| Site | Residue | pLDDT | pLDDT confidence | pLDDT10 | pLDDT10 confidence | SASA | SASA [Ų] | SASA10 | SASA10 [Ų] | RSA | RSA unformatted | RSA10 | RSA10 unformatted | Surface | Surface10 (not used) | Disorder (not used) | Disorder | Sec. str. | Secondary structure | Isomer | Phi (φ) | Psi (ψ) | Omega (ω) | Chi 1 (χ1) | Chi 2 (χ2) | Chi 3 (χ3) | Chi 4 (χ4) | Chi 5 (χ5) | Tau (τ) | Contacts (colored by PAE) | Contact details |
|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|
| 1 | M | 35.3 | Very low | 41 | Very low | 229 Ų | 229 | 146.5 Ų | 146.5 | 100% | 1.128 | 79% | 0.787 | S | S | * | * | 0 | 134.9 | 0 | -67.7 | 160.3 | 67.7 | 0 | 0 | 106.8 | |||||
| 2 | S | 38.3 | Very low | 41 | Very low | 134 Ų | 134 | 150.7 Ų | 150.7 | 94% | 0.937 | 79% | 0.786 | S | S | * | * | trans | 54.6 | 148.3 | 176.3 | 45.7 | 0 | 0 | 0 | 0 | 117 | ||||
| 3 | G | 35.2 | Very low | 40.4 | Very low | 72 Ų | 72 | 154 Ų | 154 | 74% | 0.742 | 80% | 0.795 | S | S | * | * | cis | -161.5 | -174.6 | -0.7 | 0 | 0 | 0 | 0 | 0 | 110.3 | ||||
| 4 | F | 40.7 | Very low | 40.4 | Very low | 185 Ų | 185 | 150.2 Ų | 150.2 | 81% | 0.811 | 79% | 0.789 | S | S | * | * | trans | -88.7 | -166.7 | -176.8 | -119.1 | -116 | 0 | 0 | 0 | 112 | ||||
| 5 | D | 40.6 | Very low | 40.1 | Very low | 134 Ų | 134 | 146.8 Ų | 146.8 | 72% | 0.717 | 78% | 0.782 | S | S | * | * | trans | 82.3 | 81.6 | 156 | -48.9 | -46.5 | 0 | 0 | 0 | 119.3 | ||||
| 6 | N | 44.2 | Very low | 39.8 | Very low | 153 Ų | 153 | 151.2 Ų | 151.2 | 82% | 0.818 | 79% | 0.786 | S | S | * | * | -163.4 | 97.1 | 103.9 | -110.9 | -90.5 | 0 | 0 | 0 | 112.8 | N8 | N6-N8 PolarHBondContact O-N 3.22Š| |||
| 7 | F | 42.8 | Very low | 39.7 | Very low | 194 Ų | 194 | 148.4 Ų | 148.4 | 85% | 0.851 | 78% | 0.783 | S | S | * | * | trans | -85.4 | 93.4 | 154.8 | -90.1 | -96.6 | 0 | 0 | 0 | 107.8 | T9 | F7-T9 PolarHBondContact O-N 3.12Å; F7-T9 PolarHBondContact O-OG1 3.49Å; F7-T9 VanDerWaalsContact O-OG1 3.12Å | ||
| 8 | N | 43.9 | Very low | 39.7 | Very low | 117 Ų | 117 | 147 Ų | 147 | 63% | 0.626 | 78% | 0.781 | S | S | * | * | trans | -62.8 | 136.1 | 165.3 | 167.8 | -87.4 | 0 | 0 | 0 | 108.8 | N6 D10 | N6-N8 PolarHBondContact O-N 3.22Å; N8-D10 PolarHBondContact ND2-OD2 3.05Å; N8-D10 PolarHBondContact OD1-OD2 3.4Å | ||
| 9 | T | 45.3 | Very low | 39.7 | Very low | 98 Ų | 98 | 147.1 Ų | 147.1 | 60% | 0.601 | 78% | 0.782 | S | S | * | * | trans | -133.2 | 70.5 | -168.7 | -53.5 | 0 | 0 | 0 | 0 | 109.7 | F7 F11 | F7-T9 PolarHBondContact O-N 3.12Å; F7-T9 PolarHBondContact O-OG1 3.49Å; F7-T9 VanDerWaalsContact O-OG1 3.12Å; T9-F11 VanDerWaalsContact O-CB 3.28Å; T9-F11 WeakPolarHBondContact O-CB 3.28Å | ||
| 10 | D | 42.4 | Very low | 39.7 | Very low | 134 Ų | 134 | 147.2 Ų | 147.2 | 72% | 0.717 | 78% | 0.782 | S | S | * | * | trans | -112.6 | 83.7 | 170.5 | -62.7 | -49.1 | 0 | 0 | 0 | 107.3 | N8 | N8-D10 PolarHBondContact ND2-OD2 3.05Å; N8-D10 PolarHBondContact OD1-OD2 3.4Å | ||
| 11 | F | 42.3 | Very low | 39.6 | Very low | 162 Ų | 162 | 149.5 Ų | 149.5 | 71% | 0.711 | 79% | 0.789 | S | S | * | * | 62.2 | 70.9 | 50.3 | -141.8 | -97.6 | 0 | 0 | 0 | 113.4 | T9 | T9-F11 VanDerWaalsContact O-CB 3.28Å; T9-F11 WeakPolarHBondContact O-CB 3.28Å | |||
| 12 | Y | 40.3 | Very low | 39.5 | Very low | 196 Ų | 196 | 141.7 Ų | 141.7 | 77% | 0.769 | 77% | 0.766 | S | S | * | * | trans | 67.7 | 99.7 | 170.4 | -61.6 | -93.6 | 0 | 0 | 0 | 117.7 | ||||
| 13 | Q | 33.9 | Very low | 39.4 | Very low | 194 Ų | 194 | 144.3 Ų | 144.3 | 91% | 0.907 | 76% | 0.764 | S | S | * | * | trans | -133.2 | 106.1 | 137.8 | -156 | 173 | 36.7 | 0 | 0 | 110.5 | ||||
| 14 | S | 39.7 | Very low | 39.9 | Very low | 101 Ų | 101 | 146.5 Ų | 146.5 | 71% | 0.706 | 77% | 0.765 | S | S | * | * | trans | -93.6 | 109.5 | 179.6 | 52.8 | 0 | 0 | 0 | 0 | 110.9 | ||||
| 15 | S | 36.7 | Very low | 39.5 | Very low | 99 Ų | 99 | 142.7 Ų | 142.7 | 69% | 0.692 | 77% | 0.768 | S | S | * | * | trans | -128.3 | 82.3 | 174 | 55 | 0 | 0 | 0 | 0 | 110.4 | S17 | S15-S17 PolarHBondContact O-N 3.36Š| ||
| 16 | Y | 35.3 | Very low | 39 | Very low | 217 Ų | 217 | 139.2 Ų | 139.2 | 85% | 0.851 | 76% | 0.764 | S | S | * | * | trans | -75.4 | 97.6 | 168.4 | -81.6 | -90.2 | 0 | 0 | 0 | 109.4 | ||||
| 17 | S | 37.8 | Very low | 38.3 | Very low | 103 Ų | 103 | 143.8 Ų | 143.8 | 72% | 0.72 | 77% | 0.771 | S | S | * | * | trans | -87.1 | 113.4 | 161.1 | -58.6 | 0 | 0 | 0 | 0 | 108.4 | S15 | S15-S17 PolarHBondContact O-N 3.36Š| ||
| 18 | V | 39.9 | Very low | 37.6 | Very low | 124 Ų | 124 | 137.8 Ų | 137.8 | 75% | 0.752 | 76% | 0.764 | S | S | * | * | trans | -105.1 | 91.9 | 171.3 | -179.5 | 0 | 0 | 0 | 0 | 107.7 | D20 | V18-D20 PolarHBondContact O-N 3.39Š| ||
| 19 | D | 40.1 | Very low | 36.9 | Very low | 149 Ų | 149 | 143.8 Ų | 143.8 | 80% | 0.797 | 78% | 0.78 | S | S | * | * | trans | -77.8 | 111.8 | 169.1 | -71.4 | -71.8 | 0 | 0 | 0 | 109.2 | ||||
| 20 | D | 39.5 | Very low | 36.1 | Very low | 148 Ų | 148 | 144 Ų | 144 | 79% | 0.791 | 79% | 0.785 | S | S | * | * | trans | -78.9 | 134.2 | -176.3 | -171.3 | -109.9 | 0 | 0 | 0 | 112.4 | V18 G22 | V18-D20 PolarHBondContact O-N 3.39Å; D20-G22 PolarHBondContact O-N 2.96Å | ||
| 21 | Q | 37.5 | Very low | 35.4 | Very low | 197 Ų | 197 | 145.3 Ų | 145.3 | 92% | 0.921 | 79% | 0.792 | S | S | * | * | trans | -91.4 | 90 | 179.8 | -75.9 | -167.7 | -26.1 | 0 | 0 | 112 | ||||
| 22 | G | 33.3 | Very low | 35 | Very low | 64 Ų | 64 | 143.6 Ų | 143.6 | 66% | 0.66 | 80% | 0.795 | S | S | * | * | trans | -123.7 | 107.9 | 176.7 | 0 | 0 | 0 | 0 | 0 | 114.9 | D20 | D20-G22 PolarHBondContact O-N 2.96Š| ||
| 23 | Q | 35.6 | Very low | 34.6 | Very low | 189 Ų | 189 | 142.2 Ų | 142.2 | 88% | 0.883 | 80% | 0.796 | S | S | * | * | trans | -153.7 | 157.9 | 166.6 | -97.4 | -165 | 0.3 | 0 | 0 | 110.6 | ||||
| 24 | P | 46.4 | Very low | 34.3 | Very low | 118 Ų | 118 | 140 Ų | 140 | 77% | 0.766 | 79% | 0.79 | S | S | * | * | cis | -127.8 | -168.1 | 1.6 | 40.7 | -24 | 0 | 0 | 0 | 115 | ||||
| 25 | A | 32.4 | Very low | 34.7 | Very low | 105 Ų | 105 | 138.3 Ų | 138.3 | 87% | 0.868 | 78% | 0.776 | S | S | * | * | trans | -52.6 | 169 | 176.2 | 0 | 0 | 0 | 0 | 0 | 116.3 | ||||
| 26 | G | 29.6 | Very low | 34.2 | Very low | 61 Ų | 61 | 143.2 Ų | 143.2 | 63% | 0.629 | 78% | 0.781 | S | S | * | * | cis | 163.8 | -158.6 | 2.4 | 0 | 0 | 0 | 0 | 0 | 112.5 | ||||
| 27 | Y | 29.8 | Very low | 34.1 | Very low | 249 Ų | 249 | 141.8 Ų | 141.8 | 98% | 0.976 | 78% | 0.78 | S | S | * | * | trans | 69 | 133 | -166.7 | -60.4 | -93.1 | 0 | 0 | 0 | 114.7 | ||||
| 28 | G | 27.8 | Very low | 33.7 | Very low | 68 Ų | 68 | 145.5 Ų | 145.5 | 70% | 0.701 | 79% | 0.785 | S | S | * | * | cis | 146.6 | 133.3 | -15.2 | 0 | 0 | 0 | 0 | 0 | 114.2 | ||||
| 29 | Y | 28.8 | Very low | 33.2 | Very low | 244 Ų | 244 | 143.2 Ų | 143.2 | 96% | 0.957 | 79% | 0.787 | S | S | * | * | trans | -162.3 | 165.2 | 151.3 | -129.5 | -93.3 | 0 | 0 | 0 | 110.6 | ||||
| 30 | S | 29.7 | Very low | 32.6 | Very low | 103 Ų | 103 | 144.6 Ų | 144.6 | 72% | 0.72 | 79% | 0.789 | S | S | * | * | trans | -110.4 | 160 | -164.8 | 54.4 | 0 | 0 | 0 | 0 | 116.1 | ||||
| 31 | N | 28 | Very low | 32.1 | Very low | 160 Ų | 160 | 148.4 Ų | 148.4 | 86% | 0.856 | 79% | 0.793 | S | S | * | * | trans | -40.6 | 159.6 | 179 | -77.2 | -31 | 0 | 0 | 0 | 118.3 | ||||
| 32 | T | 32.4 | Very low | 31.6 | Very low | 126 Ų | 126 | 146 Ų | 146 | 77% | 0.773 | 79% | 0.787 | S | S | * | * | trans | -143.8 | 152.3 | 148.6 | -49.5 | 0 | 0 | 0 | 0 | 108.3 | ||||
| 33 | E | 31.8 | Very low | 31.5 | Very low | 167 Ų | 167 | 153.5 Ų | 153.5 | 78% | 0.78 | 80% | 0.797 | S | S | * | * | trans | -75.1 | 134.7 | -161.7 | -59.9 | 99 | 112.3 | 0 | 0 | 117.4 | ||||
| 34 | D | 28.6 | Very low | 31.3 | Very low | 149 Ų | 149 | 149.5 Ų | 149.5 | 80% | 0.797 | 79% | 0.79 | S | S | * | * | 51.7 | 171.8 | 112.3 | -134.4 | 19 | 0 | 0 | 0 | 120.2 | |||||
| 35 | P | 47.1 | Very low | 30.9 | Very low | 64 Ų | 64 | 152 Ų | 152 | 42% | 0.416 | 79% | 0.791 | S | S | . | * | cis | -129.1 | -169.6 | -26.9 | 9.9 | 16.8 | 0 | 0 | 0 | 116 | ||||
| 36 | Y | 28.1 | Very low | 31.5 | Very low | 202 Ų | 202 | 152.4 Ų | 152.4 | 79% | 0.792 | 79% | 0.785 | S | S | * | * | trans | 62.8 | 108.3 | 153.3 | 37.7 | -126.1 | 0 | 0 | 0 | 125.6 | ||||
| 37 | K | 32.2 | Very low | 31.6 | Very low | 188 Ų | 188 | 157.6 Ų | 157.6 | 82% | 0.817 | 80% | 0.795 | S | S | * | * | -178.6 | 123.5 | 114.3 | -96.5 | 168.2 | -177.3 | 177.5 | 0 | 110.6 | |||||
| 38 | Q | 29 | Very low | 31.7 | Very low | 180 Ų | 180 | 149.4 Ų | 149.4 | 84% | 0.841 | 79% | 0.786 | S | S | * | * | 57.6 | 113.4 | 85.8 | -167.7 | -176.8 | 25.3 | 0 | 0 | 113.9 | |||||
| 39 | G | 29.3 | Very low | 32 | Very low | 76 Ų | 76 | 157.1 Ų | 157.1 | 78% | 0.784 | 80% | 0.796 | S | S | * | * | cis | 130.6 | 101.6 | -9.6 | 0 | 0 | 0 | 0 | 0 | 114.2 | ||||
| 40 | Q | 28 | Very low | 32.2 | Very low | 179 Ų | 179 | 151 Ų | 151 | 84% | 0.836 | 79% | 0.789 | S | S | * | * | trans | -159.7 | 149.1 | 166.6 | -166.6 | 164.1 | -5.8 | 0 | 0 | 111.4 | ||||
| 41 | Y | 29 | Very low | 32.5 | Very low | 227 Ų | 227 | 150.8 Ų | 150.8 | 89% | 0.89 | 79% | 0.793 | S | S | * | * | trans | -122.5 | 152.6 | 170.2 | -53 | -92.7 | 0 | 0 | 0 | 109 | ||||
| 42 | D | 26.7 | Very low | 33.5 | Very low | 147 Ų | 147 | 149.5 Ų | 149.5 | 79% | 0.786 | 79% | 0.794 | S | S | * | * | trans | -149.8 | 158.1 | 157.9 | -155.4 | -79.7 | 0 | 0 | 0 | 110.2 | ||||
| 43 | Y | 30.9 | Very low | 33.4 | Very low | 221 Ų | 221 | 147 Ų | 147 | 87% | 0.867 | 79% | 0.793 | S | S | * | * | trans | -156.2 | 109.6 | -170.2 | -176.7 | -81.2 | 0 | 0 | 0 | 110.6 | ||||
| 44 | S | 32.8 | Very low | 33.6 | Very low | 105 Ų | 105 | 148.3 Ų | 148.3 | 73% | 0.734 | 80% | 0.802 | S | S | * | * | trans | -156.5 | 113.5 | 167.5 | 61.9 | 0 | 0 | 0 | 0 | 114.2 | ||||
| 45 | Q | 37.6 | Very low | 33.9 | Very low | 171 Ų | 171 | 149.5 Ų | 149.5 | 80% | 0.799 | 80% | 0.804 | S | S | * | * | trans | -90.3 | 157.2 | 147.1 | -109.1 | -166.2 | 53.8 | 0 | 0 | 107.7 | ||||
| 46 | P | 43.7 | Very low | 33.5 | Very low | 113 Ų | 113 | 154.6 Ų | 154.6 | 73% | 0.734 | 82% | 0.822 | S | S | * | * | -158.3 | 162.1 | 76.2 | 41.6 | -20.9 | 0 | 0 | 0 | 119.6 | |||||
| 47 | M | 33.4 | Very low | 34.3 | Very low | 171 Ų | 171 | 150.1 Ų | 150.1 | 84% | 0.842 | 82% | 0.818 | S | S | * | * | trans | 41.9 | 127.9 | 139.3 | -66.8 | -74.1 | -81 | 0 | 0 | 122.6 | ||||
| 48 | G | 30.6 | Very low | 34.3 | Very low | 77 Ų | 77 | 149 Ų | 149 | 79% | 0.794 | 82% | 0.816 | S | S | * | * | trans | -171 | 135.5 | 157.8 | 0 | 0 | 0 | 0 | 0 | 112.9 | ||||
| 49 | Y | 35.6 | Very low | 34.9 | Very low | 229 Ų | 229 | 147.9 Ų | 147.9 | 90% | 0.898 | 81% | 0.811 | S | S | * | * | trans | -135.6 | 127.8 | -175.8 | -125.8 | -80.8 | 0 | 0 | 0 | 109.9 | ||||
| 50 | S | 31.5 | Very low | 35.7 | Very low | 115 Ų | 115 | 149.2 Ų | 149.2 | 80% | 0.804 | 81% | 0.805 | S | S | * | * | trans | 175.6 | 132.5 | 147.7 | 34.7 | 0 | 0 | 0 | 0 | 115.9 | ||||
| 51 | A | 37.1 | Very low | 35.9 | Very low | 99 Ų | 99 | 150.9 Ų | 150.9 | 82% | 0.818 | 81% | 0.806 | S | S | * | * | trans | 62 | 156.9 | 139.5 | 0 | 0 | 0 | 0 | 0 | 122.3 | ||||
| 52 | P | 48.1 | Very low | 36.3 | Very low | 134 Ų | 134 | 146 Ų | 146 | 87% | 0.87 | 80% | 0.8 | S | S | * | * | trans | -111 | 163 | -169.4 | 41.4 | -33.3 | 0 | 0 | 0 | 115.4 | ||||
| 53 | G | 30.8 | Very low | 36.7 | Very low | 73 Ų | 73 | 141.5 Ų | 141.5 | 75% | 0.753 | 79% | 0.788 | S | S | * | * | trans | 159.2 | 122.7 | 161.5 | 0 | 0 | 0 | 0 | 0 | 113.9 | ||||
| 54 | M | 35.2 | Very low | 37.2 | Very low | 195 Ų | 195 | 139.5 Ų | 139.5 | 96% | 0.961 | 79% | 0.786 | S | S | * | * | trans | -145.9 | 135 | 174.2 | -60.2 | -176.4 | -172.9 | 0 | 0 | 110 | ||||
| 55 | M | 36.4 | Very low | 37.8 | Very low | 174 Ų | 174 | 140.6 Ų | 140.6 | 86% | 0.857 | 78% | 0.783 | S | S | * | * | trans | -148.2 | 136.6 | -177.1 | -93.8 | -167.4 | 170.5 | 0 | 0 | 113.1 | ||||
| 56 | Q | 37.5 | Very low | 37.7 | Very low | 170 Ų | 170 | 143.5 Ų | 143.5 | 79% | 0.794 | 79% | 0.788 | S | S | * | * | trans | 69.1 | 162.9 | 152.9 | -66.6 | -175 | 1.8 | 0 | 0 | 118.5 | ||||
| 57 | P | 45.1 | Very low | 37.3 | Very low | 108 Ų | 108 | 146.7 Ų | 146.7 | 70% | 0.701 | 79% | 0.793 | S | S | * | * | cis | -129.6 | 151.6 | 5.4 | 36.7 | -18.9 | 0 | 0 | 0 | 119.1 | ||||
| 58 | Q | 32.8 | Very low | 37.8 | Very low | 164 Ų | 164 | 144 Ų | 144 | 77% | 0.766 | 79% | 0.788 | S | S | * | * | trans | 20.7 | 143.8 | 144.8 | -54.1 | 178.7 | -43.3 | 0 | 0 | 124.9 | ||||
| 59 | Q | 40.1 | Very low | 38.1 | Very low | 158 Ų | 158 | 146.4 Ų | 146.4 | 74% | 0.738 | 79% | 0.788 | S | S | * | * | -177.7 | 168.3 | 113.2 | -89.9 | -44.1 | -70.7 | 0 | 0 | 110.6 | |||||
| 60 | P | 46.7 | Very low | 38.8 | Very low | 103 Ų | 103 | 141.3 Ų | 141.3 | 67% | 0.669 | 78% | 0.783 | S | S | * | * | trans | -138.6 | 172.1 | -138 | 44.7 | -28.3 | 0 | 0 | 0 | 120.8 | ||||
| 61 | Y | 33.7 | Very low | 39.3 | Very low | 214 Ų | 214 | 140.1 Ų | 140.1 | 84% | 0.839 | 78% | 0.78 | S | S | * | * | trans | 70.1 | 156.8 | 156 | -131.6 | -127 | 0 | 0 | 0 | 117.7 | ||||
| 62 | T | 35.9 | Very low | 39.1 | Very low | 125 Ų | 125 | 145.2 Ų | 145.2 | 77% | 0.767 | 78% | 0.784 | S | S | * | * | cis | -105.2 | -148.7 | 8.6 | 64.1 | 0 | 0 | 0 | 0 | 112.2 | ||||
| 63 | G | 35.5 | Very low | 38.8 | Very low | 52 Ų | 52 | 144.6 Ų | 144.6 | 54% | 0.536 | 78% | 0.778 | S | S | . | * | cis | 176.4 | 170.7 | 2.7 | 0 | 0 | 0 | 0 | 0 | 111.1 | ||||
| 64 | Q | 40.4 | Very low | 39.4 | Very low | 179 Ų | 179 | 147.2 Ų | 147.2 | 84% | 0.836 | 78% | 0.781 | S | S | * | * | trans | -148.5 | 145.1 | -175.7 | -78 | -159.1 | -6.9 | 0 | 0 | 118.8 | ||||
| 65 | I | 46.5 | Very low | 39.8 | Very low | 128 Ų | 128 | 143 Ų | 143 | 66% | 0.656 | 77% | 0.772 | S | S | * | * | trans | 38.6 | 127.1 | 136.9 | -51.5 | 171.2 | 0 | 0 | 0 | 120.1 | ||||
| 66 | Y | 35 | Very low | 40.2 | Very low | 233 Ų | 233 | 140.7 Ų | 140.7 | 91% | 0.914 | 77% | 0.769 | S | S | * | * | trans | 176.2 | -174.8 | 130.8 | -105.6 | -74.6 | 0 | 0 | 0 | 112.9 | ||||
| 67 | Q | 35.5 | Very low | 40.4 | Very low | 180 Ų | 180 | 138.3 Ų | 138.3 | 84% | 0.841 | 77% | 0.766 | S | S | * | * | trans | -154.1 | 164.3 | -166.9 | -150.9 | 159.5 | 22.6 | 0 | 0 | 108 | ||||
| 68 | P | 45 | Very low | 40.1 | Very low | 114 Ų | 114 | 141.9 Ų | 141.9 | 74% | 0.74 | 77% | 0.774 | S | S | * | * | cis | -150.8 | -144.1 | 31 | 47 | -22.9 | 0 | 0 | 0 | 117.1 | ||||
| 69 | T | 35.9 | Very low | 40.5 | Very low | 127 Ų | 127 | 138.8 Ų | 138.8 | 78% | 0.779 | 77% | 0.77 | S | S | * | * | trans | -60.7 | 171.8 | 172.4 | 15.1 | 0 | 0 | 0 | 0 | 114.9 | ||||
| 70 | P | 50.6 | Low | 40.2 | Very low | 123 Ų | 123 | 139.9 Ų | 139.9 | 80% | 0.799 | 78% | 0.778 | S | S | * | * | cis | -139.3 | -175 | 18.4 | 43.7 | -24.1 | 0 | 0 | 0 | 119 | ||||
| 71 | A | 41.5 | Very low | 39.5 | Very low | 90 Ų | 90 | 145.7 Ų | 145.7 | 74% | 0.744 | 79% | 0.788 | S | S | * | * | trans | -47.8 | 160.9 | -177.9 | 0 | 0 | 0 | 0 | 0 | 122 | ||||
| 72 | F | 34 | Very low | 39.6 | Very low | 206 Ų | 206 | 138.7 Ų | 138.7 | 90% | 0.904 | 78% | 0.781 | S | S | * | * | trans | -162.9 | 159.5 | 132.5 | -130.1 | -98.5 | 0 | 0 | 0 | 113.1 | ||||
| 73 | T | 40.5 | Very low | 39.5 | Very low | 121 Ų | 121 | 138.4 Ų | 138.4 | 74% | 0.742 | 78% | 0.784 | S | S | * | * | trans | -132 | 154.7 | 172.2 | 53.9 | 0 | 0 | 0 | 0 | 110.3 | ||||
| 74 | P | 44.4 | Very low | 39.7 | Very low | 127 Ų | 127 | 139.3 Ų | 139.3 | 83% | 0.825 | 78% | 0.782 | S | S | * | * | -152.8 | 170.2 | 97.7 | 39.5 | -21.3 | 0 | 0 | 0 | 116.4 | |||||
