| Site | Residue | pLDDT | pLDDT confidence | pLDDT10 | pLDDT10 confidence | SASA | SASA [Ų] | SASA10 | SASA10 [Ų] | RSA | RSA unformatted | RSA10 | RSA10 unformatted | Surface | Surface10 (not used) | Disorder (not used) | Disorder | Sec. str. | Secondary structure | Isomer | Phi (φ) | Psi (ψ) | Omega (ω) | Chi 1 (χ1) | Chi 2 (χ2) | Chi 3 (χ3) | Chi 4 (χ4) | Chi 5 (χ5) | Tau (τ) | Contacts (colored by PAE) | Contact details |
|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|
| 1 | M | 45.2 | Very low | 51.9 | Low | 247 Ų | 247 | 136.6 Ų | 136.6 | 100% | 1.217 | 83% | 0.826 | S | S | * | * | 0 | 145.4 | 0 | -76.7 | -177.5 | 163 | 0 | 0 | 108.5 | |||||
| 2 | L | 47.2 | Very low | 51.3 | Low | 166 Ų | 166 | 141.8 Ų | 141.8 | 87% | 0.869 | 83% | 0.829 | S | S | * | * | P | Polyproline II helix | trans | -78.3 | 161.4 | -173.3 | -101.6 | 75 | 0 | 0 | 0 | 113.2 | ||
| 3 | P | 49.4 | Very low | 50.8 | Low | 106 Ų | 106 | 150.2 Ų | 150.2 | 69% | 0.688 | 84% | 0.839 | S | S | * | * | P | Polyproline II helix | trans | -76.2 | 154.8 | 175.3 | 34 | -35.5 | 0 | 0 | 0 | 111.8 | ||
| 4 | N | 50.2 | Low | 49.8 | Very low | 168 Ų | 168 | 152.4 Ų | 152.4 | 90% | 0.898 | 84% | 0.835 | S | S | * | * | P | Polyproline II helix | trans | -99.9 | 132.2 | 177.1 | -117.9 | -65.1 | 0 | 0 | 0 | 112 | ||
| 5 | L | 50.7 | Low | 48.9 | Very low | 155 Ų | 155 | 149.9 Ų | 149.9 | 81% | 0.812 | 83% | 0.831 | S | S | * | * | P | Polyproline II helix | trans | -93.7 | 138 | 179.9 | -75.2 | 79.5 | 0 | 0 | 0 | 111.4 | ||
| 6 | G | 45.7 | Very low | 48.8 | Very low | 65 Ų | 65 | 148.1 Ų | 148.1 | 67% | 0.67 | 83% | 0.828 | S | S | * | * | 63.7 | 120.3 | 122.5 | 0 | 0 | 0 | 0 | 0 | 122.6 | |||||
| 7 | S | 53.5 | Low | 47.8 | Very low | 121 Ų | 121 | 147.1 Ų | 147.1 | 85% | 0.846 | 83% | 0.833 | S | S | * | * | trans | 78.6 | 165.2 | 141.7 | -34 | 0 | 0 | 0 | 0 | 118.1 | ||||
| 8 | P | 57.9 | Low | 47.1 | Very low | 111 Ų | 111 | 142.6 Ų | 142.6 | 72% | 0.721 | 83% | 0.825 | S | S | * | * | cis | -127.2 | 176.8 | -20.8 | 35.8 | -19 | 0 | 0 | 0 | 113.4 | ||||
| 9 | P | 61.2 | Low | 46.6 | Very low | 122 Ų | 122 | 140.8 Ų | 140.8 | 79% | 0.792 | 83% | 0.829 | S | S | * | * | trans | -83.1 | 143.1 | 170.9 | 32.9 | -34.6 | 0 | 0 | 0 | 113.8 | ||||
| 10 | P | 59.8 | Low | 46 | Very low | 119 Ų | 119 | 137.2 Ų | 137.2 | 77% | 0.773 | 82% | 0.822 | S | S | * | * | trans | -104.5 | 176.7 | 174.3 | 44.3 | -37.5 | 0 | 0 | 0 | 111.7 | ||||