| 75 | S | 42.4 | Very low | 39.6 | Very low | 108 Ų | 108 | 140.8 Ų | 140.8 | 76% | 0.755 | 79% | 0.786 | S | S | * | * | trans | -81.3 | 170.2 | 172.4 | -39.3 | 0 | 0 | 0 | 0 | 112.7 | ||||
| 76 | P | 45.9 | Very low | 39.5 | Very low | 124 Ų | 124 | 141.1 Ų | 141.1 | 81% | 0.805 | 79% | 0.789 | S | S | * | * | -146.1 | 154.7 | 84.8 | 37.6 | -19.9 | 0 | 0 | 0 | 117.9 | |||||
| 77 | T | 41.6 | Very low | 40.2 | Very low | 120 Ų | 120 | 137.4 Ų | 137.4 | 74% | 0.736 | 79% | 0.785 | S | S | * | * | trans | -38.1 | 143.3 | 170.7 | 53 | 0 | 0 | 0 | 0 | 119.4 | ||||
| 78 | Q | 38 | Very low | 40.6 | Very low | 183 Ų | 183 | 135.9 Ų | 135.9 | 86% | 0.855 | 78% | 0.778 | S | S | * | * | 173.1 | 141.9 | 113.4 | -93 | 176.2 | 15.5 | 0 | 0 | 109.5 | |||||
| 79 | S | 42.5 | Very low | 40.8 | Very low | 99 Ų | 99 | 134.6 Ų | 134.6 | 69% | 0.692 | 77% | 0.769 | S | S | * | * | cis | 162.4 | 109.3 | -23.1 | 46.5 | 0 | 0 | 0 | 0 | 106.3 | ||||
| 80 | M | 33.8 | Very low | 41.4 | Very low | 182 Ų | 182 | 132.9 Ų | 132.9 | 90% | 0.897 | 76% | 0.761 | S | S | * | * | trans | -154.6 | 109.3 | 168.8 | -160.8 | 62.7 | 173.5 | 0 | 0 | 113.1 | ||||
| 81 | Y | 31.9 | Very low | 41.1 | Very low | 225 Ų | 225 | 133.1 Ų | 133.1 | 88% | 0.882 | 75% | 0.754 | S | S | * | * | trans | 34 | 93 | 149.6 | -113.2 | -96.5 | 0 | 0 | 0 | 121.2 | ||||
| 82 | G | 35.9 | Very low | 41.4 | Very low | 67 Ų | 67 | 133.7 Ų | 133.7 | 69% | 0.691 | 75% | 0.745 | S | S | * | * | trans | 86.4 | 171.3 | 130 | 0 | 0 | 0 | 0 | 0 | 120.2 | ||||
| 83 | S | 33.4 | Very low | 42.1 | Very low | 119 Ų | 119 | 130.3 Ų | 130.3 | 83% | 0.832 | 73% | 0.732 | S | S | * | * | trans | 80.6 | 128.2 | 178.7 | -29.4 | 0 | 0 | 0 | 0 | 116.9 | ||||
| 84 | S | 39.9 | Very low | 42.5 | Very low | 71 Ų | 71 | 132.6 Ų | 132.6 | 50% | 0.497 | 73% | 0.734 | S | S | . | * | trans | 63.8 | 79.1 | 145.7 | -54.7 | 0 | 0 | 0 | 0 | 120.8 | D86 | S84-D86 VanDerWaalsContact CA-OD2 3.28Å; S84-D86 WeakPolarHBondContact CA-OD2 3.32Å; S84-D86 PolarHBondContact O-N 3.4Å; S84-D86 PolarHBondContact OG-OD2 3.31Å | ||
| 85 | F | 38.1 | Very low | 42.9 | Very low | 209 Ų | 209 | 133 Ų | 133 | 92% | 0.917 | 73% | 0.728 | S | S | * | * | S | Bend | trans | -78.9 | 38 | 131.3 | -77.9 | -88.1 | 0 | 0 | 0 | 110.7 | ||
| 86 | D | 43 | Very low | 43.3 | Very low | 136 Ų | 136 | 130.9 Ų | 130.9 | 73% | 0.727 | 72% | 0.724 | S | S | * | * | trans | -109 | -6.5 | 179.9 | -60.5 | -77.4 | 0 | 0 | 0 | 112 | S84 | S84-D86 VanDerWaalsContact CA-OD2 3.28Å; S84-D86 WeakPolarHBondContact CA-OD2 3.32Å; S84-D86 PolarHBondContact O-N 3.4Å; S84-D86 PolarHBondContact OG-OD2 3.31Å | ||
| 87 | D | 50.9 | Low | 43.7 | Very low | 154 Ų | 154 | 129.6 Ų | 129.6 | 82% | 0.824 | 71% | 0.709 | S | S | * | * | S | Bend | trans | -109.1 | 21.8 | -172.9 | -127.9 | -27.8 | 0 | 0 | 0 | 112.2 | ||
| 88 | E | 43.5 | Very low | 44.4 | Very low | 149 Ų | 149 | 127.6 Ų | 127.6 | 70% | 0.696 | 69% | 0.694 | S | S | * | * | S | Bend | trans | -122.3 | 108.2 | 166.9 | -174.8 | 169.3 | -145 | 0 | 0 | 107.7 | ||
| 89 | P | 50.1 | Low | 45.2 | Very low | 86 Ų | 86 | 126.3 Ų | 126.3 | 56% | 0.558 | 69% | 0.686 | S | S | * | * | trans | -64 | 132.1 | 179.9 | 25.9 | -32.9 | 0 | 0 | 0 | 109.4 | ||||
| 90 | P | 47.8 | Very low | 45.7 | Very low | 92 Ų | 92 | 126.8 Ų | 126.8 | 60% | 0.597 | 68% | 0.681 | S | S | * | * | trans | -65.3 | 145.5 | -170.1 | 25.4 | -34.3 | 0 | 0 | 0 | 111.8 | L92 E93 | P90-L92 PolarHBondContact O-N 3.13Å; P90-E93 PolarHBondContact O-N 3.38Å | ||
| 91 | L | 43.4 | Very low | 46.2 | Very low | 127 Ų | 127 | 123.7 Ų | 123.7 | 67% | 0.665 | 66% | 0.664 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -67.3 | 28 | -179.5 | -58.6 | 173.4 | 0 | 0 | 0 | 114.7 | ||
| 92 | L | 47.5 | Very low | 47.3 | Very low | 103 Ų | 103 | 117.2 Ų | 117.2 | 54% | 0.539 | 64% | 0.644 | S | S | . | * | T | Hydrogen-bonded Turn | trans | -111.7 | -10.2 | 167.1 | -63.4 | 176.3 | 0 | 0 | 0 | 112 | P90 L95 G96 | P90-L92 PolarHBondContact O-N 3.13Å; L92-L95 CarbonylContact O-C 3.52Å; L92-G96 PolarHBondContact O-N 3.31Å; L92-G96 VanDerWaalsContact O-N 3.17Å |
| 93 | E | 49.4 | Very low | 48.1 | Very low | 135 Ų | 135 | 121.6 Ų | 121.6 | 63% | 0.631 | 64% | 0.639 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -74 | -40.9 | 162.6 | -170.4 | 156.8 | -157.7 | 0 | 0 | 110.5 | P90 L95 G96 | P90-E93 PolarHBondContact O-N 3.38Å; E93-L95 VanDerWaalsContact C-N 3.28Å; E93-L95 PolarHBondContact O-N 3.11Å; E93-G96 PolarHBondContact O-N 2.84Å |
| 94 | E | 49 | Very low | 48.8 | Very low | 168 Ų | 168 | 121 Ų | 121 | 79% | 0.785 | 62% | 0.623 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -69.4 | -23.3 | 170 | -168.5 | 170 | -159.3 | 0 | 0 | 112.9 | ||
| 95 | L | 53.5 | Low | 49.2 | Very low | 135 Ų | 135 | 124.6 Ų | 124.6 | 71% | 0.707 | 63% | 0.63 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -103.6 | 25.6 | 174.1 | -147.5 | 72 | 0 | 0 | 0 | 114.4 | L92 E93 I97 | L92-L95 CarbonylContact O-C 3.52Å; E93-L95 VanDerWaalsContact C-N 3.28Å; E93-L95 PolarHBondContact O-N 3.11Å; L95-I97 VanDerWaalsContact C-N 3.29Å; L95-I97 PolarHBondContact O-N 3.46Å |
| 96 | G | 50.2 | Low | 49.8 | Very low | 65 Ų | 65 | 117 Ų | 117 | 67% | 0.67 | 60% | 0.601 | S | S | * | * | T | Hydrogen-bonded Turn | trans | 69.6 | -5.5 | 147.5 | 0 | 0 | 0 | 0 | 0 | 119.8 | L92 E93 | L92-G96 PolarHBondContact O-N 3.31Å; L92-G96 VanDerWaalsContact O-N 3.17Å; E93-G96 PolarHBondContact O-N 2.84Å |
| 97 | I | 54.6 | Low | 50 | Low | 96 Ų | 96 | 114.9 Ų | 114.9 | 49% | 0.492 | 59% | 0.589 | S | S | . | * | trans | -126.3 | 97.3 | -179.5 | -67.6 | -174.9 | 0 | 0 | 0 | 111.4 | L95 F99 | L95-I97 VanDerWaalsContact C-N 3.29Å; L95-I97 PolarHBondContact O-N 3.46Å; I97-F99 HydrophobicContact CG2-CD1 3.97Å; I97-F99 HydrophobicContact CG2-CD2 3.62Å; I97-F99 HydrophobicContact CG2-CE1 3.76Å; I97-F99 HydrophobicContact CG2-CE2 3.39Å; I97-F99 HydrophobicContact CG2-CG 3.91Å; I97-F99 HydrophobicContact CG2-CZ 3.46Å; I97-F99 VanDerWaalsContact CG2-CZ 3.46Å | ||
| 98 | N | 56.3 | Low | 49.8 | Very low | 78 Ų | 78 | 112.4 Ų | 112.4 | 42% | 0.417 | 58% | 0.579 | S | S | . | * | trans | -103 | 92.3 | 163.6 | -87.1 | -71.4 | 0 | 0 | 0 | 109.3 | D100 H101 I102 | N98-D100 VanDerWaalsContact C-N 3.26Å; N98-D100 PolarHBondContact O-N 2.97Å; N98-H101 HydrophobicContact CB-CB 4.17Å; N98-H101 PolarHBondContact O-N 3.21Å; N98-H101 VanDerWaalsContact O-N 3.1Å; N98-I102 PolarHBondContact O-N 3.46Å; N98-I102 VanDerWaalsContact O-N 3.17Å | ||
| 99 | F | 54.7 | Low | 49.7 | Very low | 156 Ų | 156 | 109.5 Ų | 109.5 | 68% | 0.684 | 57% | 0.572 | S | S | * | * | H | α-helix | trans | -57.5 | -34.7 | -176.1 | -75.8 | -67.8 | 0 | 0 | 0 | 113.5 | I97 I102 W103 | I97-F99 HydrophobicContact CG2-CD1 3.97Å; I97-F99 HydrophobicContact CG2-CD2 3.62Å; I97-F99 HydrophobicContact CG2-CE1 3.76Å; I97-F99 HydrophobicContact CG2-CE2 3.39Å; I97-F99 HydrophobicContact CG2-CG 3.91Å; I97-F99 HydrophobicContact CG2-CZ 3.46Å; I97-F99 VanDerWaalsContact CG2-CZ 3.46Å; F99-I102 PolarHBondContact O-N 2.79Å; F99-W103 WeakPolarHBondContact O-CB 3.29Å; F99-W103 PolarHBondContact O-N 3.16Å |
| 100 | D | 52.2 | Low | 49.5 | Very low | 109 Ų | 109 | 108.8 Ų | 108.8 | 58% | 0.583 | 56% | 0.563 | S | S | * | * | H | α-helix | trans | -62 | -43.1 | 174.9 | -104.2 | -87.5 | 0 | 0 | 0 | 112.9 | N98 I102 W103 Q104 | N98-D100 VanDerWaalsContact C-N 3.26Å; N98-D100 PolarHBondContact O-N 2.97Å; D100-I102 VanDerWaalsContact C-N 3.3Å; D100-I102 PolarHBondContact O-N 2.9Å; D100-W103 PolarHBondContact O-N 3.33Å; D100-Q104 WeakPolarHBondContact O-CB 3.35Å; D100-Q104 VanDerWaalsContact O-CG 3.32Å; D100-Q104 WeakPolarHBondContact O-CG 3.47Å; D100-Q104 PolarHBondContact O-N 2.91Å |
| 101 | H | 45.8 | Very low | 49.3 | Very low | 117 Ų | 117 | 111 Ų | 111 | 54% | 0.542 | 57% | 0.565 | S | S | . | * | H | α-helix | trans | -69 | -28.1 | 175.7 | -94.1 | -158.1 | 0 | 0 | 0 | 112.9 | N98 K105 | N98-H101 HydrophobicContact CB-CB 4.17Å; N98-H101 PolarHBondContact O-N 3.21Å; N98-H101 VanDerWaalsContact O-N 3.1Å; H101-K105 WeakPolarHBondContact O-CB 3.47Å; H101-K105 WeakPolarHBondContact O-CD 3.48Å; H101-K105 VanDerWaalsContact O-CG 3.26Å; H101-K105 WeakPolarHBondContact O-CG 3.46Å; H101-K105 PolarHBondContact O-N 3.28Å |
| 102 | I | 53.4 | Low | 49.2 | Very low | 90 Ų | 90 | 108.9 Ų | 108.9 | 46% | 0.462 | 56% | 0.559 | S | S | . | * | H | α-helix | trans | -69.5 | -50.4 | 170.4 | -63 | 173 | 0 | 0 | 0 | 109.2 | N98 F99 D100 Q104 K105 T106 | N98-I102 PolarHBondContact O-N 3.46Å; N98-I102 VanDerWaalsContact O-N 3.17Å; F99-I102 PolarHBondContact O-N 2.79Å; D100-I102 VanDerWaalsContact C-N 3.3Å; D100-I102 PolarHBondContact O-N 2.9Å; I102-Q104 PolarHBondContact O-N 3.41Å; I102-K105 PolarHBondContact O-N 2.87Å; I102-K105 VanDerWaalsContact O-N 3.16Å; I102-T106 PolarHBondContact O-N 3.44Å; I102-T106 PolarHBondContact O-OG1 3.23Å; I102-T106 VanDerWaalsContact O-OG1 3.06Å |
| 103 | W | 52.5 | Low | 49.3 | Very low | 158 Ų | 158 | 112 Ų | 112 | 60% | 0.598 | 57% | 0.572 | S | S | * | * | H | α-helix | trans | -59.9 | -43.3 | -178.3 | -174.7 | -114.5 | 0 | 0 | 0 | 113.3 | F99 D100 T106 L107 | F99-W103 WeakPolarHBondContact O-CB 3.29Å; F99-W103 PolarHBondContact O-N 3.16Å; D100-W103 PolarHBondContact O-N 3.33Å; W103-T106 WeakPolarHBondContact O-CB 3.46Å; W103-T106 PolarHBondContact O-N 3.24Å; W103-L107 PolarHBondContact O-N 3.17Å |
| 104 | Q | 49.7 | Very low | 48.8 | Very low | 106 Ų | 106 | 113 Ų | 113 | 50% | 0.495 | 58% | 0.575 | S | S | . | * | H | α-helix | trans | -67.3 | -35.2 | 176.8 | -67.6 | 177.6 | 23 | 0 | 0 | 112.3 | D100 I102 T108 | D100-Q104 WeakPolarHBondContact O-CB 3.35Å; D100-Q104 VanDerWaalsContact O-CG 3.32Å; D100-Q104 WeakPolarHBondContact O-CG 3.47Å; D100-Q104 PolarHBondContact O-N 2.91Å; I102-Q104 PolarHBondContact O-N 3.41Å; Q104-T108 PolarHBondContact O-N 3.24Å; Q104-T108 VanDerWaalsContact O-N 3.13Å; Q104-T108 PolarHBondContact O-OG1 3.07Å |
| 105 | K | 48.7 | Very low | 48.2 | Very low | 148 Ų | 148 | 108.5 Ų | 108.5 | 64% | 0.643 | 57% | 0.567 | S | S | * | * | H | α-helix | trans | -67.8 | -40.1 | 170.7 | -74.2 | 173.5 | -178.1 | 175.1 | 0 | 111.7 | H101 I102 T108 V109 | H101-K105 WeakPolarHBondContact O-CB 3.47Å; H101-K105 WeakPolarHBondContact O-CD 3.48Å; H101-K105 VanDerWaalsContact O-CG 3.26Å; H101-K105 WeakPolarHBondContact O-CG 3.46Å; H101-K105 PolarHBondContact O-N 3.28Å; I102-K105 PolarHBondContact O-N 2.87Å; I102-K105 VanDerWaalsContact O-N 3.16Å; K105-T108 PolarHBondContact O-N 2.97Å; K105-V109 WeakPolarHBondContact O-CG2 3.48Å; K105-V109 PolarHBondContact O-N 3.34Å; K105-V109 VanDerWaalsContact O-N 3.14Å |
| 106 | T | 50.7 | Low | 47.7 | Very low | 48 Ų | 48 | 104.1 Ų | 104.1 | 29% | 0.294 | 55% | 0.549 | S | S | . | . | H | α-helix | trans | -61.2 | -46.7 | 174.9 | -59.4 | 0 | 0 | 0 | 0 | 112 | I102 W103 T108 V109 L110 L188 | I102-T106 PolarHBondContact O-N 3.44Å; I102-T106 PolarHBondContact O-OG1 3.23Å; I102-T106 VanDerWaalsContact O-OG1 3.06Å; W103-T106 WeakPolarHBondContact O-CB 3.46Å; W103-T106 PolarHBondContact O-N 3.24Å; T106-T108 VanDerWaalsContact C-N 3.3Å; T106-T108 PolarHBondContact O-N 2.71Å; T106-V109 PolarHBondContact O-N 3.23Å; T106-L110 PolarHBondContact O-N 3Å; T106-L110 VanDerWaalsContact O-N 3.16Å; T106-L188 HydrophobicContact CG2-CD1 3.73Å |
| 107 | L | 47.1 | Very low | 47.1 | Very low | 93 Ų | 93 | 106 Ų | 106 | 49% | 0.487 | 55% | 0.545 | S | S | . | . | H | α-helix | trans | -62.8 | -35.2 | 176.7 | -85.3 | 166.6 | 0 | 0 | 0 | 112.7 | W103 L110 | W103-L107 PolarHBondContact O-N 3.17Å; L107-L110 WeakPolarHBondContact O-CB 3.44Å; L107-L110 PolarHBondContact O-N 3.1Å |
| 108 | T | 45.8 | Very low | 46.8 | Very low | 101 Ų | 101 | 104.7 Ų | 104.7 | 62% | 0.62 | 55% | 0.554 | S | S | * | * | H | α-helix | trans | -68.1 | -35 | 176.9 | -54.5 | 0 | 0 | 0 | 0 | 112.1 | Q104 K105 T106 L110 H111 | Q104-T108 PolarHBondContact O-N 3.24Å; Q104-T108 VanDerWaalsContact O-N 3.13Å; Q104-T108 PolarHBondContact O-OG1 3.07Å; K105-T108 PolarHBondContact O-N 2.97Å; T106-T108 VanDerWaalsContact C-N 3.3Å; T106-T108 PolarHBondContact O-N 2.71Å; T108-L110 VanDerWaalsContact C-N 3.35Å; T108-H111 WeakPolarHBondContact O-CB 3.43Å; T108-H111 PolarHBondContact O-N 3.32Å |
| 109 | V | 41.9 | Very low | 46.1 | Very low | 88 Ų | 88 | 107.4 Ų | 107.4 | 53% | 0.533 | 57% | 0.569 | S | S | . | * | H | α-helix | trans | -79.9 | -14.1 | 178.4 | 175.2 | 0 | 0 | 0 | 0 | 113 | K105 T106 H111 K114 | K105-V109 WeakPolarHBondContact O-CG2 3.48Å; K105-V109 PolarHBondContact O-N 3.34Å; K105-V109 VanDerWaalsContact O-N 3.14Å; T106-V109 PolarHBondContact O-N 3.23Å; V109-H111 CarbonylContact C-O 3.56Å; V109-H111 PolarHBondContact O-N 3.49Å; V109-K114 HydrophobicContact CG2-CB 4.28Å; V109-K114 HydrophobicContact CG2-CD 4.17Å |
| 110 | L | 46.1 | Very low | 45.7 | Very low | 72 Ų | 72 | 105.9 Ų | 105.9 | 38% | 0.377 | 57% | 0.566 | S | S | . | * | T | Hydrogen-bonded Turn | trans | -68.2 | -20.3 | 169.8 | -160.1 | 70.5 | 0 | 0 | 0 | 112.2 | T106 L107 T108 L188 P189 | T106-L110 PolarHBondContact O-N 3Å; T106-L110 VanDerWaalsContact O-N 3.16Å; L107-L110 WeakPolarHBondContact O-CB 3.44Å; L107-L110 PolarHBondContact O-N 3.1Å; T108-L110 VanDerWaalsContact C-N 3.35Å; L110-L188 HydrophobicContact CD1-CD2 4.07Å; L110-P189 HydrophobicContact CD1-CG 4.21Å |
| 111 | H | 42.8 | Very low | 45.6 | Very low | 138 Ų | 138 | 103.7 Ų | 103.7 | 64% | 0.639 | 55% | 0.553 | S | S | * | * | S | Bend | trans | -82.5 | 139.2 | 167.5 | -145.4 | -155.6 | 0 | 0 | 0 | 109 | T108 V109 M113 | T108-H111 WeakPolarHBondContact O-CB 3.43Å; T108-H111 PolarHBondContact O-N 3.32Å; V109-H111 CarbonylContact C-O 3.56Å; V109-H111 PolarHBondContact O-N 3.49Å; H111-M113 PolarHBondContact O-N 2.88Å |
| 112 | P | 42.2 | Very low | 45.6 | Very low | 82 Ų | 82 | 104.5 Ų | 104.5 | 53% | 0.532 | 56% | 0.562 | S | S | . | * | S | Bend | trans | -80.4 | 43.3 | -165 | 35.3 | -37.5 | 0 | 0 | 0 | 113.4 | W217 | P112-W217 HydrophobicContact CB-CH2 4.42Å; P112-W217 HydrophobicContact CB-CZ2 4.2Å; P112-W217 HydrophobicContact CG-CH2 3.91Å; P112-W217 HydrophobicContact CG-CZ2 4.02Å |
| 113 | M | 47.8 | Very low | 45.5 | Very low | 168 Ų | 168 | 107.8 Ų | 107.8 | 83% | 0.828 | 58% | 0.575 | S | S | * | * | trans | -143.7 | 59.3 | -175.9 | -73 | -158.6 | 70.8 | 0 | 0 | 112.5 | H111 | H111-M113 PolarHBondContact O-N 2.88Š| ||
| 114 | K | 39.1 | Very low | 45.6 | Very low | 157 Ų | 157 | 104.8 Ų | 104.8 | 68% | 0.683 | 57% | 0.574 | S | S | * | * | trans | -123.8 | 119.6 | 143.9 | -158.5 | -179.3 | -178.3 | -167.9 | 0 | 108.8 | V109 A116 | V109-K114 HydrophobicContact CG2-CB 4.28Å; V109-K114 HydrophobicContact CG2-CD 4.17Å; K114-A116 PolarHBondContact O-N 2.96Å | ||
| 115 | A | 38 | Very low | 46.3 | Very low | 74 Ų | 74 | 104 Ų | 104 | 61% | 0.612 | 57% | 0.574 | S | S | * | * | trans | -60.6 | 136.6 | 173.7 | 0 | 0 | 0 | 0 | 0 | 109.1 | D117 | A115-D117 PolarHBondContact O-N 3.45Š| ||
| 116 | A | 41.7 | Very low | 47.2 | Very low | 42 Ų | 42 | 100.7 Ų | 100.7 | 35% | 0.347 | 56% | 0.562 | S | S | . | * | trans | -78.4 | 77.9 | 168.4 | 0 | 0 | 0 | 0 | 0 | 108 | K114 G118 I225 | K114-A116 PolarHBondContact O-N 2.96Å; A116-G118 PolarHBondContact O-N 3.31Å; A116-I225 HydrophobicContact CB-CG2 4.13Å | ||
| 117 | D | 37.4 | Very low | 48.3 | Very low | 106 Ų | 106 | 101.9 Ų | 101.9 | 57% | 0.567 | 58% | 0.577 | S | S | * | * | trans | -53.3 | 113.7 | 169.8 | -70.2 | -47.1 | 0 | 0 | 0 | 108 | A115 N119 I120 | A115-D117 PolarHBondContact O-N 3.45Å; D117-N119 PolarHBondContact O-N 3.23Å; D117-I120 HydrophobicContact CB-CG1 4.22Å; D117-I120 PolarHBondContact O-N 3.36Å | ||
| 118 | G | 48.5 | Very low | 49.8 | Very low | 67 Ų | 67 | 98.3 Ų | 98.3 | 69% | 0.691 | 56% | 0.563 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -59.9 | -11.4 | -166.8 | 0 | 0 | 0 | 0 | 0 | 115.3 | A116 | A116-G118 PolarHBondContact O-N 3.31Š|
| 119 | N | 42.6 | Very low | 51.5 | Low | 135 Ų | 135 | 94 Ų | 94 | 72% | 0.722 | 54% | 0.537 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -78 | -21.4 | 175.1 | -160.6 | 42.2 | 0 | 0 | 0 | 113.7 | D117 M121 | D117-N119 PolarHBondContact O-N 3.23Å; N119-M121 VanDerWaalsContact C-N 3.34Å |
| 120 | I | 45.6 | Very low | 53.4 | Low | 124 Ų | 124 | 94.1 Ų | 94.1 | 64% | 0.636 | 53% | 0.533 | S | S | * | . | G | 310 helix | trans | -83.6 | -10 | -177.4 | -54.5 | -60.4 | 0 | 0 | 0 | 112.2 | D117 N122 | D117-I120 HydrophobicContact CB-CG1 4.22Å; D117-I120 PolarHBondContact O-N 3.36Å; I120-N122 PolarHBondContact O-N 3.08Å |
| 121 | M | 51.1 | Low | 55.2 | Low | 64 Ų | 64 | 95.1 Ų | 95.1 | 32% | 0.315 | 54% | 0.542 | S | S | . | . | G | 310 helix | trans | -83.4 | 6.2 | 178.1 | -156.5 | 107.5 | 69.9 | 0 | 0 | 113.9 | N119 C178 V182 I225 A229 | N119-M121 VanDerWaalsContact C-N 3.34Å; M121-C178 HydrophobicContact CG-CB 4.2Å; M121-C178 VanDerWaalsContact SD-SG 3.62Å; M121-V182 HydrophobicContact CE-CG2 4.31Å; M121-V182 HydrophobicContact SD-CG2 3.93Å; M121-I225 HydrophobicContact CE-CG2 4.18Å; M121-A229 HydrophobicContact CE-CB 3.74Å |
| 122 | N | 45.7 | Very low | 57.2 | Low | 133 Ų | 133 | 91 Ų | 91 | 71% | 0.711 | 52% | 0.522 | S | S | * | . | G | 310 helix | trans | -84.3 | -28.3 | -178.5 | -158.1 | 9.2 | 0 | 0 | 0 | 112.2 | I120 T124 | I120-N122 PolarHBondContact O-N 3.08Å; N122-T124 PolarHBondContact O-N 2.93Å |
| 123 | E | 51.2 | Low | 59.3 | Low | 160 Ų | 160 | 87.9 Ų | 87.9 | 75% | 0.748 | 50% | 0.502 | S | S | * | . | S | Bend | trans | -79.7 | 110 | 173.8 | -70.3 | 177.8 | -151.5 | 0 | 0 | 109.2 | D125 | E123-D125 VanDerWaalsContact C-N 3.35Å; E123-D125 PolarHBondContact O-N 3.25Å |
| 124 | T | 53.5 | Low | 61.1 | Low | 94 Ų | 94 | 84.6 Ų | 84.6 | 58% | 0.577 | 49% | 0.487 | S | S | * | . | trans | -83.9 | 77.9 | -172.2 | -60.8 | 0 | 0 | 0 | 0 | 110.7 | N122 L126 | N122-T124 PolarHBondContact O-N 2.93Å; T124-L126 HydrophobicContact CG2-CB 4.37Å; T124-L126 PolarHBondContact O-N 3.48Å | ||
| 125 | D | 65.7 | Low | 63.4 | Low | 91 Ų | 91 | 78.9 Ų | 78.9 | 49% | 0.487 | 47% | 0.469 | S | S | . | . | trans | -69 | 45.8 | 178.1 | -79.8 | -24.7 | 0 | 0 | 0 | 114.2 | E123 A127 G128 P129 Y185 | E123-D125 VanDerWaalsContact C-N 3.35Å; E123-D125 PolarHBondContact O-N 3.25Å; D125-A127 PolarHBondContact O-N 3.36Å; D125-G128 PolarHBondContact O-N 2.98Å; D125-P129 WeakPolarHBondContact O-CD 3.23Å; D125-Y185 WeakPolarHBondContact CB-OH 3.38Å | ||
| 126 | L | 66.1 | Low | 65.8 | Low | 77 Ų | 77 | 75.3 Ų | 75.3 | 40% | 0.403 | 44% | 0.44 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -55 | -24.1 | -176.8 | -171.7 | 66.4 | 0 | 0 | 0 | 113.6 | T124 M130 A180 | T124-L126 HydrophobicContact CG2-CB 4.37Å; T124-L126 PolarHBondContact O-N 3.48Å; L126-M130 WeakPolarHBondContact O-CG 3.36Å; L126-M130 PolarHBondContact O-N 2.76Å; L126-A180 HydrophobicContact CD1-CB 4.22Å |
| 127 | A | 75.1 | Confident | 68 | Low | 73 Ų | 73 | 73.4 Ų | 73.4 | 60% | 0.603 | 42% | 0.424 | S | S | * | . | H | α-helix | trans | -63.6 | -40.8 | 175.7 | 0 | 0 | 0 | 0 | 0 | 113.4 | D125 M130 V131 | D125-A127 PolarHBondContact O-N 3.36Å; A127-M130 PolarHBondContact O-N 3.49Å; A127-V131 WeakPolarHBondContact O-CB 3.5Å; A127-V131 WeakPolarHBondContact O-CG2 3.39Å; A127-V131 PolarHBondContact O-N 2.87Å |
| 128 | G | 77.5 | Confident | 70.3 | Confident | 19 Ų | 19 | 70 Ų | 70 | 20% | 0.196 | 41% | 0.411 | C | S | . | . | H | α-helix | trans | -60.8 | -56.7 | -179 | 0 | 0 | 0 | 0 | 0 | 113.1 | D125 M130 V131 F132 | D125-G128 PolarHBondContact O-N 2.98Å; G128-M130 VanDerWaalsContact C-N 3.28Å; G128-M130 PolarHBondContact O-N 3.49Å; G128-V131 PolarHBondContact O-N 2.88Å; G128-V131 VanDerWaalsContact O-N 3.11Å; G128-F132 WeakPolarHBondContact O-CD2 3.42Å; G128-F132 WeakPolarHBondContact O-CG 3.29Å; G128-F132 PolarHBondContact O-N 3.03Å |
| 129 | P | 81.8 | Confident | 72.1 | Confident | 10 Ų | 10 | 67.8 Ų | 67.8 | 7% | 0.065 | 38% | 0.383 | C | S | . | . | H | α-helix | trans | -51.8 | -41.6 | 172.2 | -30.2 | 38.6 | 0 | 0 | 0 | 113.9 | D125 F132 C133 Y185 | D125-P129 WeakPolarHBondContact O-CD 3.23Å; P129-F132 PolarHBondContact O-N 3.1Å; P129-C133 WeakPolarHBondContact O-CB 3.45Å; P129-C133 PolarHBondContact O-N 2.98Å; P129-Y185 HydrophobicContact CG-CD2 4.46Å; P129-Y185 HydrophobicContact CG-CE2 4.11Å |
| 130 | M | 82 | Confident | 74.2 | Confident | 91 Ų | 91 | 61.5 Ų | 61.5 | 45% | 0.448 | 35% | 0.35 | S | S | . | . | H | α-helix | trans | -65.6 | -44.1 | 176.6 | -78.3 | -68.6 | -172.3 | 0 | 0 | 111.6 | L126 A127 G128 C133 L134 Y152 | L126-M130 WeakPolarHBondContact O-CG 3.36Å; L126-M130 PolarHBondContact O-N 2.76Å; A127-M130 PolarHBondContact O-N 3.49Å; G128-M130 VanDerWaalsContact C-N 3.28Å; G128-M130 PolarHBondContact O-N 3.49Å; M130-C133 PolarHBondContact O-N 3.26Å; M130-L134 VanDerWaalsContact O-CB 3.27Å; M130-L134 WeakPolarHBondContact O-CB 3.49Å; M130-L134 PolarHBondContact O-N 3.16Å; M130-Y152 HydrophobicContact SD-CE2 4.42Å |
| 131 | V | 84.4 | Confident | 76 | Confident | 93 Ų | 93 | 59.1 Ų | 59.1 | 56% | 0.564 | 34% | 0.338 | S | S | * | . | H | α-helix | trans | -63.7 | -40.9 | 175.2 | 169.2 | 0 | 0 | 0 | 0 | 111.3 | A127 G128 L134 A135 | A127-V131 WeakPolarHBondContact O-CB 3.5Å; A127-V131 WeakPolarHBondContact O-CG2 3.39Å; A127-V131 PolarHBondContact O-N 2.87Å; G128-V131 PolarHBondContact O-N 2.88Å; G128-V131 VanDerWaalsContact O-N 3.11Å; V131-L134 PolarHBondContact O-N 3.23Å; V131-A135 VanDerWaalsContact O-CB 3.27Å; V131-A135 WeakPolarHBondContact O-CB 3.44Å; V131-A135 PolarHBondContact O-N 3.14Å |
| 132 | F | 85.1 | Confident | 77.4 | Confident | 51 Ų | 51 | 62.5 Ų | 62.5 | 22% | 0.224 | 36% | 0.357 | C | S | . | . | H | α-helix | trans | -66 | -43.2 | 175.3 | -67.8 | -49.9 | 0 | 0 | 0 | 112.3 | G128 P129 L134 A135 F136 Y185 L188 I191 | G128-F132 WeakPolarHBondContact O-CD2 3.42Å; G128-F132 WeakPolarHBondContact O-CG 3.29Å; G128-F132 PolarHBondContact O-N 3.03Å; P129-F132 PolarHBondContact O-N 3.1Å; F132-L134 VanDerWaalsContact C-N 3.33Å; F132-L134 PolarHBondContact O-N 3.48Å; F132-A135 PolarHBondContact O-N 3.11Å; F132-F136 WeakPolarHBondContact O-CB 3.28Å; F132-F136 PolarHBondContact O-N 3.33Å; F132-Y185 HydrophobicContact CD2-CD1 4.32Å; F132-Y185 AromaticContact CE2-CD1 3.65Å; F132-Y185 HydrophobicContact CE2-CD1 3.65Å; F132-Y185 AromaticContact CE2-CE1 3.77Å; F132-Y185 HydrophobicContact CE2-CE1 3.77Å; F132-L188 HydrophobicContact CE1-CD1 4.15Å; F132-L188 HydrophobicContact CZ-CD1 4.24Å; F132-I191 HydrophobicContact CB-CD1 3.74Å; F132-I191 HydrophobicContact CD1-CD1 3.92Å; F132-I191 HydrophobicContact CG-CD1 4.23Å; F132-I191 VanDerWaalsContact O-CD1 3.24Å; F132-I191 WeakPolarHBondContact O-CD1 3.16Å |
| 133 | C | 86.3 | Confident | 78.7 | Confident | 16 Ų | 16 | 59.1 Ų | 59.1 | 11% | 0.108 | 34% | 0.341 | C | S | . | . | H | α-helix | trans | -64 | -37.5 | 174.8 | -172.3 | 0 | 0 | 0 | 0 | 112.2 | P129 M130 G137 S155 | P129-C133 WeakPolarHBondContact O-CB 3.45Å; P129-C133 PolarHBondContact O-N 2.98Å; M130-C133 PolarHBondContact O-N 3.26Å; C133-G137 PolarHBondContact O-N 3.47Å; C133-S155 PolarHBondContact SG-OG 3.21Å |
| 134 | L | 85.7 | Confident | 79.4 | Confident | 100 Ų | 100 | 54.2 Ų | 54.2 | 52% | 0.524 | 33% | 0.334 | S | S | . | . | H | α-helix | trans | -67.7 | -46.8 | 175.2 | -164 | 170.5 | 0 | 0 | 0 | 110.5 | M130 V131 F132 F136 G137 A138 F148 | M130-L134 VanDerWaalsContact O-CB 3.27Å; M130-L134 WeakPolarHBondContact O-CB 3.49Å; M130-L134 PolarHBondContact O-N 3.16Å; V131-L134 PolarHBondContact O-N 3.23Å; F132-L134 VanDerWaalsContact C-N 3.33Å; F132-L134 PolarHBondContact O-N 3.48Å; L134-F136 VanDerWaalsContact C-N 3.34Å; L134-F136 PolarHBondContact O-N 2.89Å; L134-G137 CarbonylContact O-C 3.6Å; L134-G137 WeakPolarHBondContact O-CA 3.45Å; L134-G137 PolarHBondContact O-N 3.3Å; L134-G137 VanDerWaalsContact O-N 3.14Å; L134-A138 WeakPolarHBondContact O-CB 3.26Å; L134-A138 PolarHBondContact O-N 2.92Å; L134-F148 HydrophobicContact CG-CE2 4.48Å |
| 135 | A | 87.5 | Confident | 80.1 | Confident | 36 Ų | 36 | 51.8 Ų | 51.8 | 30% | 0.298 | 32% | 0.315 | S | S | . | . | H | α-helix | trans | -59.2 | -42.6 | 176.8 | 0 | 0 | 0 | 0 | 0 | 112 | V131 F132 A138 T139 | V131-A135 VanDerWaalsContact O-CB 3.27Å; V131-A135 WeakPolarHBondContact O-CB 3.44Å; V131-A135 PolarHBondContact O-N 3.14Å; F132-A135 PolarHBondContact O-N 3.11Å; A135-A138 PolarHBondContact O-N 3.19Å; A135-T139 PolarHBondContact O-N 2.78Å; A135-T139 PolarHBondContact O-OG1 3.41Å |
| 136 | F | 87.9 | Confident | 79.9 | Confident | 0 Ų | 0 | 54.9 Ų | 54.9 | 0% | 0 | 33% | 0.33 | C | S | . | . | H | α-helix | trans | -58.5 | -51.9 | 171.4 | -174.7 | -119.5 | 0 | 0 | 0 | 111.3 | F132 L134 A138 T139 L140 V151 I191 A194 F250 | F132-F136 WeakPolarHBondContact O-CB 3.28Å; F132-F136 PolarHBondContact O-N 3.33Å; L134-F136 VanDerWaalsContact C-N 3.34Å; L134-F136 PolarHBondContact O-N 2.89Å; F136-A138 VanDerWaalsContact C-N 3.26Å; F136-A138 PolarHBondContact O-N 3.4Å; F136-T139 PolarHBondContact O-N 3.29Å; F136-T139 PolarHBondContact O-OG1 3.18Å; F136-L140 HydrophobicContact CD1-CD1 4.01Å; F136-L140 HydrophobicContact CE1-CD1 3.62Å; F136-L140 HydrophobicContact CE2-CD1 4.31Å; F136-L140 HydrophobicContact CG-CD1 4.48Å; F136-L140 HydrophobicContact CZ-CD1 3.78Å; F136-L140 HydrophobicContact CZ-CG 4.47Å; F136-L140 WeakPolarHBondContact O-CG 3.19Å; F136-L140 PolarHBondContact O-N 3.35Å; F136-L140 VanDerWaalsContact O-N 3.12Å; F136-V151 HydrophobicContact CD1-CG1 3.67Å; F136-V151 HydrophobicContact CE1-CG1 4.08Å; F136-I191 HydrophobicContact CB-CD1 4.47Å; F136-I191 HydrophobicContact CB-CG1 3.91Å; F136-I191 HydrophobicContact CD2-CG1 4.26Å; F136-I191 HydrophobicContact CG-CG1 4.49Å; F136-A194 HydrophobicContact CD2-CB 4.05Å; F136-A194 HydrophobicContact CE2-CB 3.88Å; F136-F250 HydrophobicContact CE1-CB 3.8Å; F136-F250 AromaticContact CE1-CD1 3.81Å; F136-F250 HydrophobicContact CE1-CD1 3.81Å; F136-F250 AromaticContact CE1-CG 3.97Å; F136-F250 HydrophobicContact CE1-CG 3.97Å; F136-F250 HydrophobicContact CZ-CB 3.77Å; F136-F250 HydrophobicContact CZ-CG 4.44Å |
| 137 | G | 87.1 | Confident | 80 | Confident | 1 Ų | 1 | 54.5 Ų | 54.5 | 1% | 0.01 | 33% | 0.326 | C | S | . | . | H | α-helix | trans | -57.3 | -35.5 | 174.9 | 0 | 0 | 0 | 0 | 0 | 113.8 | C133 L134 L140 L141 | C133-G137 PolarHBondContact O-N 3.47Å; L134-G137 CarbonylContact O-C 3.6Å; L134-G137 WeakPolarHBondContact O-CA 3.45Å; L134-G137 PolarHBondContact O-N 3.3Å; L134-G137 VanDerWaalsContact O-N 3.14Å; G137-L140 PolarHBondContact O-N 3.17Å; G137-L141 WeakPolarHBondContact O-CG 3.3Å; G137-L141 PolarHBondContact O-N 2.9Å |
| 138 | A | 86.6 | Confident | 79.8 | Confident | 36 Ų | 36 | 55.4 Ų | 55.4 | 30% | 0.298 | 32% | 0.317 | S | S | . | . | H | α-helix | trans | -70.8 | -40.4 | 176.7 | 0 | 0 | 0 | 0 | 0 | 112.2 | L134 A135 F136 L140 L141 L142 | L134-A138 WeakPolarHBondContact O-CB 3.26Å; L134-A138 PolarHBondContact O-N 2.92Å; A135-A138 PolarHBondContact O-N 3.19Å; F136-A138 VanDerWaalsContact C-N 3.26Å; F136-A138 PolarHBondContact O-N 3.4Å; A138-L140 VanDerWaalsContact C-N 3.28Å; A138-L140 PolarHBondContact O-N 3.43Å; A138-L141 PolarHBondContact O-N 3.32Å; A138-L142 WeakPolarHBondContact O-CG 3.36Å; A138-L142 PolarHBondContact O-N 3.12Å |
| 139 | T | 85.3 | Confident | 80 | Confident | 19 Ų | 19 | 57.2 Ų | 57.2 | 12% | 0.117 | 34% | 0.335 | C | S | . | . | H | α-helix | trans | -60.6 | -38.7 | 172.4 | 53 | 0 | 0 | 0 | 0 | 111.9 | A135 F136 L142 T143 I198 | A135-T139 PolarHBondContact O-N 2.78Å; A135-T139 PolarHBondContact O-OG1 3.41Å; F136-T139 PolarHBondContact O-N 3.29Å; F136-T139 PolarHBondContact O-OG1 3.18Å; T139-L142 PolarHBondContact O-N 3.06Å; T139-T143 PolarHBondContact O-N 2.84Å; T139-T143 PolarHBondContact O-OG1 3.02Å; T139-I198 HydrophobicContact CG2-CD1 4.14Å |
| 140 | L | 86 | Confident | 80.1 | Confident | 3 Ų | 3 | 64 Ų | 64 | 2% | 0.016 | 36% | 0.361 | C | S | . | . | H | α-helix | trans | -69.4 | -35.5 | 176.3 | -63.3 | 169.7 | 0 | 0 | 0 | 113 | F136 G137 A138 T143 G144 K145 V151 I253 | F136-L140 HydrophobicContact CD1-CD1 4.01Å; F136-L140 HydrophobicContact CE1-CD1 3.62Å; F136-L140 HydrophobicContact CE2-CD1 4.31Å; F136-L140 HydrophobicContact CG-CD1 4.48Å; F136-L140 HydrophobicContact CZ-CD1 3.78Å; F136-L140 HydrophobicContact CZ-CG 4.47Å; F136-L140 WeakPolarHBondContact O-CG 3.19Å; F136-L140 PolarHBondContact O-N 3.35Å; F136-L140 VanDerWaalsContact O-N 3.12Å; G137-L140 PolarHBondContact O-N 3.17Å; A138-L140 VanDerWaalsContact C-N 3.28Å; A138-L140 PolarHBondContact O-N 3.43Å; L140-T143 WeakPolarHBondContact O-CB 3.49Å; L140-T143 PolarHBondContact O-N 3.48Å; L140-G144 PolarHBondContact O-N 3.06Å; L140-K145 PolarHBondContact O-N 2.94Å; L140-K145 VanDerWaalsContact O-N 3.08Å; L140-V151 HydrophobicContact CD1-CG2 3.45Å; L140-V151 VanDerWaalsContact CD1-CG2 3.45Å; L140-I253 HydrophobicContact CD1-CG2 3.88Å; L140-I253 HydrophobicContact CD2-CG2 4.35Å |
| 141 | L | 83.5 | Confident | 80.3 | Confident | 74 Ų | 74 | 59.8 Ų | 59.8 | 39% | 0.387 | 34% | 0.34 | S | S | . | . | H | α-helix | trans | -65.2 | -37.7 | 171.2 | -74.7 | 171.7 | 0 | 0 | 0 | 112.2 | G137 A138 T143 G144 I146 F148 | G137-L141 WeakPolarHBondContact O-CG 3.3Å; G137-L141 PolarHBondContact O-N 2.9Å; A138-L141 PolarHBondContact O-N 3.32Å; L141-T143 VanDerWaalsContact C-N 3.34Å; L141-G144 WeakPolarHBondContact O-CA 3.41Å; L141-G144 PolarHBondContact O-N 2.76Å; L141-I146 HydrophobicContact CD2-CG1 4.42Å; L141-I146 HydrophobicContact CD2-CG2 4.47Å; L141-F148 HydrophobicContact CD1-CB 4.23Å; L141-F148 HydrophobicContact CD1-CD2 3.96Å; L141-F148 HydrophobicContact CD1-CG 4.38Å; L141-F148 HydrophobicContact CD2-CB 4.4Å; L141-F148 HydrophobicContact CG-CB 4.44Å |
| 142 | L | 80.8 | Confident | 80.4 | Confident | 135 Ų | 135 | 61 Ų | 61 | 71% | 0.707 | 34% | 0.335 | S | S | * | . | H | α-helix | trans | -67.4 | -32.1 | 174.8 | -71.3 | 169.7 | 0 | 0 | 0 | 112.6 | A138 T139 G144 I198 | A138-L142 WeakPolarHBondContact O-CG 3.36Å; A138-L142 PolarHBondContact O-N 3.12Å; T139-L142 PolarHBondContact O-N 3.06Å; L142-G144 PolarHBondContact O-N 3.02Å; L142-I198 HydrophobicContact CB-CD1 4.04Å; L142-I198 HydrophobicContact CD1-CD1 4.43Å |
| 143 | T | 74.1 | Confident | 80.7 | Confident | 62 Ų | 62 | 59.8 Ų | 59.8 | 38% | 0.38 | 34% | 0.336 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -67.1 | -2.6 | 166.4 | -61.6 | 0 | 0 | 0 | 0 | 113.1 | T139 L140 L141 K145 | T139-T143 PolarHBondContact O-N 2.84Å; T139-T143 PolarHBondContact O-OG1 3.02Å; L140-T143 WeakPolarHBondContact O-CB 3.49Å; L140-T143 PolarHBondContact O-N 3.48Å; L141-T143 VanDerWaalsContact C-N 3.34Å; T143-K145 VanDerWaalsContact C-N 3.33Å; T143-K145 HydrophobicContact CG2-CD 4.44Å; T143-K145 HydrophobicContact CG2-CG 4.41Å |
| 144 | G | 65.6 | Low | 80.8 | Confident | 58 Ų | 58 | 61.5 Ų | 61.5 | 60% | 0.598 | 34% | 0.344 | S | S | * | . | T | Hydrogen-bonded Turn | trans | 82.9 | 3.6 | 179.3 | 0 | 0 | 0 | 0 | 0 | 114.5 | L140 L141 L142 I146 | L140-G144 PolarHBondContact O-N 3.06Å; L141-G144 WeakPolarHBondContact O-CA 3.41Å; L141-G144 PolarHBondContact O-N 2.76Å; L142-G144 PolarHBondContact O-N 3.02Å; G144-I146 PolarHBondContact O-N 3.36Å |