| 11 | P | 49.9 | Very low | 45.3 | Very low | 123 Ų | 123 | 141.9 Ų | 141.9 | 80% | 0.799 | 83% | 0.825 | S | S | * | * | -128 | 173.7 | -90.8 | 27.7 | -5.5 | 0 | 0 | 0 | 115.2 | |||||
| 12 | F | 44.6 | Very low | 44.7 | Very low | 198 Ų | 198 | 134.9 Ų | 134.9 | 87% | 0.868 | 80% | 0.797 | S | S | * | * | trans | -45 | 137.7 | 167.8 | -102.1 | -103.6 | 0 | 0 | 0 | 113.8 | ||||
| 13 | R | 45.8 | Very low | 44 | Very low | 252 Ų | 252 | 133 Ų | 133 | 95% | 0.951 | 79% | 0.793 | S | S | * | * | trans | -116.5 | 126.7 | 154.2 | -105.4 | -171.5 | 178.9 | -168.6 | 1.3 | 110.7 | ||||
| 14 | K | 35.8 | Very low | 43.2 | Very low | 181 Ų | 181 | 132.8 Ų | 132.8 | 79% | 0.787 | 80% | 0.799 | S | S | * | * | trans | -93.5 | 131.4 | 179.4 | -84.5 | 175.8 | 170.8 | 174.3 | 0 | 111.6 | ||||
| 15 | C | 36.5 | Very low | 42.4 | Very low | 115 Ų | 115 | 131.7 Ų | 131.7 | 78% | 0.777 | 80% | 0.798 | S | S | * | * | trans | 58.3 | -177.7 | 136.4 | -49.5 | 0 | 0 | 0 | 0 | 118.3 | ||||
| 16 | P | 47.3 | Very low | 41.4 | Very low | 121 Ų | 121 | 127.5 Ų | 127.5 | 79% | 0.786 | 79% | 0.786 | S | S | * | * | cis | -132.4 | -178.2 | -14.6 | 28.1 | -5.7 | 0 | 0 | 0 | 115.7 | ||||
| 17 | S | 32 | Very low | 40.6 | Very low | 130 Ų | 130 | 135 Ų | 135 | 91% | 0.909 | 80% | 0.795 | S | S | * | * | trans | 111 | 143.1 | 133 | -150.8 | 0 | 0 | 0 | 0 | 120 | ||||
| 18 | G | 35.5 | Very low | 39.4 | Very low | 66 Ų | 66 | 135 Ų | 135 | 68% | 0.68 | 79% | 0.789 | S | S | * | * | trans | 114.8 | 69.2 | 179.7 | 0 | 0 | 0 | 0 | 0 | 113.2 | ||||
| 19 | A | 36.8 | Very low | 38.1 | Very low | 110 Ų | 110 | 134.9 Ų | 134.9 | 91% | 0.909 | 79% | 0.791 | S | S | * | * | 62.6 | 124.4 | 84 | 0 | 0 | 0 | 0 | 0 | 113.7 | |||||
| 20 | G | 34.4 | Very low | 36.7 | Very low | 67 Ų | 67 | 133.6 Ų | 133.6 | 69% | 0.691 | 79% | 0.791 | S | S | * | * | cis | -147.6 | 167.1 | 1.8 | 0 | 0 | 0 | 0 | 0 | 112.1 | ||||
| 21 | R | 32.7 | Very low | 35.5 | Very low | 236 Ų | 236 | 134 Ų | 134 | 89% | 0.891 | 79% | 0.793 | S | S | * | * | 60 | 132.1 | 95.9 | -75.3 | -172.1 | 80.5 | 163.4 | 4.8 | 114.9 | |||||
| 22 | T | 32.8 | Very low | 34.7 | Very low | 100 Ų | 100 | 137.3 Ų | 137.3 | 61% | 0.613 | 80% | 0.798 | S | S | * | * | cis | -171.8 | 153 | -16.2 | 7.7 | 0 | 0 | 0 | 0 | 106.6 | ||||
| 23 | T | 32.1 | Very low | 34.1 | Very low | 128 Ų | 128 | 134.8 Ų | 134.8 | 79% | 0.785 | 80% | 0.799 | S | S | * | * | trans | 43 | 123.7 | 150.1 | 59.7 | 0 | 0 | 0 | 0 | 120.5 | ||||