| 145 | K | 67 | Low | 81 | Confident | 43 Ų | 43 | 57.4 Ų | 57.4 | 19% | 0.187 | 32% | 0.324 | C | S | . | . | trans | -86.2 | 101.4 | 177.4 | -68.3 | -179.5 | -177.9 | 179.2 | 0 | 110 | L140 T143 Q147 I253 F256 | L140-K145 PolarHBondContact O-N 2.94Å; L140-K145 VanDerWaalsContact O-N 3.08Å; T143-K145 VanDerWaalsContact C-N 3.33Å; T143-K145 HydrophobicContact CG2-CD 4.44Å; T143-K145 HydrophobicContact CG2-CG 4.41Å; K145-Q147 PolarHBondContact O-N 2.91Å; K145-I253 PolarHBondContact NZ-O 2.98Å; K145-F256 WeakPolarHBondContact CE-O 3.28Å; K145-F256 PolarHBondContact NZ-O 3.12Å; K145-F256 PolarHBondContact NZ-OXT 2.87Å | ||
| 146 | I | 61.8 | Low | 81.2 | Confident | 155 Ų | 155 | 58.6 Ų | 58.6 | 80% | 0.795 | 33% | 0.327 | S | S | * | . | trans | -74.6 | 72.5 | 172.3 | -51.5 | -177 | 0 | 0 | 0 | 109.7 | L141 G144 | L141-I146 HydrophobicContact CD2-CG1 4.42Å; L141-I146 HydrophobicContact CD2-CG2 4.47Å; G144-I146 PolarHBondContact O-N 3.36Å | ||
| 147 | Q | 68.2 | Low | 81.4 | Confident | 69 Ų | 69 | 64.5 Ų | 64.5 | 32% | 0.322 | 36% | 0.358 | S | S | . | . | trans | -125 | 16.9 | 179.7 | -71.1 | -165.6 | -13.4 | 0 | 0 | 113.3 | K145 G149 Y150 V151 | K145-Q147 PolarHBondContact O-N 2.91Å; Q147-G149 PolarHBondContact O-N 2.8Å; Q147-G149 VanDerWaalsContact O-N 3.12Å; Q147-Y150 HydrophobicContact CB-CD2 3.96Å; Q147-Y150 HydrophobicContact CG-CD2 3.9Å; Q147-Y150 HydrophobicContact CG-CE2 4.45Å; Q147-Y150 WeakPolarHBondContact O-CA 3.42Å; Q147-Y150 WeakPolarHBondContact O-CB 3.3Å; Q147-Y150 PolarHBondContact O-N 3.44Å; Q147-V151 PolarHBondContact O-N 2.62Å | ||
| 148 | F | 71.5 | Confident | 81.7 | Confident | 93 Ų | 93 | 65.3 Ų | 65.3 | 41% | 0.408 | 37% | 0.365 | S | S | . | . | H | α-helix | trans | -48.6 | -42.3 | -179.8 | -174.1 | -96.2 | 0 | 0 | 0 | 113.6 | L134 L141 V151 Y152 | L134-F148 HydrophobicContact CG-CE2 4.48Å; L141-F148 HydrophobicContact CD1-CB 4.23Å; L141-F148 HydrophobicContact CD1-CD2 3.96Å; L141-F148 HydrophobicContact CD1-CG 4.38Å; L141-F148 HydrophobicContact CD2-CB 4.4Å; L141-F148 HydrophobicContact CG-CB 4.44Å; F148-V151 PolarHBondContact O-N 3.32Å; F148-Y152 PolarHBondContact O-N 3.48Å |
| 149 | G | 80.9 | Confident | 81.9 | Confident | 56 Ų | 56 | 64.5 Ų | 64.5 | 58% | 0.577 | 36% | 0.357 | S | S | * | . | H | α-helix | trans | -67 | -32.6 | 175.8 | 0 | 0 | 0 | 0 | 0 | 114.6 | Q147 G153 | Q147-G149 PolarHBondContact O-N 2.8Å; Q147-G149 VanDerWaalsContact O-N 3.12Å; G149-G153 PolarHBondContact O-N 2.88Å |
| 150 | Y | 84.5 | Confident | 82.2 | Confident | 154 Ų | 154 | 68.3 Ų | 68.3 | 60% | 0.604 | 38% | 0.376 | S | S | * | . | H | α-helix | trans | -70.5 | -43.8 | 173.4 | -68.1 | -78.6 | 0 | 0 | 0 | 111.1 | Q147 G153 I154 | Q147-Y150 HydrophobicContact CB-CD2 3.96Å; Q147-Y150 HydrophobicContact CG-CD2 3.9Å; Q147-Y150 HydrophobicContact CG-CE2 4.45Å; Q147-Y150 WeakPolarHBondContact O-CA 3.42Å; Q147-Y150 WeakPolarHBondContact O-CB 3.3Å; Q147-Y150 PolarHBondContact O-N 3.44Å; Y150-G153 PolarHBondContact O-N 3.16Å; Y150-I154 VanDerWaalsContact O-CB 3.26Å; Y150-I154 WeakPolarHBondContact O-CB 3.48Å; Y150-I154 WeakPolarHBondContact O-CD1 3.5Å; Y150-I154 WeakPolarHBondContact O-CG1 3.23Å; Y150-I154 PolarHBondContact O-N 3.42Å |
| 151 | V | 86.8 | Confident | 82.5 | Confident | 2 Ų | 2 | 69.7 Ų | 69.7 | 1% | 0.012 | 39% | 0.392 | C | S | . | . | H | α-helix | trans | -57.6 | -53 | 176.3 | 178.4 | 0 | 0 | 0 | 0 | 110 | F136 L140 Q147 F148 G153 I154 S155 I253 | F136-V151 HydrophobicContact CD1-CG1 3.67Å; F136-V151 HydrophobicContact CE1-CG1 4.08Å; L140-V151 HydrophobicContact CD1-CG2 3.45Å; L140-V151 VanDerWaalsContact CD1-CG2 3.45Å; Q147-V151 PolarHBondContact O-N 2.62Å; F148-V151 PolarHBondContact O-N 3.32Å; V151-G153 PolarHBondContact O-N 2.84Å; V151-I154 PolarHBondContact O-N 3.25Å; V151-S155 WeakPolarHBondContact O-CB 3.43Å; V151-S155 PolarHBondContact O-N 3.32Å; V151-S155 PolarHBondContact O-OG 3.18Å; V151-S155 VanDerWaalsContact O-OG 3.08Å; V151-I253 HydrophobicContact CG2-CG2 4.49Å |
| 152 | Y | 87.1 | Confident | 82.8 | Confident | 119 Ų | 119 | 66.5 Ų | 66.5 | 47% | 0.467 | 38% | 0.375 | S | S | . | . | H | α-helix | trans | -62.2 | -44.6 | 178.6 | -177.3 | -102.4 | 0 | 0 | 0 | 112.5 | M130 F148 S155 V156 | M130-Y152 HydrophobicContact SD-CE2 4.42Å; F148-Y152 PolarHBondContact O-N 3.48Å; Y152-S155 PolarHBondContact O-N 2.97Å; Y152-V156 HydrophobicContact CD1-CG2 4.38Å; Y152-V156 HydrophobicContact CE1-CG2 3.97Å; Y152-V156 HydrophobicContact CE2-CG2 4.16Å; Y152-V156 WeakPolarHBondContact O-CG2 3.12Å; Y152-V156 PolarHBondContact O-N 3.31Å |
| 153 | G | 89.9 | Confident | 83.3 | Confident | 24 Ų | 24 | 64 Ų | 64 | 25% | 0.247 | 36% | 0.357 | C | S | . | . | H | α-helix | trans | -62.4 | -44 | 178.2 | 0 | 0 | 0 | 0 | 0 | 113.1 | G149 Y150 V151 V156 I157 | G149-G153 PolarHBondContact O-N 2.88Å; Y150-G153 PolarHBondContact O-N 3.16Å; V151-G153 PolarHBondContact O-N 2.84Å; G153-V156 PolarHBondContact O-N 2.99Å; G153-I157 WeakPolarHBondContact O-CB 3.39Å; G153-I157 VanDerWaalsContact O-CG1 3.25Å; G153-I157 WeakPolarHBondContact O-CG1 3.34Å; G153-I157 PolarHBondContact O-N 2.75Å |
| 154 | I | 90 | Very high | 84 | Confident | 52 Ų | 52 | 64.3 Ų | 64.3 | 27% | 0.267 | 36% | 0.36 | S | S | . | . | H | α-helix | trans | -67.9 | -37.5 | 176.7 | -67.2 | 165.7 | 0 | 0 | 0 | 110.6 | Y150 V151 G158 V249 F250 I253 | Y150-I154 VanDerWaalsContact O-CB 3.26Å; Y150-I154 WeakPolarHBondContact O-CB 3.48Å; Y150-I154 WeakPolarHBondContact O-CD1 3.5Å; Y150-I154 WeakPolarHBondContact O-CG1 3.23Å; Y150-I154 PolarHBondContact O-N 3.42Å; V151-I154 PolarHBondContact O-N 3.25Å; I154-G158 WeakPolarHBondContact O-CA 3.46Å; I154-G158 PolarHBondContact O-N 2.92Å; I154-V249 HydrophobicContact CD1-CG1 4.03Å; I154-V249 HydrophobicContact CG2-CG1 3.91Å; I154-F250 HydrophobicContact CB-CE1 4.18Å; I154-F250 HydrophobicContact CG2-CD1 4.42Å; I154-F250 HydrophobicContact CG2-CE1 3.72Å; I154-F250 HydrophobicContact CG2-CZ 4.12Å; I154-I253 HydrophobicContact CD1-CD1 3.73Å |
| 155 | S | 89.4 | Confident | 85.2 | Confident | 14 Ų | 14 | 65.9 Ų | 65.9 | 10% | 0.098 | 36% | 0.355 | C | S | . | . | H | α-helix | trans | -60.5 | -48 | 171.6 | -68.8 | 0 | 0 | 0 | 0 | 112.5 | C133 V151 Y152 G158 C159 F250 | C133-S155 PolarHBondContact SG-OG 3.21Å; V151-S155 WeakPolarHBondContact O-CB 3.43Å; V151-S155 PolarHBondContact O-N 3.32Å; V151-S155 PolarHBondContact O-OG 3.18Å; V151-S155 VanDerWaalsContact O-OG 3.08Å; Y152-S155 PolarHBondContact O-N 2.97Å; S155-G158 PolarHBondContact O-N 3Å; S155-C159 WeakPolarHBondContact O-CB 3.37Å; S155-C159 PolarHBondContact O-N 3.26Å; S155-C159 PolarHBondContact O-SG 2.97Å; S155-F250 VanDerWaalsContact OG-CZ 3.24Å; S155-F250 WeakPolarHBondContact OG-CZ 3.46Å |
| 156 | V | 91.1 | Very high | 86.1 | Confident | 62 Ų | 62 | 64 Ų | 64 | 38% | 0.376 | 35% | 0.346 | S | S | . | . | H | α-helix | trans | -66.8 | -46.8 | -179.8 | 172.8 | 0 | 0 | 0 | 0 | 111.3 | Y152 G153 G158 C159 L160 | Y152-V156 HydrophobicContact CD1-CG2 4.38Å; Y152-V156 HydrophobicContact CE1-CG2 3.97Å; Y152-V156 HydrophobicContact CE2-CG2 4.16Å; Y152-V156 WeakPolarHBondContact O-CG2 3.12Å; Y152-V156 PolarHBondContact O-N 3.31Å; G153-V156 PolarHBondContact O-N 2.99Å; V156-G158 VanDerWaalsContact C-N 3.34Å; V156-G158 PolarHBondContact O-N 3.27Å; V156-C159 PolarHBondContact O-N 3.26Å; V156-L160 WeakPolarHBondContact O-CB 3.36Å; V156-L160 PolarHBondContact O-N 3.42Å |
| 157 | I | 93.1 | Very high | 87.3 | Confident | 124 Ų | 124 | 59.1 Ų | 59.1 | 64% | 0.636 | 32% | 0.322 | S | S | * | . | H | α-helix | trans | -65.2 | -39.2 | 177.8 | -67.2 | 167.5 | 0 | 0 | 0 | 110.8 | G153 L160 G161 | G153-I157 WeakPolarHBondContact O-CB 3.39Å; G153-I157 VanDerWaalsContact O-CG1 3.25Å; G153-I157 WeakPolarHBondContact O-CG1 3.34Å; G153-I157 PolarHBondContact O-N 2.75Å; I157-L160 PolarHBondContact O-N 2.87Å; I157-G161 PolarHBondContact O-N 2.7Å |
| 158 | G | 91.9 | Very high | 88.1 | Confident | 17 Ų | 17 | 62.6 Ų | 62.6 | 18% | 0.175 | 34% | 0.342 | C | S | . | . | H | α-helix | trans | -66.1 | -44.9 | 177 | 0 | 0 | 0 | 0 | 0 | 112.8 | I154 S155 V156 G161 M162 | I154-G158 WeakPolarHBondContact O-CA 3.46Å; I154-G158 PolarHBondContact O-N 2.92Å; S155-G158 PolarHBondContact O-N 3Å; V156-G158 VanDerWaalsContact C-N 3.34Å; V156-G158 PolarHBondContact O-N 3.27Å; G158-G161 PolarHBondContact O-N 3.15Å; G158-M162 WeakPolarHBondContact O-CB 3.37Å; G158-M162 WeakPolarHBondContact O-CG 3.44Å; G158-M162 PolarHBondContact O-N 2.92Å |
| 159 | C | 90.6 | Very high | 88.6 | Confident | 19 Ų | 19 | 60.4 Ų | 60.4 | 13% | 0.128 | 33% | 0.334 | C | S | . | . | H | α-helix | trans | -63.3 | -42.1 | 174 | -68.3 | 0 | 0 | 0 | 0 | 111.6 | S155 V156 Y163 F176 L183 | S155-C159 WeakPolarHBondContact O-CB 3.37Å; S155-C159 PolarHBondContact O-N 3.26Å; S155-C159 PolarHBondContact O-SG 2.97Å; V156-C159 PolarHBondContact O-N 3.26Å; C159-Y163 WeakPolarHBondContact O-CB 3.44Å; C159-Y163 PolarHBondContact O-N 2.92Å; C159-F176 HydrophobicContact CB-CE2 4.35Å; C159-F176 HydrophobicContact CB-CZ 4.44Å; C159-L183 HydrophobicContact CB-CD1 4.39Å |
| 160 | L | 91.8 | Very high | 88.3 | Confident | 99 Ų | 99 | 58.3 Ų | 58.3 | 52% | 0.518 | 31% | 0.31 | S | S | . | . | H | α-helix | trans | -65.5 | -40.8 | 176 | -177.9 | 62.7 | 0 | 0 | 0 | 112.1 | V156 I157 Y163 C164 | V156-L160 WeakPolarHBondContact O-CB 3.36Å; V156-L160 PolarHBondContact O-N 3.42Å; I157-L160 PolarHBondContact O-N 2.87Å; L160-Y163 HydrophobicContact CD1-CD1 4.44Å; L160-Y163 PolarHBondContact O-N 3.25Å; L160-C164 WeakPolarHBondContact O-CB 3.43Å; L160-C164 PolarHBondContact O-N 3.37Å |
| 161 | G | 92.4 | Very high | 87.5 | Confident | 33 Ų | 33 | 60.2 Ų | 60.2 | 34% | 0.34 | 33% | 0.327 | S | S | . | . | H | α-helix | trans | -63.8 | -47.9 | 175.5 | 0 | 0 | 0 | 0 | 0 | 112.3 | I157 G158 C164 L165 | I157-G161 PolarHBondContact O-N 2.7Å; G158-G161 PolarHBondContact O-N 3.15Å; G161-C164 PolarHBondContact O-N 2.82Å; G161-L165 WeakPolarHBondContact O-CG 3.08Å; G161-L165 PolarHBondContact O-N 3.12Å |
| 162 | M | 91.1 | Very high | 86.7 | Confident | 7 Ų | 7 | 64.7 Ų | 64.7 | 3% | 0.034 | 36% | 0.355 | C | S | . | . | H | α-helix | trans | -60.7 | -43.8 | 173.5 | -76.7 | -62.2 | -56.7 | 0 | 0 | 111.8 | G158 C164 L165 L166 V179 L183 F226 V239 P242 C243 L246 | G158-M162 WeakPolarHBondContact O-CB 3.37Å; G158-M162 WeakPolarHBondContact O-CG 3.44Å; G158-M162 PolarHBondContact O-N 2.92Å; M162-C164 VanDerWaalsContact C-N 3.33Å; M162-C164 PolarHBondContact O-N 3.43Å; M162-L165 PolarHBondContact O-N 3.44Å; M162-L166 HydrophobicContact CE-CD1 4.11Å; M162-L166 HydrophobicContact CE-CG 4.3Å; M162-L166 VanDerWaalsContact O-CB 3.3Å; M162-L166 WeakPolarHBondContact O-CB 3.24Å; M162-L166 WeakPolarHBondContact O-CD1 3.27Å; M162-L166 WeakPolarHBondContact O-CG 3.46Å; M162-L166 PolarHBondContact O-N 2.71Å; M162-V179 HydrophobicContact CB-CG1 3.76Å; M162-L183 HydrophobicContact CB-CD1 3.94Å; M162-L183 HydrophobicContact CG-CD1 3.9Å; M162-L183 HydrophobicContact CG-CD2 4.37Å; M162-F226 HydrophobicContact CE-CD2 4.39Å; M162-F226 HydrophobicContact CE-CE2 4.04Å; M162-V239 HydrophobicContact CE-CG1 4.29Å; M162-P242 HydrophobicContact CE-CG 4.37Å; M162-P242 HydrophobicContact SD-CB 3.66Å; M162-P242 HydrophobicContact SD-CG 3.82Å; M162-C243 VanDerWaalsContact CE-SG 3.57Å; M162-L246 HydrophobicContact CG-CD1 4.04Å |
| 163 | Y | 90.5 | Very high | 86 | Confident | 83 Ų | 83 | 61.7 Ų | 61.7 | 33% | 0.325 | 36% | 0.36 | S | S | . | . | H | α-helix | trans | -60.5 | -41.2 | 175.8 | 170.4 | -93.7 | 0 | 0 | 0 | 112.2 | C159 L160 N167 V174 F176 V179 | C159-Y163 WeakPolarHBondContact O-CB 3.44Å; C159-Y163 PolarHBondContact O-N 2.92Å; L160-Y163 HydrophobicContact CD1-CD1 4.44Å; L160-Y163 PolarHBondContact O-N 3.25Å; Y163-N167 VanDerWaalsContact CD2-ND2 3.33Å; Y163-N167 WeakPolarHBondContact CD2-ND2 3.39Å; Y163-N167 WeakPolarHBondContact CE2-ND2 3.16Å; Y163-N167 WeakPolarHBondContact O-CB 3.4Å; Y163-N167 PolarHBondContact O-N 3.28Å; Y163-N167 VanDerWaalsContact O-N 3.1Å; Y163-N167 PolarHBondContact O-ND2 3.17Å; Y163-V174 WeakPolarHBondContact CE2-O 3.29Å; Y163-F176 HydrophobicContact CD1-CD2 4.44Å; Y163-F176 HydrophobicContact CD2-CB 3.89Å; Y163-F176 HydrophobicContact CD2-CD2 4.07Å; Y163-F176 HydrophobicContact CD2-CG 4.5Å; Y163-F176 HydrophobicContact CE2-CB 3.81Å; Y163-F176 AromaticContact CG-CD2 3.96Å; Y163-F176 HydrophobicContact CG-CD2 3.96Å; Y163-V179 HydrophobicContact CD2-CG2 4.28Å |
| 164 | C | 89.6 | Confident | 85.5 | Confident | 67 Ų | 67 | 61.1 Ų | 61.1 | 45% | 0.453 | 35% | 0.351 | S | S | . | . | H | α-helix | trans | -64.7 | -49.8 | 175 | -171.2 | 0 | 0 | 0 | 0 | 111.4 | L160 G161 M162 L166 N167 L168 | L160-C164 WeakPolarHBondContact O-CB 3.43Å; L160-C164 PolarHBondContact O-N 3.37Å; G161-C164 PolarHBondContact O-N 2.82Å; M162-C164 VanDerWaalsContact C-N 3.33Å; M162-C164 PolarHBondContact O-N 3.43Å; C164-L166 PolarHBondContact O-N 3.06Å; C164-N167 PolarHBondContact O-N 3.41Å; C164-L168 WeakPolarHBondContact O-CB 3.34Å; C164-L168 VanDerWaalsContact O-CG 3.31Å; C164-L168 WeakPolarHBondContact O-CG 3.47Å; C164-L168 PolarHBondContact O-N 3.25Å |
| 165 | L | 89.5 | Confident | 85.3 | Confident | 91 Ų | 91 | 61.9 Ų | 61.9 | 48% | 0.476 | 36% | 0.361 | S | S | . | . | H | α-helix | trans | -60.4 | -44.8 | 178.9 | -71.1 | 173.5 | 0 | 0 | 0 | 112.3 | G161 M162 L168 M169 P242 | G161-L165 WeakPolarHBondContact O-CG 3.08Å; G161-L165 PolarHBondContact O-N 3.12Å; M162-L165 PolarHBondContact O-N 3.44Å; L165-L168 PolarHBondContact O-N 3.27Å; L165-M169 WeakPolarHBondContact O-CB 3.39Å; L165-M169 PolarHBondContact O-N 3.08Å; L165-P242 HydrophobicContact CD1-CB 3.87Å; L165-P242 HydrophobicContact CD1-CG 4.23Å |
| 166 | L | 86.5 | Confident | 85 | Confident | 3 Ų | 3 | 65.7 Ų | 65.7 | 2% | 0.016 | 38% | 0.376 | C | S | . | . | H | α-helix | trans | -64.9 | -42.4 | 179.8 | -68.9 | 165.5 | 0 | 0 | 0 | 111.4 | M162 C164 L168 M169 S170 V174 V179 F226 L230 V239 | M162-L166 HydrophobicContact CE-CD1 4.11Å; M162-L166 HydrophobicContact CE-CG 4.3Å; M162-L166 VanDerWaalsContact O-CB 3.3Å; M162-L166 WeakPolarHBondContact O-CB 3.24Å; M162-L166 WeakPolarHBondContact O-CD1 3.27Å; M162-L166 WeakPolarHBondContact O-CG 3.46Å; M162-L166 PolarHBondContact O-N 2.71Å; C164-L166 PolarHBondContact O-N 3.06Å; L166-L168 VanDerWaalsContact C-N 3.35Å; L166-L168 PolarHBondContact O-N 2.76Å; L166-M169 HydrophobicContact CD2-CE 4.34Å; L166-M169 PolarHBondContact O-N 2.94Å; L166-S170 PolarHBondContact O-N 3.47Å; L166-S170 PolarHBondContact O-OG 3.36Å; L166-S170 VanDerWaalsContact O-OG 3.07Å; L166-V174 HydrophobicContact CB-CG1 3.64Å; L166-V174 HydrophobicContact CD1-CG1 4.28Å; L166-V179 HydrophobicContact CD1-CG1 4.1Å; L166-V179 HydrophobicContact CD1-CG2 3.67Å; L166-F226 HydrophobicContact CD1-CD1 3.66Å; L166-F226 HydrophobicContact CD1-CE1 3.55Å; L166-F226 HydrophobicContact CD1-CE2 4.46Å; L166-F226 HydrophobicContact CD1-CG 4.2Å; L166-F226 HydrophobicContact CD1-CZ 3.98Å; L166-F226 HydrophobicContact CD2-CB 4.27Å; L166-F226 HydrophobicContact CD2-CD1 4.28Å; L166-F226 HydrophobicContact CD2-CG 4.21Å; L166-L230 HydrophobicContact CB-CD2 4.17Å; L166-L230 HydrophobicContact CD2-CD2 3.55Å; L166-L230 HydrophobicContact CG-CD2 4.44Å; L166-V239 HydrophobicContact CD2-CG1 4.08Å; L166-V239 HydrophobicContact CD2-CG2 4.4Å |
| 167 | N | 86.7 | Confident | 84.6 | Confident | 53 Ų | 53 | 63.4 Ų | 63.4 | 28% | 0.283 | 37% | 0.366 | S | S | . | . | H | α-helix | trans | -73.6 | -19.5 | 176.3 | -77 | -65.7 | 0 | 0 | 0 | 114.6 | Y163 C164 G173 V174 | Y163-N167 VanDerWaalsContact CD2-ND2 3.33Å; Y163-N167 WeakPolarHBondContact CD2-ND2 3.39Å; Y163-N167 WeakPolarHBondContact CE2-ND2 3.16Å; Y163-N167 WeakPolarHBondContact O-CB 3.4Å; Y163-N167 PolarHBondContact O-N 3.28Å; Y163-N167 VanDerWaalsContact O-N 3.1Å; Y163-N167 PolarHBondContact O-ND2 3.17Å; C164-N167 PolarHBondContact O-N 3.41Å; N167-G173 WeakPolarHBondContact OD1-CA 3.16Å; N167-V174 PolarHBondContact ND2-O 2.95Å; N167-V174 PolarHBondContact OD1-N 3.36Å |
| 168 | L | 85.1 | Confident | 84.2 | Confident | 142 Ų | 142 | 58 Ų | 58 | 74% | 0.743 | 34% | 0.339 | S | S | * | . | H | α-helix | trans | -82.7 | -19.1 | 169.7 | -73.4 | 171.3 | 0 | 0 | 0 | 112.7 | C164 L165 L166 | C164-L168 WeakPolarHBondContact O-CB 3.34Å; C164-L168 VanDerWaalsContact O-CG 3.31Å; C164-L168 WeakPolarHBondContact O-CG 3.47Å; C164-L168 PolarHBondContact O-N 3.25Å; L165-L168 PolarHBondContact O-N 3.27Å; L166-L168 VanDerWaalsContact C-N 3.35Å; L166-L168 PolarHBondContact O-N 2.76Å |
| 169 | M | 82.4 | Confident | 84 | Confident | 47 Ų | 47 | 57.2 Ų | 57.2 | 23% | 0.232 | 33% | 0.33 | C | S | . | . | H | α-helix | trans | -101.3 | -31.6 | -174.1 | -166.3 | -169.3 | 68.7 | 0 | 0 | 112.5 | L165 L166 L230 M232 L238 V239 | L165-M169 WeakPolarHBondContact O-CB 3.39Å; L165-M169 PolarHBondContact O-N 3.08Å; L166-M169 HydrophobicContact CD2-CE 4.34Å; L166-M169 PolarHBondContact O-N 2.94Å; M169-L230 HydrophobicContact CE-CD2 4Å; M169-M232 HydrophobicContact CE-CE 3.74Å; M169-M232 HydrophobicContact CE-SD 3.51Å; M169-M232 VanDerWaalsContact CE-SD 3.51Å; M169-M232 HydrophobicContact CG-CE 3.68Å; M169-M232 HydrophobicContact CG-SD 4.27Å; M169-M232 WeakPolarHBondContact O-CE 3.38Å; M169-M232 HydrophobicContact SD-CE 4.14Å; M169-L238 HydrophobicContact CG-CD2 4.32Å; M169-L238 HydrophobicContact SD-CD2 3.7Å; M169-L238 HydrophobicContact SD-CG 3.97Å; M169-V239 HydrophobicContact CE-CG2 3.34Å; M169-V239 HydrophobicContact SD-CG2 4Å |
| 170 | S | 74.8 | Confident | 83.8 | Confident | 12 Ų | 12 | 56.8 Ų | 56.8 | 8% | 0.084 | 33% | 0.328 | C | S | . | . | trans | -95.4 | 147.6 | 177.2 | 67.9 | 0 | 0 | 0 | 0 | 113.5 | L166 T172 | L166-S170 PolarHBondContact O-N 3.47Å; L166-S170 PolarHBondContact O-OG 3.36Å; L166-S170 VanDerWaalsContact O-OG 3.07Å; S170-T172 WeakPolarHBondContact CB-O 3.46Å; S170-T172 PolarHBondContact OG-O 3Å | ||
| 171 | M | 67.5 | Low | 83.5 | Confident | 195 Ų | 195 | 52.7 Ų | 52.7 | 96% | 0.961 | 31% | 0.308 | S | S | * | . | S | Bend | trans | -79.9 | -24.4 | 165 | -61.9 | -65.1 | 161.4 | 0 | 0 | 111.5 | ||
| 172 | T | 69.5 | Low | 83.2 | Confident | 96 Ų | 96 | 51.4 Ų | 51.4 | 59% | 0.589 | 29% | 0.294 | S | S | * | . | S | Bend | trans | -100 | 95.2 | 175.3 | -43.4 | 0 | 0 | 0 | 0 | 108.1 | S170 | S170-T172 WeakPolarHBondContact CB-O 3.46Å; S170-T172 PolarHBondContact OG-O 3Å |
| 173 | G | 72.1 | Confident | 83.1 | Confident | 55 Ų | 55 | 51.3 Ų | 51.3 | 57% | 0.567 | 29% | 0.293 | S | S | * | . | P | Polyproline II helix | trans | -60.2 | 142.9 | -174.3 | 0 | 0 | 0 | 0 | 0 | 113.4 | N167 | N167-G173 WeakPolarHBondContact OD1-CA 3.16Š|
| 174 | V | 80 | Confident | 82.9 | Confident | 13 Ų | 13 | 47.6 Ų | 47.6 | 8% | 0.079 | 28% | 0.28 | C | S | . | . | P | Polyproline II helix | trans | -99.9 | 141.6 | -175.2 | 68.5 | 0 | 0 | 0 | 0 | 111.4 | Y163 L166 N167 C178 V179 L230 | Y163-V174 WeakPolarHBondContact CE2-O 3.29Å; L166-V174 HydrophobicContact CB-CG1 3.64Å; L166-V174 HydrophobicContact CD1-CG1 4.28Å; N167-V174 PolarHBondContact ND2-O 2.95Å; N167-V174 PolarHBondContact OD1-N 3.36Å; V174-C178 HydrophobicContact CG2-CB 3.92Å; V174-V179 HydrophobicContact CB-CG2 4.42Å; V174-V179 HydrophobicContact CG1-CG2 3.6Å; V174-V179 HydrophobicContact CG2-CG2 3.9Å; V174-L230 HydrophobicContact CB-CD1 3.98Å; V174-L230 HydrophobicContact CG2-CD1 4.04Å |
| 175 | S | 85.4 | Confident | 82.7 | Confident | 68 Ų | 68 | 49 Ų | 49 | 48% | 0.476 | 28% | 0.276 | S | S | . | . | P | Polyproline II helix | trans | -72.6 | 146.4 | 177.5 | 77.4 | 0 | 0 | 0 | 0 | 112.1 | G177 C178 V179 | S175-G177 VanDerWaalsContact C-N 3.27Å; S175-G177 PolarHBondContact O-N 2.91Å; S175-C178 WeakPolarHBondContact O-CB 3.13Å; S175-C178 PolarHBondContact O-N 3.13Å; S175-C178 VanDerWaalsContact OG-CB 3.23Å; S175-C178 WeakPolarHBondContact OG-CB 3.04Å; S175-C178 PolarHBondContact OG-N 2.89Å; S175-C178 VanDerWaalsContact OG-N 3.12Å; S175-V179 PolarHBondContact O-N 3.39Å |
| 176 | F | 84.6 | Confident | 82.5 | Confident | 93 Ų | 93 | 45.2 Ų | 45.2 | 41% | 0.408 | 26% | 0.257 | S | S | . | . | H | α-helix | trans | -61.3 | -37.4 | 177.8 | -179.1 | -98.7 | 0 | 0 | 0 | 112 | C159 Y163 V179 A180 | C159-F176 HydrophobicContact CB-CE2 4.35Å; C159-F176 HydrophobicContact CB-CZ 4.44Å; Y163-F176 HydrophobicContact CD1-CD2 4.44Å; Y163-F176 HydrophobicContact CD2-CB 3.89Å; Y163-F176 HydrophobicContact CD2-CD2 4.07Å; Y163-F176 HydrophobicContact CD2-CG 4.5Å; Y163-F176 HydrophobicContact CE2-CB 3.81Å; Y163-F176 AromaticContact CG-CD2 3.96Å; Y163-F176 HydrophobicContact CG-CD2 3.96Å; F176-V179 PolarHBondContact O-N 3.28Å; F176-A180 WeakPolarHBondContact O-CB 3.4Å; F176-A180 PolarHBondContact O-N 3.02Å |
| 177 | G | 82.9 | Confident | 82.5 | Confident | 15 Ų | 15 | 45.4 Ų | 45.4 | 16% | 0.155 | 26% | 0.259 | C | S | . | . | H | α-helix | trans | -59.5 | -45.5 | 173.6 | 0 | 0 | 0 | 0 | 0 | 112.7 | S175 V179 A180 S181 | S175-G177 VanDerWaalsContact C-N 3.27Å; S175-G177 PolarHBondContact O-N 2.91Å; G177-V179 VanDerWaalsContact C-N 3.35Å; G177-V179 PolarHBondContact O-N 3.14Å; G177-A180 PolarHBondContact O-N 3.43Å; G177-S181 VanDerWaalsContact O-CB 3.32Å; G177-S181 WeakPolarHBondContact O-CB 3.31Å; G177-S181 PolarHBondContact O-N 3.5Å; G177-S181 PolarHBondContact O-OG 2.9Å |
| 178 | C | 82.9 | Confident | 82.4 | Confident | 10 Ų | 10 | 44.7 Ų | 44.7 | 7% | 0.068 | 25% | 0.254 | C | S | . | . | H | α-helix | trans | -57.1 | -46.4 | 174.5 | 173.4 | 0 | 0 | 0 | 0 | 111.7 | M121 V174 S175 S181 V182 | M121-C178 HydrophobicContact CG-CB 4.2Å; M121-C178 VanDerWaalsContact SD-SG 3.62Å; V174-C178 HydrophobicContact CG2-CB 3.92Å; S175-C178 WeakPolarHBondContact O-CB 3.13Å; S175-C178 PolarHBondContact O-N 3.13Å; S175-C178 VanDerWaalsContact OG-CB 3.23Å; S175-C178 WeakPolarHBondContact OG-CB 3.04Å; S175-C178 PolarHBondContact OG-N 2.89Å; S175-C178 VanDerWaalsContact OG-N 3.12Å; C178-S181 PolarHBondContact O-N 3.45Å; C178-V182 VanDerWaalsContact O-CG2 3.32Å; C178-V182 WeakPolarHBondContact O-CG2 3.19Å; C178-V182 PolarHBondContact O-N 2.87Å |
| 179 | V | 87.6 | Confident | 82.4 | Confident | 0 Ų | 0 | 38.8 Ų | 38.8 | 0% | 0 | 23% | 0.225 | C | C | . | . | H | α-helix | trans | -66.2 | -45.6 | -179 | -178.3 | 0 | 0 | 0 | 0 | 111.6 | M162 Y163 L166 V174 S175 F176 G177 S181 L183 F226 | M162-V179 HydrophobicContact CB-CG1 3.76Å; Y163-V179 HydrophobicContact CD2-CG2 4.28Å; L166-V179 HydrophobicContact CD1-CG1 4.1Å; L166-V179 HydrophobicContact CD1-CG2 3.67Å; V174-V179 HydrophobicContact CB-CG2 4.42Å; V174-V179 HydrophobicContact CG1-CG2 3.6Å; V174-V179 HydrophobicContact CG2-CG2 3.9Å; S175-V179 PolarHBondContact O-N 3.39Å; F176-V179 PolarHBondContact O-N 3.28Å; G177-V179 VanDerWaalsContact C-N 3.35Å; G177-V179 PolarHBondContact O-N 3.14Å; V179-S181 VanDerWaalsContact C-N 3.31Å; V179-S181 PolarHBondContact O-N 3.42Å; V179-L183 HydrophobicContact CG1-CD1 3.83Å; V179-L183 HydrophobicContact CG1-CG 4.44Å; V179-L183 WeakPolarHBondContact O-CB 3.21Å; V179-L183 VanDerWaalsContact O-CG 3.26Å; V179-L183 WeakPolarHBondContact O-CG 3.46Å; V179-L183 PolarHBondContact O-N 3.33Å; V179-L183 VanDerWaalsContact O-N 3.11Å; V179-F226 HydrophobicContact CB-CE1 4.44Å; V179-F226 HydrophobicContact CG1-CE1 4.39Å; V179-F226 HydrophobicContact CG1-CZ 4.19Å; V179-F226 HydrophobicContact CG2-CE1 4.21Å |
| 180 | A | 87.4 | Confident | 82.6 | Confident | 10 Ų | 10 | 36.6 Ų | 36.6 | 8% | 0.083 | 21% | 0.214 | C | C | . | . | H | α-helix | trans | -60.5 | -40.8 | 175.2 | 0 | 0 | 0 | 0 | 0 | 112 | L126 F176 G177 G184 | L126-A180 HydrophobicContact CD1-CB 4.22Å; F176-A180 WeakPolarHBondContact O-CB 3.4Å; F176-A180 PolarHBondContact O-N 3.02Å; G177-A180 PolarHBondContact O-N 3.43Å; A180-G184 PolarHBondContact O-N 3.18Å |
| 181 | S | 85.4 | Confident | 83.3 | Confident | 13 Ų | 13 | 37.1 Ų | 37.1 | 9% | 0.091 | 22% | 0.216 | C | C | . | . | H | α-helix | trans | -63.9 | -58.1 | 176.4 | -71.6 | 0 | 0 | 0 | 0 | 112.8 | G177 C178 V179 L183 G184 Y185 | G177-S181 VanDerWaalsContact O-CB 3.32Å; G177-S181 WeakPolarHBondContact O-CB 3.31Å; G177-S181 PolarHBondContact O-N 3.5Å; G177-S181 PolarHBondContact O-OG 2.9Å; C178-S181 PolarHBondContact O-N 3.45Å; V179-S181 VanDerWaalsContact C-N 3.31Å; V179-S181 PolarHBondContact O-N 3.42Å; S181-L183 VanDerWaalsContact C-N 3.26Å; S181-L183 PolarHBondContact O-N 2.94Å; S181-G184 PolarHBondContact O-N 3.39Å; S181-Y185 WeakPolarHBondContact O-CD2 3.48Å; S181-Y185 PolarHBondContact O-N 2.98Å |
| 182 | V | 85.9 | Confident | 84.2 | Confident | 7 Ų | 7 | 32 Ų | 32 | 4% | 0.042 | 19% | 0.192 | C | C | . | . | H | α-helix | trans | -57.9 | -40.1 | -177.2 | 174.9 | 0 | 0 | 0 | 0 | 111.6 | M121 C178 C186 A222 I225 F226 | M121-V182 HydrophobicContact CE-CG2 4.31Å; M121-V182 HydrophobicContact SD-CG2 3.93Å; C178-V182 VanDerWaalsContact O-CG2 3.32Å; C178-V182 WeakPolarHBondContact O-CG2 3.19Å; C178-V182 PolarHBondContact O-N 2.87Å; V182-C186 WeakPolarHBondContact O-CB 3.37Å; V182-C186 PolarHBondContact O-N 3.3Å; V182-C186 PolarHBondContact O-SG 3.49Å; V182-A222 HydrophobicContact CG1-CB 4.44Å; V182-I225 HydrophobicContact CB-CG2 4.4Å; V182-I225 HydrophobicContact CG1-CB 3.87Å; V182-I225 HydrophobicContact CG1-CD1 4.27Å; V182-I225 HydrophobicContact CG1-CG2 3.86Å; V182-I225 HydrophobicContact CG2-CB 4.49Å; V182-I225 HydrophobicContact CG2-CG2 3.57Å; V182-F226 HydrophobicContact CB-CE1 3.78Å; V182-F226 HydrophobicContact CB-CE2 4.3Å; V182-F226 HydrophobicContact CB-CZ 3.66Å; V182-F226 HydrophobicContact CG1-CD1 4.25Å; V182-F226 HydrophobicContact CG1-CD2 4.07Å; V182-F226 HydrophobicContact CG1-CE1 3.86Å; V182-F226 HydrophobicContact CG1-CE2 3.67Å; V182-F226 HydrophobicContact CG1-CG 4.34Å; V182-F226 HydrophobicContact CG1-CZ 3.55Å; V182-F226 HydrophobicContact CG2-CE1 4.21Å |
| 183 | L | 88.6 | Confident | 85 | Confident | 4 Ų | 4 | 27.9 Ų | 27.9 | 2% | 0.021 | 17% | 0.166 | C | C | . | . | H | α-helix | trans | -67.3 | -44.5 | 175.2 | -66.3 | 172.7 | 0 | 0 | 0 | 112.3 | C159 M162 V179 S181 C186 L187 F226 L246 Y247 | C159-L183 HydrophobicContact CB-CD1 4.39Å; M162-L183 HydrophobicContact CB-CD1 3.94Å; M162-L183 HydrophobicContact CG-CD1 3.9Å; M162-L183 HydrophobicContact CG-CD2 4.37Å; V179-L183 HydrophobicContact CG1-CD1 3.83Å; V179-L183 HydrophobicContact CG1-CG 4.44Å; V179-L183 WeakPolarHBondContact O-CB 3.21Å; V179-L183 VanDerWaalsContact O-CG 3.26Å; V179-L183 WeakPolarHBondContact O-CG 3.46Å; V179-L183 PolarHBondContact O-N 3.33Å; V179-L183 VanDerWaalsContact O-N 3.11Å; S181-L183 VanDerWaalsContact C-N 3.26Å; S181-L183 PolarHBondContact O-N 2.94Å; L183-C186 PolarHBondContact O-N 2.91Å; L183-L187 PolarHBondContact O-N 3.35Å; L183-F226 HydrophobicContact CD2-CE2 3.97Å; L183-F226 HydrophobicContact CD2-CZ 4.2Å; L183-F226 HydrophobicContact CG-CE2 4.37Å; L183-F226 HydrophobicContact CG-CZ 4.09Å; L183-L246 HydrophobicContact CD1-CD1 4.12Å; L183-L246 HydrophobicContact CD2-CD2 4.44Å; L183-Y247 WeakPolarHBondContact CA-OH 3.34Å; L183-Y247 WeakPolarHBondContact CD2-OH 3.34Å; L183-Y247 PolarHBondContact O-OH 3.49Å |
| 184 | G | 87.4 | Confident | 85.7 | Confident | 5 Ų | 5 | 25.4 Ų | 25.4 | 5% | 0.052 | 14% | 0.14 | C | C | . | . | H | α-helix | trans | -67.4 | -42.6 | -176.9 | 0 | 0 | 0 | 0 | 0 | 114.5 | A180 S181 C186 L187 | A180-G184 PolarHBondContact O-N 3.18Å; S181-G184 PolarHBondContact O-N 3.39Å; G184-C186 VanDerWaalsContact C-N 3.29Å; G184-C186 PolarHBondContact O-N 3.22Å; G184-L187 WeakPolarHBondContact O-CB 3.35Å; G184-L187 PolarHBondContact O-N 3.03Å; G184-L187 VanDerWaalsContact O-N 3.15Å |
| 185 | Y | 84.3 | Confident | 86 | Confident | 96 Ų | 96 | 26.9 Ų | 26.9 | 38% | 0.376 | 15% | 0.151 | S | C | . | . | H | α-helix | trans | -64.8 | -36.1 | 174.5 | -73 | -72.6 | 0 | 0 | 0 | 111.6 | D125 P129 F132 S181 L187 L188 | D125-Y185 WeakPolarHBondContact CB-OH 3.38Å; P129-Y185 HydrophobicContact CG-CD2 4.46Å; P129-Y185 HydrophobicContact CG-CE2 4.11Å; F132-Y185 HydrophobicContact CD2-CD1 4.32Å; F132-Y185 AromaticContact CE2-CD1 3.65Å; F132-Y185 HydrophobicContact CE2-CD1 3.65Å; F132-Y185 AromaticContact CE2-CE1 3.77Å; F132-Y185 HydrophobicContact CE2-CE1 3.77Å; S181-Y185 WeakPolarHBondContact O-CD2 3.48Å; S181-Y185 PolarHBondContact O-N 2.98Å; Y185-L187 PolarHBondContact O-N 3.21Å; Y185-L188 PolarHBondContact O-N 3.38Å |
| 186 | C | 86.1 | Confident | 85.9 | Confident | 12 Ų | 12 | 27.8 Ų | 27.8 | 8% | 0.081 | 15% | 0.147 | C | C | . | . | T | Hydrogen-bonded Turn | trans | -73 | -5.1 | 175.9 | -67.1 | 0 | 0 | 0 | 0 | 114 | V182 L183 G184 P189 C218 A222 Y247 | V182-C186 WeakPolarHBondContact O-CB 3.37Å; V182-C186 PolarHBondContact O-N 3.3Å; V182-C186 PolarHBondContact O-SG 3.49Å; L183-C186 PolarHBondContact O-N 2.91Å; G184-C186 VanDerWaalsContact C-N 3.29Å; G184-C186 PolarHBondContact O-N 3.22Å; C186-P189 WeakPolarHBondContact O-CD 3.37Å; C186-C218 HydrophobicContact CB-CB 4.49Å; C186-C218 VanDerWaalsContact O-CB 3.23Å; C186-C218 WeakPolarHBondContact O-CB 3.48Å; C186-A222 HydrophobicContact CB-CB 4.19Å; C186-Y247 WeakPolarHBondContact CB-OH 3.25Å |
| 187 | L | 85.2 | Confident | 85.8 | Confident | 8 Ų | 8 | 24.3 Ų | 24.3 | 4% | 0.042 | 14% | 0.137 | C | C | . | . | T | Hydrogen-bonded Turn | trans | -76.1 | -17 | 168.7 | -72.7 | 172.2 | 0 | 0 | 0 | 113.7 | L183 G184 Y185 M190 I191 Y247 F250 | L183-L187 PolarHBondContact O-N 3.35Å; G184-L187 WeakPolarHBondContact O-CB 3.35Å; G184-L187 PolarHBondContact O-N 3.03Å; G184-L187 VanDerWaalsContact O-N 3.15Å; Y185-L187 PolarHBondContact O-N 3.21Å; L187-M190 CarbonylContact O-C 3.45Å; L187-M190 WeakPolarHBondContact O-CA 3.38Å; L187-M190 WeakPolarHBondContact O-CB 3.13Å; L187-M190 PolarHBondContact O-N 3.18Å; L187-I191 PolarHBondContact O-N 3.35Å; L187-Y247 HydrophobicContact CD2-CD1 3.73Å; L187-Y247 HydrophobicContact CD2-CE1 3.67Å; L187-Y247 HydrophobicContact CG-CE1 4.11Å; L187-F250 HydrophobicContact CD2-CD2 3.66Å; L187-F250 HydrophobicContact CD2-CE2 3.94Å |
| 188 | L | 84.6 | Confident | 85.7 | Confident | 37 Ų | 37 | 27.1 Ų | 27.1 | 19% | 0.194 | 15% | 0.148 | C | C | . | . | H | α-helix | trans | -54 | -45.2 | -174.9 | -171.5 | 161.7 | 0 | 0 | 0 | 113.4 | T106 L110 F132 Y185 M190 I191 L192 | T106-L188 HydrophobicContact CG2-CD1 3.73Å; L110-L188 HydrophobicContact CD1-CD2 4.07Å; F132-L188 HydrophobicContact CE1-CD1 4.15Å; F132-L188 HydrophobicContact CZ-CD1 4.24Å; Y185-L188 PolarHBondContact O-N 3.38Å; L188-M190 VanDerWaalsContact C-N 3.29Å; L188-M190 PolarHBondContact O-N 2.89Å; L188-I191 PolarHBondContact O-N 3.27Å; L188-L192 HydrophobicContact CD2-CD1 3.89Å; L188-L192 HydrophobicContact CD2-CG 4.26Å; L188-L192 PolarHBondContact O-N 3.39Å; L188-L192 VanDerWaalsContact O-N 3.11Å |
| 189 | P | 85.5 | Confident | 85.6 | Confident | 19 Ų | 19 | 32.7 Ų | 32.7 | 12% | 0.123 | 18% | 0.175 | C | C | . | . | H | α-helix | trans | -59.8 | -33.5 | 172.8 | -25.5 | 36.5 | 0 | 0 | 0 | 114.4 | L110 C186 L192 L193 I214 | L110-P189 HydrophobicContact CD1-CG 4.21Å; C186-P189 WeakPolarHBondContact O-CD 3.37Å; P189-L192 PolarHBondContact O-N 3Å; P189-L193 PolarHBondContact O-N 3.15Å; P189-L193 VanDerWaalsContact O-N 3.1Å; P189-I214 HydrophobicContact CB-CG2 3.59Å |
| 190 | M | 87.6 | Confident | 85 | Confident | 0 Ų | 0 | 38.3 Ų | 38.3 | 0% | 0 | 20% | 0.2 | C | C | . | . | H | α-helix | trans | -73.5 | -32.2 | 176.7 | -70.4 | -58.9 | -53.5 | 0 | 0 | 112.4 | L187 L188 L193 A194 I214 I215 A251 | L187-M190 CarbonylContact O-C 3.45Å; L187-M190 WeakPolarHBondContact O-CA 3.38Å; L187-M190 WeakPolarHBondContact O-CB 3.13Å; L187-M190 PolarHBondContact O-N 3.18Å; L188-M190 VanDerWaalsContact C-N 3.29Å; L188-M190 PolarHBondContact O-N 2.89Å; M190-L193 HydrophobicContact CE-CD2 4.5Å; M190-L193 PolarHBondContact O-N 3.4Å; M190-A194 WeakPolarHBondContact O-CB 2.94Å; M190-A194 PolarHBondContact O-N 3.45Å; M190-I214 HydrophobicContact CG-CG2 4.22Å; M190-I214 HydrophobicContact SD-CB 4.18Å; M190-I214 HydrophobicContact SD-CG2 3.53Å; M190-I214 VanDerWaalsContact SD-CG2 3.53Å; M190-I215 HydrophobicContact SD-CG1 4.31Å; M190-A251 VanDerWaalsContact CE-CA 3.5Å; M190-A251 HydrophobicContact CE-CB 3.47Å; M190-A251 VanDerWaalsContact CE-CB 3.47Å |
| 191 | I | 88.4 | Confident | 84.4 | Confident | 24 Ų | 24 | 42.4 Ų | 42.4 | 12% | 0.123 | 23% | 0.228 | C | C | . | . | H | α-helix | trans | -66.3 | -41.7 | 172.6 | -63 | 166.6 | 0 | 0 | 0 | 110.3 | F132 F136 L187 L188 A194 S195 | F132-I191 HydrophobicContact CB-CD1 3.74Å; F132-I191 HydrophobicContact CD1-CD1 3.92Å; F132-I191 HydrophobicContact CG-CD1 4.23Å; F132-I191 VanDerWaalsContact O-CD1 3.24Å; F132-I191 WeakPolarHBondContact O-CD1 3.16Å; F136-I191 HydrophobicContact CB-CD1 4.47Å; F136-I191 HydrophobicContact CB-CG1 3.91Å; F136-I191 HydrophobicContact CD2-CG1 4.26Å; F136-I191 HydrophobicContact CG-CG1 4.49Å; L187-I191 PolarHBondContact O-N 3.35Å; L188-I191 PolarHBondContact O-N 3.27Å; I191-A194 PolarHBondContact O-N 3.36Å; I191-S195 WeakPolarHBondContact O-CB 3.45Å; I191-S195 PolarHBondContact O-N 2.94Å; I191-S195 PolarHBondContact O-OG 3.35Å |
| 192 | L | 87.1 | Confident | 83.5 | Confident | 88 Ų | 88 | 42.6 Ų | 42.6 | 46% | 0.461 | 23% | 0.228 | S | C | . | . | H | α-helix | trans | -60 | -46.5 | 173.8 | -66.4 | 176.7 | 0 | 0 | 0 | 111 | L188 P189 A194 S195 F196 | L188-L192 HydrophobicContact CD2-CD1 3.89Å; L188-L192 HydrophobicContact CD2-CG 4.26Å; L188-L192 PolarHBondContact O-N 3.39Å; L188-L192 VanDerWaalsContact O-N 3.11Å; P189-L192 PolarHBondContact O-N 3Å; L192-A194 PolarHBondContact O-N 3.38Å; L192-S195 PolarHBondContact O-N 3.06Å; L192-S195 PolarHBondContact O-OG 3.11Å; L192-F196 PolarHBondContact O-N 2.87Å |
| 193 | L | 86.9 | Confident | 82.7 | Confident | 9 Ų | 9 | 50.4 Ų | 50.4 | 5% | 0.047 | 26% | 0.264 | C | S | . | . | H | α-helix | trans | -57.5 | -47.5 | 174 | -176.7 | 156 | 0 | 0 | 0 | 112.5 | P189 M190 S195 F196 G197 L202 I210 A211 I214 V255 | P189-L193 PolarHBondContact O-N 3.15Å; P189-L193 VanDerWaalsContact O-N 3.1Å; M190-L193 HydrophobicContact CE-CD2 4.5Å; M190-L193 PolarHBondContact O-N 3.4Å; L193-S195 PolarHBondContact O-N 3.09Å; L193-F196 PolarHBondContact O-N 2.84Å; L193-G197 PolarHBondContact O-N 2.91Å; L193-L202 HydrophobicContact CD2-CD2 3.82Å; L193-L202 HydrophobicContact CG-CD2 4.18Å; L193-I210 HydrophobicContact CD1-CG2 3.98Å; L193-A211 HydrophobicContact CD1-CB 4.03Å; L193-I214 HydrophobicContact CD1-CB 4.09Å; L193-I214 HydrophobicContact CD1-CG1 4.01Å; L193-V255 HydrophobicContact CD2-CG2 4.35Å |
| 194 | A | 86.6 | Confident | 82.2 | Confident | 3 Ų | 3 | 52 Ų | 52 | 3% | 0.025 | 28% | 0.281 | C | S | . | . | H | α-helix | trans | -61.5 | -43.5 | 178.8 | 0 | 0 | 0 | 0 | 0 | 112.1 | F136 M190 I191 L192 F196 G197 I198 S254 | F136-A194 HydrophobicContact CD2-CB 4.05Å; F136-A194 HydrophobicContact CE2-CB 3.88Å; M190-A194 WeakPolarHBondContact O-CB 2.94Å; M190-A194 PolarHBondContact O-N 3.45Å; I191-A194 PolarHBondContact O-N 3.36Å; L192-A194 PolarHBondContact O-N 3.38Å; A194-F196 VanDerWaalsContact C-N 3.34Å; A194-F196 PolarHBondContact O-N 3.31Å; A194-G197 WeakPolarHBondContact O-CA 3.4Å; A194-G197 PolarHBondContact O-N 3.46Å; A194-G197 VanDerWaalsContact O-N 3.12Å; A194-I198 PolarHBondContact O-N 3.44Å; A194-S254 WeakPolarHBondContact CA-OG 3.33Å; A194-S254 WeakPolarHBondContact CB-OG 3.38Å |
| 195 | S | 85.3 | Confident | 82 | Confident | 43 Ų | 43 | 58.9 Ų | 58.9 | 30% | 0.301 | 31% | 0.314 | S | S | . | . | H | α-helix | trans | -63.8 | -37.6 | 176.2 | 74.5 | 0 | 0 | 0 | 0 | 112.7 | I191 L192 L193 G197 I198 | I191-S195 WeakPolarHBondContact O-CB 3.45Å; I191-S195 PolarHBondContact O-N 2.94Å; I191-S195 PolarHBondContact O-OG 3.35Å; L192-S195 PolarHBondContact O-N 3.06Å; L192-S195 PolarHBondContact O-OG 3.11Å; L193-S195 PolarHBondContact O-N 3.09Å; S195-G197 VanDerWaalsContact C-N 3.29Å; S195-G197 PolarHBondContact O-N 2.95Å; S195-I198 WeakPolarHBondContact O-CB 3.32Å; S195-I198 PolarHBondContact O-N 3.24Å |
| 196 | F | 84.4 | Confident | 82 | Confident | 88 Ų | 88 | 61.2 Ų | 61.2 | 39% | 0.386 | 33% | 0.326 | S | S | . | . | H | α-helix | trans | -66.1 | -34.5 | 173.8 | -166.6 | -92.6 | 0 | 0 | 0 | 111.2 | L192 L193 A194 I198 I199 F200 L202 | L192-F196 PolarHBondContact O-N 2.87Å; L193-F196 PolarHBondContact O-N 2.84Å; A194-F196 VanDerWaalsContact C-N 3.34Å; A194-F196 PolarHBondContact O-N 3.31Å; F196-I198 PolarHBondContact O-N 2.87Å; F196-I199 PolarHBondContact O-N 3.34Å; F196-I199 VanDerWaalsContact O-N 3.11Å; F196-F200 HydrophobicContact CD1-CB 4.16Å; F196-F200 AromaticContact CD1-CD2 4Å; F196-F200 HydrophobicContact CD1-CD2 4Å; F196-F200 HydrophobicContact CD1-CG 4.44Å; F196-F200 AromaticContact CD2-CD2 3.97Å; F196-F200 HydrophobicContact CD2-CD2 3.97Å; F196-F200 HydrophobicContact CD2-CE2 4.27Å; F196-F200 HydrophobicContact CE1-CB 3.79Å; F196-F200 AromaticContact CE1-CD2 3.53Å; F196-F200 HydrophobicContact CE1-CD2 3.53Å; F196-F200 HydrophobicContact CE1-CE2 4.32Å; F196-F200 AromaticContact CE1-CG 3.81Å; F196-F200 HydrophobicContact CE1-CG 3.81Å; F196-F200 AromaticContact CE2-CD2 3.49Å; F196-F200 HydrophobicContact CE2-CD2 3.49Å; F196-F200 VanDerWaalsContact CE2-CD2 3.49Å; F196-F200 AromaticContact CE2-CE2 3.55Å; F196-F200 HydrophobicContact CE2-CE2 3.55Å; F196-F200 HydrophobicContact CE2-CG 4.49Å; F196-F200 HydrophobicContact CG-CD2 4.21Å; F196-F200 HydrophobicContact CZ-CB 4.35Å; F196-F200 AromaticContact CZ-CD2 3.25Å; F196-F200 HydrophobicContact CZ-CD2 3.25Å; F196-F200 AromaticContact CZ-CE2 3.58Å; F196-F200 HydrophobicContact CZ-CE2 3.58Å; F196-F200 AromaticContact CZ-CG 3.85Å; F196-F200 HydrophobicContact CZ-CG 3.85Å; F196-F200 HydrophobicContact CZ-CZ 4.4Å; F196-F200 PolarHBondContact O-N 3.4Å; F196-L202 HydrophobicContact CD1-CD1 3.85Å |
| 197 | G | 81.8 | Confident | 81.9 | Confident | 20 Ų | 20 | 60.7 Ų | 60.7 | 21% | 0.206 | 32% | 0.322 | C | S | . | . | H | α-helix | trans | -64 | -18.6 | 173.4 | 0 | 0 | 0 | 0 | 0 | 115.7 | L193 A194 S195 F200 | L193-G197 PolarHBondContact O-N 2.91Å; A194-G197 WeakPolarHBondContact O-CA 3.4Å; A194-G197 PolarHBondContact O-N 3.46Å; A194-G197 VanDerWaalsContact O-N 3.12Å; S195-G197 VanDerWaalsContact C-N 3.29Å; S195-G197 PolarHBondContact O-N 2.95Å; G197-F200 CarbonylContact C-O 3.52Å; G197-F200 WeakPolarHBondContact CA-O 3.49Å |
| 198 | I | 81.6 | Confident | 82 | Confident | 74 Ų | 74 | 64.3 Ų | 64.3 | 38% | 0.379 | 34% | 0.341 | S | S | . | . | H | α-helix | trans | -77.8 | -37.4 | 171.2 | -58.4 | 170 | 0 | 0 | 0 | 110.5 | T139 L142 A194 S195 F196 | T139-I198 HydrophobicContact CG2-CD1 4.14Å; L142-I198 HydrophobicContact CB-CD1 4.04Å; L142-I198 HydrophobicContact CD1-CD1 4.43Å; A194-I198 PolarHBondContact O-N 3.44Å; S195-I198 WeakPolarHBondContact O-CB 3.32Å; S195-I198 PolarHBondContact O-N 3.24Å; F196-I198 PolarHBondContact O-N 2.87Å |
| 199 | I | 79.9 | Confident | 82.3 | Confident | 127 Ų | 127 | 67 Ų | 67 | 65% | 0.651 | 35% | 0.354 | S | S | * | . | H | α-helix | trans | -84.9 | -40.6 | -175 | -56 | 172.9 | 0 | 0 | 0 | 111 | F196 | F196-I199 PolarHBondContact O-N 3.34Å; F196-I199 VanDerWaalsContact O-N 3.11Å |
| 200 | F | 75.8 | Confident | 82.4 | Confident | 118 Ų | 118 | 68.5 Ų | 68.5 | 52% | 0.518 | 36% | 0.361 | S | S | . | . | S | Bend | trans | -121.8 | 122 | 178.8 | -62.9 | -88.3 | 0 | 0 | 0 | 108.9 | F196 G197 L202 | F196-F200 HydrophobicContact CD1-CB 4.16Å; F196-F200 AromaticContact CD1-CD2 4Å; F196-F200 HydrophobicContact CD1-CD2 4Å; F196-F200 HydrophobicContact CD1-CG 4.44Å; F196-F200 AromaticContact CD2-CD2 3.97Å; F196-F200 HydrophobicContact CD2-CD2 3.97Å; F196-F200 HydrophobicContact CD2-CE2 4.27Å; F196-F200 HydrophobicContact CE1-CB 3.79Å; F196-F200 AromaticContact CE1-CD2 3.53Å; F196-F200 HydrophobicContact CE1-CD2 3.53Å; F196-F200 HydrophobicContact CE1-CE2 4.32Å; F196-F200 AromaticContact CE1-CG 3.81Å; F196-F200 HydrophobicContact CE1-CG 3.81Å; F196-F200 AromaticContact CE2-CD2 3.49Å; F196-F200 HydrophobicContact CE2-CD2 3.49Å; F196-F200 VanDerWaalsContact CE2-CD2 3.49Å; F196-F200 AromaticContact CE2-CE2 3.55Å; F196-F200 HydrophobicContact CE2-CE2 3.55Å; F196-F200 HydrophobicContact CE2-CG 4.49Å; F196-F200 HydrophobicContact CG-CD2 4.21Å; F196-F200 HydrophobicContact CZ-CB 4.35Å; F196-F200 AromaticContact CZ-CD2 3.25Å; F196-F200 HydrophobicContact CZ-CD2 3.25Å; F196-F200 AromaticContact CZ-CE2 3.58Å; F196-F200 HydrophobicContact CZ-CE2 3.58Å; F196-F200 AromaticContact CZ-CG 3.85Å; F196-F200 HydrophobicContact CZ-CG 3.85Å; F196-F200 HydrophobicContact CZ-CZ 4.4Å; F196-F200 PolarHBondContact O-N 3.4Å; G197-F200 CarbonylContact C-O 3.52Å; G197-F200 WeakPolarHBondContact CA-O 3.49Å; F200-L202 PolarHBondContact O-N 3.35Å |
| 201 | S | 73.8 | Confident | 82.5 | Confident | 95 Ų | 95 | 68.8 Ų | 68.8 | 66% | 0.664 | 36% | 0.364 | S | S | * | . | trans | -59 | 111.2 | 175.1 | -178.5 | 0 | 0 | 0 | 0 | 110.2 | Q203 | S201-Q203 PolarHBondContact O-N 3.14Å; S201-Q203 VanDerWaalsContact OG-CB 3.29Å; S201-Q203 WeakPolarHBondContact OG-CB 3.37Å | ||
| 202 | L | 67.3 | Low | 82.6 | Confident | 18 Ų | 18 | 70.5 Ų | 70.5 | 9% | 0.094 | 38% | 0.381 | C | S | . | . | trans | -73.4 | 10.3 | -179.8 | -118 | 83.6 | 0 | 0 | 0 | 113.2 | L193 F196 F200 G204 G207 V255 | L193-L202 HydrophobicContact CD2-CD2 3.82Å; L193-L202 HydrophobicContact CG-CD2 4.18Å; F196-L202 HydrophobicContact CD1-CD1 3.85Å; F200-L202 PolarHBondContact O-N 3.35Å; L202-G204 PolarHBondContact O-N 3.02Å; L202-G207 WeakPolarHBondContact O-CA 3.33Å; L202-V255 HydrophobicContact CD2-CG2 3.81Å | ||
| 203 | Q | 68.8 | Low | 82.8 | Confident | 171 Ų | 171 | 70.7 Ų | 70.7 | 80% | 0.799 | 39% | 0.386 | S | S | * | . | trans | -76.7 | 75.9 | -167.1 | -164.3 | 172.8 | 18 | 0 | 0 | 112.5 | S201 | S201-Q203 PolarHBondContact O-N 3.14Å; S201-Q203 VanDerWaalsContact OG-CB 3.29Å; S201-Q203 WeakPolarHBondContact OG-CB 3.37Å | ||
| 204 | G | 78 | Confident | 83 | Confident | 36 Ų | 36 | 72.2 Ų | 72.2 | 37% | 0.371 | 39% | 0.394 | S | S | . | . | S | Bend | trans | 166.6 | -175 | 173.8 | 0 | 0 | 0 | 0 | 0 | 113.7 | L202 F206 G207 I208 | L202-G204 PolarHBondContact O-N 3.02Å; G204-F206 PolarHBondContact O-N 2.93Å; G204-F206 VanDerWaalsContact O-N 3.12Å; G204-G207 PolarHBondContact O-N 3.39Å; G204-G207 VanDerWaalsContact O-N 3.08Å; G204-I208 PolarHBondContact O-N 2.87Å |
| 205 | M | 83 | Confident | 83.2 | Confident | 151 Ų | 151 | 73.5 Ų | 73.5 | 74% | 0.744 | 40% | 0.4 | S | S | * | . | H | α-helix | trans | -54 | -34.4 | -178.3 | -174 | 174.2 | 70 | 0 | 0 | 113.3 | I208 I209 | M205-I208 PolarHBondContact O-N 2.79Å; M205-I209 HydrophobicContact CG-CD1 3.92Å; M205-I209 HydrophobicContact CG-CG1 4.47Å; M205-I209 VanDerWaalsContact O-CG1 3.29Å; M205-I209 WeakPolarHBondContact O-CG1 3.27Å; M205-I209 PolarHBondContact O-N 3.29Å |
| 206 | F | 84.3 | Confident | 83.5 | Confident | 144 Ų | 144 | 73.3 Ų | 73.3 | 63% | 0.632 | 41% | 0.405 | S | S | * | . | H | α-helix | trans | -63.1 | -45.1 | 177.6 | -175.3 | -111.1 | 0 | 0 | 0 | 112.7 | G204 I208 I209 I210 | G204-F206 PolarHBondContact O-N 2.93Å; G204-F206 VanDerWaalsContact O-N 3.12Å; F206-I208 VanDerWaalsContact C-N 3.34Å; F206-I208 PolarHBondContact O-N 3.01Å; F206-I209 PolarHBondContact O-N 3.28Å; F206-I210 HydrophobicContact CD1-CD1 3.94Å; F206-I210 HydrophobicContact CE1-CD1 3.47Å; F206-I210 VanDerWaalsContact CE1-CD1 3.47Å; F206-I210 HydrophobicContact CE2-CD1 4.13Å; F206-I210 HydrophobicContact CG-CD1 4.46Å; F206-I210 HydrophobicContact CZ-CD1 3.59Å; F206-I210 WeakPolarHBondContact O-CG1 3.43Å; F206-I210 PolarHBondContact O-N 2.89Å |
| 207 | G | 84.3 | Confident | 83.7 | Confident | 1 Ų | 1 | 74.7 Ų | 74.7 | 1% | 0.01 | 41% | 0.408 | C | S | . | . | H | α-helix | trans | -65.9 | -36.3 | 176 | 0 | 0 | 0 | 0 | 0 | 112.8 | L202 G204 I210 A211 | L202-G207 WeakPolarHBondContact O-CA 3.33Å; G204-G207 PolarHBondContact O-N 3.39Å; G204-G207 VanDerWaalsContact O-N 3.08Å; G207-I210 PolarHBondContact O-N 2.96Å; G207-A211 VanDerWaalsContact O-CB 3.23Å; G207-A211 WeakPolarHBondContact O-CB 3.5Å; G207-A211 PolarHBondContact O-N 3.13Å |
| 208 | I | 87.2 | Confident | 84 | Confident | 85 Ų | 85 | 73.8 Ų | 73.8 | 44% | 0.436 | 40% | 0.398 | S | S | . | . | H | α-helix | trans | -64.2 | -42.5 | 174.4 | -60.3 | 170.3 | 0 | 0 | 0 | 111.1 | G204 M205 F206 A211 A212 F256 | G204-I208 PolarHBondContact O-N 2.87Å; M205-I208 PolarHBondContact O-N 2.79Å; F206-I208 VanDerWaalsContact C-N 3.34Å; F206-I208 PolarHBondContact O-N 3.01Å; I208-A211 PolarHBondContact O-N 3.19Å; I208-A212 WeakPolarHBondContact O-CB 3.36Å; I208-A212 PolarHBondContact O-N 3.16Å; I208-F256 HydrophobicContact CD1-CZ 4Å; I208-F256 HydrophobicContact CG1-CZ 3.99Å |
| 209 | I | 90.6 | Very high | 84.4 | Confident | 92 Ų | 92 | 70.5 Ų | 70.5 | 47% | 0.472 | 38% | 0.382 | S | S | . | . | H | α-helix | trans | -63.8 | -47.9 | 177.6 | -70.6 | 163.7 | 0 | 0 | 0 | 110.7 | M205 F206 A211 A212 T213 | M205-I209 HydrophobicContact CG-CD1 3.92Å; M205-I209 HydrophobicContact CG-CG1 4.47Å; M205-I209 VanDerWaalsContact O-CG1 3.29Å; M205-I209 WeakPolarHBondContact O-CG1 3.27Å; M205-I209 PolarHBondContact O-N 3.29Å; F206-I209 PolarHBondContact O-N 3.28Å; I209-A211 PolarHBondContact O-N 3.07Å; I209-A212 PolarHBondContact O-N 3.21Å; I209-T213 PolarHBondContact O-N 3Å; I209-T213 PolarHBondContact O-OG1 3.4Å; I209-T213 VanDerWaalsContact O-OG1 3.07Å |
| 210 | I | 88.6 | Confident | 84.8 | Confident | 51 Ų | 51 | 69.8 Ų | 69.8 | 26% | 0.262 | 37% | 0.374 | S | S | . | . | H | α-helix | trans | -61.9 | -45.2 | 177.4 | -67.5 | 174.5 | 0 | 0 | 0 | 110.4 | L193 F206 G207 A212 T213 I214 | L193-I210 HydrophobicContact CD1-CG2 3.98Å; F206-I210 HydrophobicContact CD1-CD1 3.94Å; F206-I210 HydrophobicContact CE1-CD1 3.47Å; F206-I210 VanDerWaalsContact CE1-CD1 3.47Å; F206-I210 HydrophobicContact CE2-CD1 4.13Å; F206-I210 HydrophobicContact CG-CD1 4.46Å; F206-I210 HydrophobicContact CZ-CD1 3.59Å; F206-I210 WeakPolarHBondContact O-CG1 3.43Å; F206-I210 PolarHBondContact O-N 2.89Å; G207-I210 PolarHBondContact O-N 2.96Å; I210-A212 PolarHBondContact O-N 3.4Å; I210-T213 PolarHBondContact O-N 3.14Å; I210-I214 HydrophobicContact CG2-CG1 4.31Å; I210-I214 WeakPolarHBondContact O-CG1 3.11Å; I210-I214 PolarHBondContact O-N 3.43Å |
| 211 | A | 89.4 | Confident | 85.2 | Confident | 7 Ų | 7 | 65.7 Ų | 65.7 | 6% | 0.058 | 36% | 0.36 | C | S | . | . | H | α-helix | trans | -57.8 | -48.9 | 175.4 | 0 | 0 | 0 | 0 | 0 | 112.1 | L193 G207 I208 I209 T213 I214 I215 A251 V255 | L193-A211 HydrophobicContact CD1-CB 4.03Å; G207-A211 VanDerWaalsContact O-CB 3.23Å; G207-A211 WeakPolarHBondContact O-CB 3.5Å; G207-A211 PolarHBondContact O-N 3.13Å; I208-A211 PolarHBondContact O-N 3.19Å; I209-A211 PolarHBondContact O-N 3.07Å; A211-T213 VanDerWaalsContact C-N 3.3Å; A211-T213 PolarHBondContact O-N 3.39Å; A211-I214 PolarHBondContact O-N 3.42Å; A211-I215 WeakPolarHBondContact O-CB 3.3Å; A211-I215 VanDerWaalsContact O-CD1 3.3Å; A211-I215 WeakPolarHBondContact O-CD1 3.4Å; A211-I215 WeakPolarHBondContact O-CG1 3.4Å; A211-I215 PolarHBondContact O-N 3.5Å; A211-A251 HydrophobicContact CB-CB 4.43Å; A211-V255 HydrophobicContact CB-CG2 4.39Å |
| 212 | A | 91.3 | Very high | 85.8 | Confident | 59 Ų | 59 | 61.1 Ų | 61.1 | 49% | 0.488 | 33% | 0.329 | S | S | . | . | H | α-helix | trans | -58 | -40.8 | 176.8 | 0 | 0 | 0 | 0 | 0 | 112.5 | I208 I209 I210 G216 | I208-A212 WeakPolarHBondContact O-CB 3.36Å; I208-A212 PolarHBondContact O-N 3.16Å; I209-A212 PolarHBondContact O-N 3.21Å; I210-A212 PolarHBondContact O-N 3.4Å; A212-G216 PolarHBondContact O-N 3.48Å |
| 213 | T | 90.4 | Very high | 86.8 | Confident | 92 Ų | 92 | 60.3 Ų | 60.3 | 56% | 0.564 | 32% | 0.324 | S | S | * | . | H | α-helix | trans | -65.8 | -45.8 | 176.2 | -56.5 | 0 | 0 | 0 | 0 | 112.3 | I209 I210 A211 G216 W217 | I209-T213 PolarHBondContact O-N 3Å; I209-T213 PolarHBondContact O-OG1 3.4Å; I209-T213 VanDerWaalsContact O-OG1 3.07Å; I210-T213 PolarHBondContact O-N 3.14Å; A211-T213 VanDerWaalsContact C-N 3.3Å; A211-T213 PolarHBondContact O-N 3.39Å; T213-G216 PolarHBondContact O-N 3.26Å; T213-W217 WeakPolarHBondContact O-CB 3.45Å; T213-W217 PolarHBondContact O-N 2.91Å |
| 214 | I | 90.4 | Very high | 87.4 | Confident | 41 Ų | 41 | 57.1 Ų | 57.1 | 21% | 0.21 | 31% | 0.308 | C | S | . | . | H | α-helix | trans | -69.2 | -41 | 179.6 | -60.3 | -59.8 | 0 | 0 | 0 | 111.5 | P189 M190 L193 I210 A211 G216 W217 C218 | P189-I214 HydrophobicContact CB-CG2 3.59Å; M190-I214 HydrophobicContact CG-CG2 4.22Å; M190-I214 HydrophobicContact SD-CB 4.18Å; M190-I214 HydrophobicContact SD-CG2 3.53Å; M190-I214 VanDerWaalsContact SD-CG2 3.53Å; L193-I214 HydrophobicContact CD1-CB 4.09Å; L193-I214 HydrophobicContact CD1-CG1 4.01Å; I210-I214 HydrophobicContact CG2-CG1 4.31Å; I210-I214 WeakPolarHBondContact O-CG1 3.11Å; I210-I214 PolarHBondContact O-N 3.43Å; A211-I214 PolarHBondContact O-N 3.42Å; I214-G216 VanDerWaalsContact C-N 3.31Å; I214-G216 PolarHBondContact O-N 3.23Å; I214-W217 PolarHBondContact O-N 3.42Å; I214-W217 VanDerWaalsContact O-N 3.16Å; I214-C218 PolarHBondContact O-N 2.96Å; I214-C218 PolarHBondContact O-SG 3.27Å |
| 215 | I | 92.1 | Very high | 87.7 | Confident | 30 Ų | 30 | 57.8 Ų | 57.8 | 15% | 0.154 | 30% | 0.302 | C | S | . | . | H | α-helix | trans | -56.2 | -47.1 | 172.3 | -64.8 | 157.5 | 0 | 0 | 0 | 110 | M190 A211 W217 C218 S219 A244 A251 | M190-I215 HydrophobicContact SD-CG1 4.31Å; A211-I215 WeakPolarHBondContact O-CB 3.3Å; A211-I215 VanDerWaalsContact O-CD1 3.3Å; A211-I215 WeakPolarHBondContact O-CD1 3.4Å; A211-I215 WeakPolarHBondContact O-CG1 3.4Å; A211-I215 PolarHBondContact O-N 3.5Å; I215-W217 VanDerWaalsContact C-N 3.33Å; I215-W217 PolarHBondContact O-N 3.04Å; I215-C218 PolarHBondContact O-SG 2.92Å; I215-S219 WeakPolarHBondContact O-CB 3.42Å; I215-S219 PolarHBondContact O-N 3.36Å; I215-S219 PolarHBondContact O-OG 3.21Å; I215-A244 HydrophobicContact CG2-CB 4.3Å; I215-A251 HydrophobicContact CD1-CB 3.54Å; I215-A251 HydrophobicContact CG1-CB 3.82Å |
| 216 | G | 89.9 | Confident | 87.7 | Confident | 40 Ų | 40 | 50.6 Ų | 50.6 | 41% | 0.412 | 27% | 0.267 | S | S | . | . | H | α-helix | trans | -58.4 | -44.9 | 176.4 | 0 | 0 | 0 | 0 | 0 | 112.3 | A212 T213 I214 F220 | A212-G216 PolarHBondContact O-N 3.48Å; T213-G216 PolarHBondContact O-N 3.26Å; I214-G216 VanDerWaalsContact C-N 3.31Å; I214-G216 PolarHBondContact O-N 3.23Å; G216-F220 VanDerWaalsContact O-CB 3.28Å; G216-F220 WeakPolarHBondContact O-CB 3.26Å; G216-F220 PolarHBondContact O-N 3.11Å |
| 217 | W | 89.8 | Confident | 87.6 | Confident | 117 Ų | 117 | 45 Ų | 45 | 44% | 0.443 | 24% | 0.243 | S | C | . | . | H | α-helix | trans | -66.5 | -47.1 | -178.9 | -169.2 | -95.6 | 0 | 0 | 0 | 113.7 | P112 T213 I214 I215 S221 | P112-W217 HydrophobicContact CB-CH2 4.42Å; P112-W217 HydrophobicContact CB-CZ2 4.2Å; P112-W217 HydrophobicContact CG-CH2 3.91Å; P112-W217 HydrophobicContact CG-CZ2 4.02Å; T213-W217 WeakPolarHBondContact O-CB 3.45Å; T213-W217 PolarHBondContact O-N 2.91Å; I214-W217 PolarHBondContact O-N 3.42Å; I214-W217 VanDerWaalsContact O-N 3.16Å; I215-W217 VanDerWaalsContact C-N 3.33Å; I215-W217 PolarHBondContact O-N 3.04Å; W217-S221 WeakPolarHBondContact O-CB 3.4Å; W217-S221 PolarHBondContact O-N 3.4Å; W217-S221 PolarHBondContact O-OG 3.47Å |
| 218 | C | 88.4 | Confident | 87.3 | Confident | 1 Ų | 1 | 48.5 Ų | 48.5 | 1% | 0.007 | 27% | 0.268 | C | S | . | . | H | α-helix | trans | -70.8 | -35.2 | 178.4 | 64.1 | 0 | 0 | 0 | 0 | 112.1 | C186 I214 I215 S221 A222 Y247 | C186-C218 HydrophobicContact CB-CB 4.49Å; C186-C218 VanDerWaalsContact O-CB 3.23Å; C186-C218 WeakPolarHBondContact O-CB 3.48Å; I214-C218 PolarHBondContact O-N 2.96Å; I214-C218 PolarHBondContact O-SG 3.27Å; I215-C218 PolarHBondContact O-SG 2.92Å; C218-S221 PolarHBondContact O-N 3.13Å; C218-A222 VanDerWaalsContact O-CB 3.3Å; C218-A222 WeakPolarHBondContact O-CB 3.45Å; C218-A222 PolarHBondContact O-N 2.91Å; C218-Y247 HydrophobicContact CB-CD2 4.36Å; C218-Y247 HydrophobicContact CB-CE2 4.38Å; C218-Y247 WeakPolarHBondContact SG-CD2 3.26Å |
| 219 | S | 90.1 | Very high | 86.7 | Confident | 4 Ų | 4 | 46.4 Ų | 46.4 | 3% | 0.028 | 26% | 0.263 | C | S | . | . | H | α-helix | trans | -67.9 | -41.9 | 176.1 | -53.5 | 0 | 0 | 0 | 0 | 112.2 | I215 S223 A244 | I215-S219 WeakPolarHBondContact O-CB 3.42Å; I215-S219 PolarHBondContact O-N 3.36Å; I215-S219 PolarHBondContact O-OG 3.21Å; S219-S223 VanDerWaalsContact O-CB 3.29Å; S219-S223 WeakPolarHBondContact O-CB 3.18Å; S219-S223 PolarHBondContact O-N 3.21Å; S219-S223 PolarHBondContact O-OG 3.03Å; S219-A244 WeakPolarHBondContact OG-CA 3.23Å; S219-A244 WeakPolarHBondContact OG-CB 3.41Å; S219-A244 PolarHBondContact OG-N 2.75Å |
| 220 | F | 87.1 | Confident | 85.9 | Confident | 112 Ų | 112 | 42.4 Ų | 42.4 | 49% | 0.491 | 24% | 0.242 | S | C | . | . | H | α-helix | trans | -63.4 | -47.3 | 175 | -171.7 | -96 | 0 | 0 | 0 | 110.7 | G216 S223 K224 Q236 | G216-F220 VanDerWaalsContact O-CB 3.28Å; G216-F220 WeakPolarHBondContact O-CB 3.26Å; G216-F220 PolarHBondContact O-N 3.11Å; F220-S223 PolarHBondContact O-N 3.44Å; F220-S223 PolarHBondContact O-OG 2.85Å; F220-K224 HydrophobicContact CD1-CG 4.39Å; F220-K224 HydrophobicContact CE1-CG 4.11Å; F220-K224 PolarHBondContact O-N 2.96Å; F220-Q236 VanDerWaalsContact CD2-NE2 3.33Å |
| 221 | S | 85.1 | Confident | 85 | Confident | 32 Ų | 32 | 43.9 Ų | 43.9 | 22% | 0.224 | 26% | 0.263 | C | S | . | . | H | α-helix | trans | -57.4 | -52.2 | 176.1 | -59.5 | 0 | 0 | 0 | 0 | 112.5 | W217 C218 S223 K224 I225 | W217-S221 WeakPolarHBondContact O-CB 3.4Å; W217-S221 PolarHBondContact O-N 3.4Å; W217-S221 PolarHBondContact O-OG 3.47Å; C218-S221 PolarHBondContact O-N 3.13Å; S221-S223 PolarHBondContact O-N 2.9Å; S221-K224 PolarHBondContact O-N 3.4Å; S221-I225 WeakPolarHBondContact O-CG1 3.41Å; S221-I225 PolarHBondContact O-N 3.12Å |
| 222 | A | 86.2 | Confident | 83.9 | Confident | 0 Ų | 0 | 45 Ų | 45 | 0% | 0 | 27% | 0.267 | C | S | . | . | H | α-helix | trans | -60 | -44.6 | 178.2 | 0 | 0 | 0 | 0 | 0 | 112 | V182 C186 C218 K224 I225 F226 Y247 | V182-A222 HydrophobicContact CG1-CB 4.44Å; C186-A222 HydrophobicContact CB-CB 4.19Å; C218-A222 VanDerWaalsContact O-CB 3.3Å; C218-A222 WeakPolarHBondContact O-CB 3.45Å; C218-A222 PolarHBondContact O-N 2.91Å; A222-K224 VanDerWaalsContact C-N 3.34Å; A222-K224 PolarHBondContact O-N 2.84Å; A222-I225 PolarHBondContact O-N 3Å; A222-F226 HydrophobicContact CB-CE2 4.36Å; A222-F226 WeakPolarHBondContact O-CD2 3.44Å; A222-F226 PolarHBondContact O-N 3.08Å; A222-Y247 HydrophobicContact CB-CE2 4.16Å |
| 223 | S | 87.1 | Confident | 82.6 | Confident | 0 Ų | 0 | 49.3 Ų | 49.3 | 0% | 0 | 28% | 0.282 | C | S | . | . | H | α-helix | trans | -61.5 | -38.9 | 178.9 | 69.3 | 0 | 0 | 0 | 0 | 112.8 | S219 F220 S221 I225 F226 I227 Q236 | S219-S223 VanDerWaalsContact O-CB 3.29Å; S219-S223 WeakPolarHBondContact O-CB 3.18Å; S219-S223 PolarHBondContact O-N 3.21Å; S219-S223 PolarHBondContact O-OG 3.03Å; F220-S223 PolarHBondContact O-N 3.44Å; F220-S223 PolarHBondContact O-OG 2.85Å; S221-S223 PolarHBondContact O-N 2.9Å; S223-I225 PolarHBondContact O-N 3.32Å; S223-F226 PolarHBondContact O-N 3.45Å; S223-I227 WeakPolarHBondContact O-CD1 3.42Å; S223-I227 WeakPolarHBondContact O-CG1 3.32Å; S223-I227 PolarHBondContact O-N 3.5Å; S223-Q236 PolarHBondContact OG-NE2 2.78Å |
| 224 | K | 82.9 | Confident | 81.5 | Confident | 104 Ų | 104 | 49 Ų | 49 | 45% | 0.452 | 30% | 0.296 | S | S | . | . | H | α-helix | trans | -60 | -45.3 | 174.4 | -76.8 | -57.8 | -163.4 | -166.1 | 0 | 112.2 | F220 S221 A222 I227 S228 Q236 | F220-K224 HydrophobicContact CD1-CG 4.39Å; F220-K224 HydrophobicContact CE1-CG 4.11Å; F220-K224 PolarHBondContact O-N 2.96Å; S221-K224 PolarHBondContact O-N 3.4Å; A222-K224 VanDerWaalsContact C-N 3.34Å; A222-K224 PolarHBondContact O-N 2.84Å; K224-I227 PolarHBondContact O-N 3.38Å; K224-S228 PolarHBondContact O-N 2.86Å; K224-S228 VanDerWaalsContact O-N 3.13Å; K224-Q236 VanDerWaalsContact CE-OE1 3.24Å |
| 225 | I | 83.5 | Confident | 80.7 | Confident | 50 Ų | 50 | 51.3 Ų | 51.3 | 26% | 0.256 | 31% | 0.306 | S | S | . | . | H | α-helix | trans | -66.5 | -42.9 | -179.1 | -59.1 | 163.5 | 0 | 0 | 0 | 110.3 | A116 M121 V182 S221 A222 S223 I227 S228 A229 | A116-I225 HydrophobicContact CB-CG2 4.13Å; M121-I225 HydrophobicContact CE-CG2 4.18Å; V182-I225 HydrophobicContact CB-CG2 4.4Å; V182-I225 HydrophobicContact CG1-CB 3.87Å; V182-I225 HydrophobicContact CG1-CD1 4.27Å; V182-I225 HydrophobicContact CG1-CG2 3.86Å; V182-I225 HydrophobicContact CG2-CB 4.49Å; V182-I225 HydrophobicContact CG2-CG2 3.57Å; S221-I225 WeakPolarHBondContact O-CG1 3.41Å; S221-I225 PolarHBondContact O-N 3.12Å; A222-I225 PolarHBondContact O-N 3Å; S223-I225 PolarHBondContact O-N 3.32Å; I225-I227 PolarHBondContact O-N 3.33Å; I225-S228 PolarHBondContact O-N 2.85Å; I225-A229 WeakPolarHBondContact O-CB 3.46Å; I225-A229 PolarHBondContact O-N 3.43Å |
| 226 | F | 83.6 | Confident | 80.1 | Confident | 0 Ų | 0 | 51.5 Ų | 51.5 | 0% | 0 | 31% | 0.307 | C | S | . | . | H | α-helix | trans | -63.1 | -41.6 | 176.5 | -74.5 | -53.1 | 0 | 0 | 0 | 113.4 | M162 L166 V179 V182 L183 A222 S223 S228 A229 L230 V239 | M162-F226 HydrophobicContact CE-CD2 4.39Å; M162-F226 HydrophobicContact CE-CE2 4.04Å; L166-F226 HydrophobicContact CD1-CD1 3.66Å; L166-F226 HydrophobicContact CD1-CE1 3.55Å; L166-F226 HydrophobicContact CD1-CE2 4.46Å; L166-F226 HydrophobicContact CD1-CG 4.2Å; L166-F226 HydrophobicContact CD1-CZ 3.98Å; L166-F226 HydrophobicContact CD2-CB 4.27Å; L166-F226 HydrophobicContact CD2-CD1 4.28Å; L166-F226 HydrophobicContact CD2-CG 4.21Å; V179-F226 HydrophobicContact CB-CE1 4.44Å; V179-F226 HydrophobicContact CG1-CE1 4.39Å; V179-F226 HydrophobicContact CG1-CZ 4.19Å; V179-F226 HydrophobicContact CG2-CE1 4.21Å; V182-F226 HydrophobicContact CB-CE1 3.78Å; V182-F226 HydrophobicContact CB-CE2 4.3Å; V182-F226 HydrophobicContact CB-CZ 3.66Å; V182-F226 HydrophobicContact CG1-CD1 4.25Å; V182-F226 HydrophobicContact CG1-CD2 4.07Å; V182-F226 HydrophobicContact CG1-CE1 3.86Å; V182-F226 HydrophobicContact CG1-CE2 3.67Å; V182-F226 HydrophobicContact CG1-CG 4.34Å; V182-F226 HydrophobicContact CG1-CZ 3.55Å; V182-F226 HydrophobicContact CG2-CE1 4.21Å; L183-F226 HydrophobicContact CD2-CE2 3.97Å; L183-F226 HydrophobicContact CD2-CZ 4.2Å; L183-F226 HydrophobicContact CG-CE2 4.37Å; L183-F226 HydrophobicContact CG-CZ 4.09Å; A222-F226 HydrophobicContact CB-CE2 4.36Å; A222-F226 WeakPolarHBondContact O-CD2 3.44Å; A222-F226 PolarHBondContact O-N 3.08Å; S223-F226 PolarHBondContact O-N 3.45Å; F226-S228 VanDerWaalsContact C-N 3.3Å; F226-S228 PolarHBondContact O-N 2.86Å; F226-A229 PolarHBondContact O-N 3.17Å; F226-L230 WeakPolarHBondContact O-CB 3.24Å; F226-L230 WeakPolarHBondContact O-CD1 3.42Å; F226-L230 PolarHBondContact O-N 3.01Å; F226-V239 HydrophobicContact CB-CG1 3.84Å; F226-V239 HydrophobicContact CD2-CG1 3.84Å; F226-V239 HydrophobicContact CG-CG1 4.16Å |
| 227 | I | 81.8 | Confident | 79.8 | Confident | 26 Ų | 26 | 56.8 Ų | 56.8 | 13% | 0.133 | 33% | 0.325 | C | S | . | . | H | α-helix | trans | -59.3 | -44.5 | 174.9 | -66.1 | 153.9 | 0 | 0 | 0 | 111 | S223 K224 I225 A229 L230 A231 M232 Q236 | S223-I227 WeakPolarHBondContact O-CD1 3.42Å; S223-I227 WeakPolarHBondContact O-CG1 3.32Å; S223-I227 PolarHBondContact O-N 3.5Å; K224-I227 PolarHBondContact O-N 3.38Å; I225-I227 PolarHBondContact O-N 3.33Å; I227-A229 VanDerWaalsContact C-N 3.28Å; I227-A229 PolarHBondContact O-N 2.79Å; I227-L230 PolarHBondContact O-N 3.45Å; I227-A231 WeakPolarHBondContact O-CA 3.32Å; I227-A231 PolarHBondContact O-N 3.44Å; I227-M232 WeakPolarHBondContact CG2-O 3.36Å; I227-M232 PolarHBondContact O-N 2.87Å; I227-Q236 HydrophobicContact CD1-CB 3.42Å; I227-Q236 VanDerWaalsContact CD1-CB 3.42Å; I227-Q236 HydrophobicContact CD1-CG 3.58Å |
| 228 | S | 77.1 | Confident | 79.7 | Confident | 76 Ų | 76 | 56.1 Ų | 56.1 | 53% | 0.531 | 33% | 0.33 | S | S | . | . | H | α-helix | trans | -65.9 | -30.3 | 179.1 | -160.4 | 0 | 0 | 0 | 0 | 112.7 | K224 I225 F226 | K224-S228 PolarHBondContact O-N 2.86Å; K224-S228 VanDerWaalsContact O-N 3.13Å; I225-S228 PolarHBondContact O-N 2.85Å; F226-S228 VanDerWaalsContact C-N 3.3Å; F226-S228 PolarHBondContact O-N 2.86Å |
| 229 | A | 75.9 | Confident | 79.5 | Confident | 41 Ų | 41 | 56.3 Ų | 56.3 | 34% | 0.339 | 33% | 0.331 | S | S | . | . | H | α-helix | trans | -81.6 | -32 | 177.4 | 0 | 0 | 0 | 0 | 0 | 113.4 | M121 I225 F226 I227 | M121-A229 HydrophobicContact CE-CB 3.74Å; I225-A229 WeakPolarHBondContact O-CB 3.46Å; I225-A229 PolarHBondContact O-N 3.43Å; F226-A229 PolarHBondContact O-N 3.17Å; I227-A229 VanDerWaalsContact C-N 3.28Å; I227-A229 PolarHBondContact O-N 2.79Å |
| 230 | L | 73.4 | Confident | 79.4 | Confident | 7 Ų | 7 | 56.9 Ų | 56.9 | 4% | 0.037 | 34% | 0.336 | C | S | . | . | H | α-helix | trans | -96.6 | -7.8 | -177.8 | -82.8 | 57.5 | 0 | 0 | 0 | 113.5 | L166 M169 V174 F226 I227 M232 | L166-L230 HydrophobicContact CB-CD2 4.17Å; L166-L230 HydrophobicContact CD2-CD2 3.55Å; L166-L230 HydrophobicContact CG-CD2 4.44Å; M169-L230 HydrophobicContact CE-CD2 4Å; V174-L230 HydrophobicContact CB-CD1 3.98Å; V174-L230 HydrophobicContact CG2-CD1 4.04Å; F226-L230 WeakPolarHBondContact O-CB 3.24Å; F226-L230 WeakPolarHBondContact O-CD1 3.42Å; F226-L230 PolarHBondContact O-N 3.01Å; I227-L230 PolarHBondContact O-N 3.45Å; L230-M232 HydrophobicContact CB-CB 4.41Å; L230-M232 HydrophobicContact CB-CG 3.87Å; L230-M232 HydrophobicContact CB-SD 4.06Å; L230-M232 HydrophobicContact CD2-SD 4.02Å |
| 231 | A | 70.1 | Confident | 79.6 | Confident | 83 Ų | 83 | 59.7 Ų | 59.7 | 69% | 0.686 | 34% | 0.344 | S | S | * | . | T | Hydrogen-bonded Turn | trans | 56.1 | 43.9 | -172.8 | 0 | 0 | 0 | 0 | 0 | 113.9 | I227 | I227-A231 WeakPolarHBondContact O-CA 3.32Å; I227-A231 PolarHBondContact O-N 3.44Å |
| 232 | M | 66.4 | Low | 79.8 | Confident | 30 Ų | 30 | 59.2 Ų | 59.2 | 15% | 0.148 | 34% | 0.34 | C | S | . | . | trans | -109.6 | 71.4 | -171.4 | -72 | -169.5 | 68.8 | 0 | 0 | 113.9 | M169 I227 L230 Q235 | M169-M232 HydrophobicContact CE-CE 3.74Å; M169-M232 HydrophobicContact CE-SD 3.51Å; M169-M232 VanDerWaalsContact CE-SD 3.51Å; M169-M232 HydrophobicContact CG-CE 3.68Å; M169-M232 HydrophobicContact CG-SD 4.27Å; M169-M232 WeakPolarHBondContact O-CE 3.38Å; M169-M232 HydrophobicContact SD-CE 4.14Å; I227-M232 WeakPolarHBondContact CG2-O 3.36Å; I227-M232 PolarHBondContact O-N 2.87Å; L230-M232 HydrophobicContact CB-CB 4.41Å; L230-M232 HydrophobicContact CB-CG 3.87Å; L230-M232 HydrophobicContact CB-SD 4.06Å; L230-M232 HydrophobicContact CD2-SD 4.02Å; M232-Q235 VanDerWaalsContact CE-OE1 3.23Å | ||
| 233 | D | 63 | Low | 80 | Confident | 149 Ų | 149 | 59.2 Ų | 59.2 | 80% | 0.797 | 34% | 0.34 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -55.7 | 141.7 | 178.6 | -77.5 | -60.5 | 0 | 0 | 0 | 113.7 | Q235 | D233-Q235 VanDerWaalsContact C-N 3.27Å; D233-Q235 PolarHBondContact O-N 3.37Å; D233-Q235 VanDerWaalsContact O-N 3.16Å |
| 234 | G | 68.6 | Low | 80.2 | Confident | 85 Ų | 85 | 61 Ų | 61 | 88% | 0.876 | 36% | 0.355 | S | S | * | . | T | Hydrogen-bonded Turn | trans | 79.6 | -25.5 | 177.1 | 0 | 0 | 0 | 0 | 0 | 116.6 | Q236 | G234-Q236 VanDerWaalsContact C-N 3.31Å; G234-Q236 PolarHBondContact O-N 3.49Å |
| 235 | Q | 72.4 | Confident | 80.6 | Confident | 90 Ų | 90 | 60.7 Ų | 60.7 | 42% | 0.421 | 36% | 0.357 | S | S | . | . | trans | -87.9 | 24.8 | -171.2 | -62.7 | -163.5 | -4.3 | 0 | 0 | 115.6 | M232 D233 L237 L238 | M232-Q235 VanDerWaalsContact CE-OE1 3.23Å; D233-Q235 VanDerWaalsContact C-N 3.27Å; D233-Q235 PolarHBondContact O-N 3.37Å; D233-Q235 VanDerWaalsContact O-N 3.16Å; Q235-L237 PolarHBondContact O-N 2.82Å; Q235-L238 WeakPolarHBondContact O-CB 3.41Å; Q235-L238 PolarHBondContact O-N 3.46Å; Q235-L238 VanDerWaalsContact O-N 3.07Å | ||
| 236 | Q | 80.9 | Confident | 81 | Confident | 34 Ų | 34 | 59.1 Ų | 59.1 | 16% | 0.159 | 35% | 0.35 | C | S | . | . | H | α-helix | trans | -54.3 | -44.4 | -171.8 | 179.4 | 159.9 | 10.3 | 0 | 0 | 114.9 | F220 S223 K224 I227 G234 L238 V239 A240 | F220-Q236 VanDerWaalsContact CD2-NE2 3.33Å; S223-Q236 PolarHBondContact OG-NE2 2.78Å; K224-Q236 VanDerWaalsContact CE-OE1 3.24Å; I227-Q236 HydrophobicContact CD1-CB 3.42Å; I227-Q236 VanDerWaalsContact CD1-CB 3.42Å; I227-Q236 HydrophobicContact CD1-CG 3.58Å; G234-Q236 VanDerWaalsContact C-N 3.31Å; G234-Q236 PolarHBondContact O-N 3.49Å; Q236-L238 PolarHBondContact O-N 3.12Å; Q236-V239 PolarHBondContact O-N 3.28Å; Q236-A240 WeakPolarHBondContact O-CB 3.16Å; Q236-A240 PolarHBondContact O-N 3.47Å |
| 237 | L | 83.5 | Confident | 81.4 | Confident | 151 Ų | 151 | 59.1 Ų | 59.1 | 79% | 0.791 | 35% | 0.35 | S | S | * | . | H | α-helix | trans | -64.3 | -27.8 | -176.9 | -75 | 168 | 0 | 0 | 0 | 112.7 | Q235 V239 A240 Y241 | Q235-L237 PolarHBondContact O-N 2.82Å; L237-V239 VanDerWaalsContact C-N 3.35Å; L237-A240 PolarHBondContact O-N 3.18Å; L237-Y241 PolarHBondContact O-N 3.18Å; L237-Y241 VanDerWaalsContact O-N 3.13Å |
| 238 | L | 86.1 | Confident | 81.8 | Confident | 104 Ų | 104 | 58.5 Ų | 58.5 | 55% | 0.545 | 35% | 0.35 | S | S | . | . | H | α-helix | trans | -68.9 | -34.2 | -179.4 | -168.2 | 59.4 | 0 | 0 | 0 | 111.9 | M169 Q235 Q236 P242 | M169-L238 HydrophobicContact CG-CD2 4.32Å; M169-L238 HydrophobicContact SD-CD2 3.7Å; M169-L238 HydrophobicContact SD-CG 3.97Å; Q235-L238 WeakPolarHBondContact O-CB 3.41Å; Q235-L238 PolarHBondContact O-N 3.46Å; Q235-L238 VanDerWaalsContact O-N 3.07Å; Q236-L238 PolarHBondContact O-N 3.12Å; L238-P242 WeakPolarHBondContact O-CD 3.2Å |
| 239 | V | 86.1 | Confident | 82.4 | Confident | 5 Ų | 5 | 57.1 Ų | 57.1 | 3% | 0.03 | 34% | 0.338 | C | S | . | . | H | α-helix | trans | -87.2 | -33.2 | 174.6 | -173.8 | 0 | 0 | 0 | 0 | 112.2 | M162 L166 M169 F226 Q236 L237 Y241 P242 C243 | M162-V239 HydrophobicContact CE-CG1 4.29Å; L166-V239 HydrophobicContact CD2-CG1 4.08Å; L166-V239 HydrophobicContact CD2-CG2 4.4Å; M169-V239 HydrophobicContact CE-CG2 3.34Å; M169-V239 HydrophobicContact SD-CG2 4Å; F226-V239 HydrophobicContact CB-CG1 3.84Å; F226-V239 HydrophobicContact CD2-CG1 3.84Å; F226-V239 HydrophobicContact CG-CG1 4.16Å; Q236-V239 PolarHBondContact O-N 3.28Å; L237-V239 VanDerWaalsContact C-N 3.35Å; V239-Y241 VanDerWaalsContact C-N 3.3Å; V239-Y241 PolarHBondContact O-N 3.35Å; V239-P242 VanDerWaalsContact O-CD 3.3Å; V239-P242 WeakPolarHBondContact O-CD 3.37Å; V239-P242 WeakPolarHBondContact O-CG 3.4Å; V239-C243 PolarHBondContact O-N 2.92Å; V239-C243 PolarHBondContact O-SG 2.92Å |
| 240 | A | 87.8 | Confident | 83.1 | Confident | 16 Ų | 16 | 55.3 Ų | 55.3 | 13% | 0.132 | 32% | 0.322 | C | S | . | . | H | α-helix | trans | -63.9 | -33.7 | 178 | 0 | 0 | 0 | 0 | 0 | 112.7 | Q236 L237 A244 | Q236-A240 WeakPolarHBondContact O-CB 3.16Å; Q236-A240 PolarHBondContact O-N 3.47Å; L237-A240 PolarHBondContact O-N 3.18Å; A240-A244 WeakPolarHBondContact O-CB 3.3Å; A240-A244 PolarHBondContact O-N 3.41Å |
| 241 | Y | 90.5 | Very high | 83.8 | Confident | 170 Ų | 170 | 55.1 Ų | 55.1 | 67% | 0.667 | 32% | 0.322 | S | S | * | . | H | α-helix | trans | -61.2 | -56.9 | 179.4 | 177.7 | -101.5 | 0 | 0 | 0 | 114.4 | L237 V239 C243 A244 L245 | L237-Y241 PolarHBondContact O-N 3.18Å; L237-Y241 VanDerWaalsContact O-N 3.13Å; V239-Y241 VanDerWaalsContact C-N 3.3Å; V239-Y241 PolarHBondContact O-N 3.35Å; Y241-C243 VanDerWaalsContact C-N 3.29Å; Y241-C243 PolarHBondContact O-N 2.96Å; Y241-A244 PolarHBondContact O-N 3.47Å; Y241-A244 VanDerWaalsContact O-N 3.14Å; Y241-L245 PolarHBondContact O-N 2.87Å |
| 242 | P | 89.8 | Confident | 84.7 | Confident | 23 Ų | 23 | 56 Ų | 56 | 15% | 0.149 | 32% | 0.315 | C | S | . | . | H | α-helix | trans | -67.5 | -28.3 | 178.6 | 28.8 | -37 | 0 | 0 | 0 | 112.6 | M162 L165 L238 V239 L245 L246 | M162-P242 HydrophobicContact CE-CG 4.37Å; M162-P242 HydrophobicContact SD-CB 3.66Å; M162-P242 HydrophobicContact SD-CG 3.82Å; L165-P242 HydrophobicContact CD1-CB 3.87Å; L165-P242 HydrophobicContact CD1-CG 4.23Å; L238-P242 WeakPolarHBondContact O-CD 3.2Å; V239-P242 VanDerWaalsContact O-CD 3.3Å; V239-P242 WeakPolarHBondContact O-CD 3.37Å; V239-P242 WeakPolarHBondContact O-CG 3.4Å; P242-L245 PolarHBondContact O-N 2.92Å; P242-L246 WeakPolarHBondContact O-CB 3.4Å; P242-L246 PolarHBondContact O-N 3.21Å |
| 243 | C | 90.2 | Very high | 85.6 | Confident | 0 Ų | 0 | 55.5 Ų | 55.5 | 0% | 0 | 31% | 0.313 | C | S | . | . | H | α-helix | trans | -60.6 | -48.8 | 168 | -68.2 | 0 | 0 | 0 | 0 | 111.5 | M162 V239 Y241 L245 L246 Y247 | M162-C243 VanDerWaalsContact CE-SG 3.57Å; V239-C243 PolarHBondContact O-N 2.92Å; V239-C243 PolarHBondContact O-SG 2.92Å; Y241-C243 VanDerWaalsContact C-N 3.29Å; Y241-C243 PolarHBondContact O-N 2.96Å; C243-L245 VanDerWaalsContact C-N 3.3Å; C243-L245 PolarHBondContact O-N 3.39Å; C243-L246 PolarHBondContact O-N 2.94Å; C243-Y247 HydrophobicContact CB-CD2 4.29Å; C243-Y247 HydrophobicContact CB-CE2 4.04Å; C243-Y247 WeakPolarHBondContact O-CD2 3.35Å; C243-Y247 PolarHBondContact O-N 3.07Å |
| 244 | A | 91.1 | Very high | 86.5 | Confident | 36 Ų | 36 | 49.1 Ų | 49.1 | 30% | 0.298 | 28% | 0.28 | S | S | . | . | H | α-helix | trans | -64.8 | -32.3 | 179.6 | 0 | 0 | 0 | 0 | 0 | 113.2 | I215 S219 A240 Y241 G248 | I215-A244 HydrophobicContact CG2-CB 4.3Å; S219-A244 WeakPolarHBondContact OG-CA 3.23Å; S219-A244 WeakPolarHBondContact OG-CB 3.41Å; S219-A244 PolarHBondContact OG-N 2.75Å; A240-A244 WeakPolarHBondContact O-CB 3.3Å; A240-A244 PolarHBondContact O-N 3.41Å; Y241-A244 PolarHBondContact O-N 3.47Å; Y241-A244 VanDerWaalsContact O-N 3.14Å; A244-G248 WeakPolarHBondContact O-CA 3.47Å; A244-G248 PolarHBondContact O-N 3.07Å |
| 245 | L | 91.1 | Very high | 87.1 | Confident | 98 Ų | 98 | 46 Ų | 46 | 51% | 0.513 | 24% | 0.243 | S | C | . | . | H | α-helix | trans | -63.3 | -51.7 | 171 | -158.6 | 173.8 | 0 | 0 | 0 | 110.3 | Y241 P242 C243 G248 V249 | Y241-L245 PolarHBondContact O-N 2.87Å; P242-L245 PolarHBondContact O-N 2.92Å; C243-L245 VanDerWaalsContact C-N 3.3Å; C243-L245 PolarHBondContact O-N 3.39Å; L245-G248 PolarHBondContact O-N 3.31Å; L245-V249 HydrophobicContact CD2-CG2 4.09Å; L245-V249 WeakPolarHBondContact O-CG2 3.22Å; L245-V249 PolarHBondContact O-N 3.33Å |
| 246 | L | 91.6 | Very high | 87.4 | Confident | 17 Ų | 17 | 49.1 Ų | 49.1 | 9% | 0.089 | 26% | 0.256 | C | S | . | . | H | α-helix | trans | -60.1 | -49.6 | -179.4 | 178.8 | 152.1 | 0 | 0 | 0 | 112.3 | M162 L183 P242 C243 G248 V249 F250 | M162-L246 HydrophobicContact CG-CD1 4.04Å; L183-L246 HydrophobicContact CD1-CD1 4.12Å; L183-L246 HydrophobicContact CD2-CD2 4.44Å; P242-L246 WeakPolarHBondContact O-CB 3.4Å; P242-L246 PolarHBondContact O-N 3.21Å; C243-L246 PolarHBondContact O-N 2.94Å; L246-G248 VanDerWaalsContact C-N 3.33Å; L246-G248 PolarHBondContact O-N 2.95Å; L246-V249 PolarHBondContact O-N 2.89Å; L246-F250 HydrophobicContact CD2-CD2 4.08Å; L246-F250 HydrophobicContact CD2-CE2 3.56Å; L246-F250 HydrophobicContact CG-CE2 4.13Å; L246-F250 WeakPolarHBondContact O-CD2 3.38Å; L246-F250 PolarHBondContact O-N 2.84Å |
| 247 | Y | 91.4 | Very high | 87.7 | Confident | 0 Ų | 0 | 49.9 Ų | 49.9 | 0% | 0 | 26% | 0.261 | C | S | . | . | H | α-helix | trans | -69.2 | -31.1 | 175.8 | -62.3 | -57.1 | 0 | 0 | 0 | 112.8 | L183 C186 L187 C218 A222 C243 F250 A251 | L183-Y247 WeakPolarHBondContact CA-OH 3.34Å; L183-Y247 WeakPolarHBondContact CD2-OH 3.34Å; L183-Y247 PolarHBondContact O-OH 3.49Å; C186-Y247 WeakPolarHBondContact CB-OH 3.25Å; L187-Y247 HydrophobicContact CD2-CD1 3.73Å; L187-Y247 HydrophobicContact CD2-CE1 3.67Å; L187-Y247 HydrophobicContact CG-CE1 4.11Å; C218-Y247 HydrophobicContact CB-CD2 4.36Å; C218-Y247 HydrophobicContact CB-CE2 4.38Å; C218-Y247 WeakPolarHBondContact SG-CD2 3.26Å; A222-Y247 HydrophobicContact CB-CE2 4.16Å; C243-Y247 HydrophobicContact CB-CD2 4.29Å; C243-Y247 HydrophobicContact CB-CE2 4.04Å; C243-Y247 WeakPolarHBondContact O-CD2 3.35Å; C243-Y247 PolarHBondContact O-N 3.07Å; Y247-F250 HydrophobicContact CD1-CD2 4.4Å; Y247-F250 PolarHBondContact O-N 3.27Å; Y247-A251 WeakPolarHBondContact O-CB 3.31Å; Y247-A251 PolarHBondContact O-N 3.1Å |
| 248 | G | 90.8 | Very high | 87.9 | Confident | 14 Ų | 14 | 44.5 Ų | 44.5 | 14% | 0.144 | 23% | 0.233 | C | C | . | . | H | α-helix | trans | -62.6 | -40 | 173.5 | 0 | 0 | 0 | 0 | 0 | 113 | A244 L245 L246 A251 L252 | A244-G248 WeakPolarHBondContact O-CA 3.47Å; A244-G248 PolarHBondContact O-N 3.07Å; L245-G248 PolarHBondContact O-N 3.31Å; L246-G248 VanDerWaalsContact C-N 3.33Å; L246-G248 PolarHBondContact O-N 2.95Å; G248-A251 WeakPolarHBondContact O-CB 3.35Å; G248-A251 PolarHBondContact O-N 3.37Å; G248-L252 VanDerWaalsContact O-CG 3.31Å; G248-L252 WeakPolarHBondContact O-CG 3.41Å; G248-L252 PolarHBondContact O-N 2.9Å |
| 249 | V | 90.8 | Very high | 88 | Confident | 46 Ų | 46 | 41.2 Ų | 41.2 | 28% | 0.279 | 22% | 0.215 | S | C | . | . | H | α-helix | trans | -63.7 | -43.6 | 174.9 | 173.4 | 0 | 0 | 0 | 0 | 111.2 | I154 L245 L246 L252 I253 | I154-V249 HydrophobicContact CD1-CG1 4.03Å; I154-V249 HydrophobicContact CG2-CG1 3.91Å; L245-V249 HydrophobicContact CD2-CG2 4.09Å; L245-V249 WeakPolarHBondContact O-CG2 3.22Å; L245-V249 PolarHBondContact O-N 3.33Å; L246-V249 PolarHBondContact O-N 2.89Å; V249-L252 PolarHBondContact O-N 3.28Å; V249-I253 HydrophobicContact CG1-CD1 4Å; V249-I253 WeakPolarHBondContact O-CG1 3.13Å; V249-I253 PolarHBondContact O-N 2.9Å; V249-I253 VanDerWaalsContact O-N 3.09Å |
| 250 | F | 89.4 | Confident | 88.1 | Confident | 3 Ų | 3 | 43.4 Ų | 43.4 | 1% | 0.013 | 23% | 0.226 | C | C | . | . | H | α-helix | trans | -63.5 | -40.2 | 174.2 | -64.2 | -43.8 | 0 | 0 | 0 | 112.6 | F136 I154 S155 L187 L246 Y247 I253 S254 | F136-F250 HydrophobicContact CE1-CB 3.8Å; F136-F250 AromaticContact CE1-CD1 3.81Å; F136-F250 HydrophobicContact CE1-CD1 3.81Å; F136-F250 AromaticContact CE1-CG 3.97Å; F136-F250 HydrophobicContact CE1-CG 3.97Å; F136-F250 HydrophobicContact CZ-CB 3.77Å; F136-F250 HydrophobicContact CZ-CG 4.44Å; I154-F250 HydrophobicContact CB-CE1 4.18Å; I154-F250 HydrophobicContact CG2-CD1 4.42Å; I154-F250 HydrophobicContact CG2-CE1 3.72Å; I154-F250 HydrophobicContact CG2-CZ 4.12Å; S155-F250 VanDerWaalsContact OG-CZ 3.24Å; S155-F250 WeakPolarHBondContact OG-CZ 3.46Å; L187-F250 HydrophobicContact CD2-CD2 3.66Å; L187-F250 HydrophobicContact CD2-CE2 3.94Å; L246-F250 HydrophobicContact CD2-CD2 4.08Å; L246-F250 HydrophobicContact CD2-CE2 3.56Å; L246-F250 HydrophobicContact CG-CE2 4.13Å; L246-F250 WeakPolarHBondContact O-CD2 3.38Å; L246-F250 PolarHBondContact O-N 2.84Å; Y247-F250 HydrophobicContact CD1-CD2 4.4Å; Y247-F250 PolarHBondContact O-N 3.27Å; F250-I253 PolarHBondContact O-N 3.37Å; F250-S254 WeakPolarHBondContact O-CB 3.2Å; F250-S254 PolarHBondContact O-N 3.47Å |
| 251 | A | 89 | Confident | 88.1 | Confident | 4 Ų | 4 | 45.1 Ų | 45.1 | 3% | 0.033 | 23% | 0.232 | C | C | . | . | H | α-helix | trans | -61.3 | -43.9 | 175.1 | 0 | 0 | 0 | 0 | 0 | 112.2 | M190 A211 I215 Y247 G248 S254 V255 | M190-A251 VanDerWaalsContact CE-CA 3.5Å; M190-A251 HydrophobicContact CE-CB 3.47Å; M190-A251 VanDerWaalsContact CE-CB 3.47Å; A211-A251 HydrophobicContact CB-CB 4.43Å; I215-A251 HydrophobicContact CD1-CB 3.54Å; I215-A251 HydrophobicContact CG1-CB 3.82Å; Y247-A251 WeakPolarHBondContact O-CB 3.31Å; Y247-A251 PolarHBondContact O-N 3.1Å; G248-A251 WeakPolarHBondContact O-CB 3.35Å; G248-A251 PolarHBondContact O-N 3.37Å; A251-S254 PolarHBondContact O-N 3.19Å; A251-V255 WeakPolarHBondContact O-CB 3.36Å; A251-V255 WeakPolarHBondContact O-CG2 3.16Å; A251-V255 PolarHBondContact O-N 3.48Å |
| 252 | L | 88 | Confident | 88 | Confident | 100 Ų | 100 | 36.7 Ų | 36.7 | 52% | 0.524 | 20% | 0.203 | S | C | . | . | H | α-helix | trans | -61 | -47.2 | 177.3 | -71.7 | 171.8 | 0 | 0 | 0 | 111.4 | G248 V249 S254 V255 F256 | G248-L252 VanDerWaalsContact O-CG 3.31Å; G248-L252 WeakPolarHBondContact O-CG 3.41Å; G248-L252 PolarHBondContact O-N 2.9Å; V249-L252 PolarHBondContact O-N 3.28Å; L252-S254 PolarHBondContact O-N 3.24Å; L252-V255 PolarHBondContact O-N 2.77Å; L252-F256 HydrophobicContact CD2-CD2 3.74Å; L252-F256 HydrophobicContact CD2-CE2 3.81Å; L252-F256 PolarHBondContact O-N 3.47Å |
| 253 | I | 86.3 | Confident | 87.9 | Confident | 21 Ų | 21 | 37.7 Ų | 37.7 | 11% | 0.108 | 21% | 0.207 | C | C | . | . | H | α-helix | trans | -59.7 | -35.6 | 175.8 | -67.1 | 165 | 0 | 0 | 0 | 111.7 | L140 K145 V151 I154 V249 F250 | L140-I253 HydrophobicContact CD1-CG2 3.88Å; L140-I253 HydrophobicContact CD2-CG2 4.35Å; K145-I253 PolarHBondContact NZ-O 2.98Å; V151-I253 HydrophobicContact CG2-CG2 4.49Å; I154-I253 HydrophobicContact CD1-CD1 3.73Å; V249-I253 HydrophobicContact CG1-CD1 4Å; V249-I253 WeakPolarHBondContact O-CG1 3.13Å; V249-I253 PolarHBondContact O-N 2.9Å; V249-I253 VanDerWaalsContact O-N 3.09Å; F250-I253 PolarHBondContact O-N 3.37Å |
| 254 | S | 82.2 | Confident | 87.7 | Confident | 15 Ų | 15 | 40.6 Ų | 40.6 | 11% | 0.105 | 22% | 0.223 | C | C | . | . | H | α-helix | trans | -75.7 | -27.4 | 178.7 | -169.3 | 0 | 0 | 0 | 0 | 114.5 | A194 F250 A251 L252 | A194-S254 WeakPolarHBondContact CA-OG 3.33Å; A194-S254 WeakPolarHBondContact CB-OG 3.38Å; F250-S254 WeakPolarHBondContact O-CB 3.2Å; F250-S254 PolarHBondContact O-N 3.47Å; A251-S254 PolarHBondContact O-N 3.19Å; L252-S254 PolarHBondContact O-N 3.24Å |
| 255 | V | 80.6 | Confident | 87.4 | Confident | 19 Ų | 19 | 41 Ų | 41 | 12% | 0.115 | 22% | 0.217 | C | C | . | . | H | α-helix | trans | -103.3 | -31.3 | -173.6 | 176.3 | 0 | 0 | 0 | 0 | 112.9 | L193 L202 A211 A251 L252 | L193-V255 HydrophobicContact CD2-CG2 4.35Å; L202-V255 HydrophobicContact CD2-CG2 3.81Å; A211-V255 HydrophobicContact CB-CG2 4.39Å; A251-V255 WeakPolarHBondContact O-CB 3.36Å; A251-V255 WeakPolarHBondContact O-CG2 3.16Å; A251-V255 PolarHBondContact O-N 3.48Å; L252-V255 PolarHBondContact O-N 2.77Å |
| 256 | F | 77.6 | Confident | 87.1 | Confident | 155 Ų | 155 | 35.8 Ų | 35.8 | 68% | 0.68 | 19% | 0.19 | S | C | * | . | trans | -118.5 | 0 | -174.6 | -60.4 | -74.2 | 0 | 0 | 0 | 111.6 | K145 I208 L252 | K145-F256 WeakPolarHBondContact CE-O 3.28Å; K145-F256 PolarHBondContact NZ-O 3.12Å; K145-F256 PolarHBondContact NZ-OXT 2.87Å; I208-F256 HydrophobicContact CD1-CZ 4Å; I208-F256 HydrophobicContact CG1-CZ 3.99Å; L252-F256 HydrophobicContact CD2-CD2 3.74Å; L252-F256 HydrophobicContact CD2-CE2 3.81Å; L252-F256 PolarHBondContact O-N 3.47Å |
Retrieved 256 of 256 residues in 170.6 ms
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