| 24 | A | 31.9 | Very low | 33.4 | Very low | 100 Ų | 100 | 133.2 Ų | 133.2 | 83% | 0.826 | 79% | 0.793 | S | S | * | * | 179.9 | 142.4 | 105.4 | 0 | 0 | 0 | 0 | 0 | 113.6 | |||||
| 25 | V | 33.3 | Very low | 33.3 | Very low | 145 Ų | 145 | 135.1 Ų | 135.1 | 88% | 0.879 | 80% | 0.796 | S | S | * | * | trans | -74 | 155.4 | 171.2 | 167.8 | 0 | 0 | 0 | 0 | 111.2 | ||||
| 26 | A | 29.2 | Very low | 32.9 | Very low | 68 Ų | 68 | 133.3 Ų | 133.3 | 56% | 0.562 | 80% | 0.796 | S | S | * | * | trans | 120 | 116.1 | 145.4 | 0 | 0 | 0 | 0 | 0 | 119 | ||||
| 27 | R | 30.8 | Very low | 32.2 | Very low | 223 Ų | 223 | 139 Ų | 139 | 84% | 0.842 | 80% | 0.802 | S | S | * | * | 86.3 | 134.6 | 129.7 | -72.5 | 178.5 | -156 | 132.4 | 1.6 | 122.6 | |||||
| 28 | T | 27.8 | Very low | 32.4 | Very low | 120 Ų | 120 | 136.9 Ų | 136.9 | 74% | 0.736 | 79% | 0.792 | S | S | * | * | trans | 75.8 | 102.5 | 137 | 49.8 | 0 | 0 | 0 | 0 | 121.9 | ||||
| 29 | S | 30.8 | Very low | 32.7 | Very low | 109 Ų | 109 | 139.8 Ų | 139.8 | 76% | 0.762 | 80% | 0.8 | S | S | * | * | 67.4 | 123.2 | 120.6 | 65.8 | 0 | 0 | 0 | 0 | 122.7 | |||||
| 30 | A | 31.6 | Very low | 32.6 | Very low | 95 Ų | 95 | 139.4 Ų | 139.4 | 79% | 0.785 | 79% | 0.79 | S | S | * | * | trans | 71.9 | 143.2 | 141.6 | 0 | 0 | 0 | 0 | 0 | 120.2 | ||||
| 31 | P | 34.4 | Very low | 32.5 | Very low | 126 Ų | 126 | 142 Ų | 142 | 82% | 0.818 | 80% | 0.798 | S | S | * | * | trans | -109.5 | 128.4 | 146.3 | 33.8 | -24.2 | 0 | 0 | 0 | 111 | ||||
| 32 | E | 32.7 | Very low | 32.5 | Very low | 193 Ų | 193 | 134.3 Ų | 134.3 | 90% | 0.902 | 79% | 0.792 | S | S | * | * | P | Polyproline II helix | trans | -73 | 132.5 | 170.7 | -70.9 | -177.5 | 88 | 0 | 0 | 111.8 | ||
| 33 | T | 32.5 | Very low | 32.7 | Very low | 146 Ų | 146 | 137.7 Ų | 137.7 | 90% | 0.896 | 81% | 0.806 | S | S | * | * | P | Polyproline II helix | trans | -93.6 | 121.4 | 162 | 38.9 | 0 | 0 | 0 | 0 | 110.7 | ||
| 34 | R | 31.8 | Very low | 32.9 | Very low | 218 Ų | 218 | 136.6 Ų | 136.6 | 82% | 0.823 | 81% | 0.81 | S | S | * | * | P | Polyproline II helix | trans | -92.9 | 148.4 | -173.7 | -167.4 | -176.5 | -177.1 | -133.8 | 1.9 | 111.9 | ||
| 35 | R | 32.4 | Very low | 32.9 | Very low | 221 Ų | 221 | 141 Ų | 141 | 83% | 0.834 | 81% | 0.811 | S | S | * | * | trans | 77.1 | 123.9 | 177.8 | -51.4 | 179.3 | 170.2 | -157 | -2.1 | 113.8 | ||||
| 36 | G | 29.1 | Very low | 33 | Very low | 77 Ų | 77 | 141.2 Ų | 141.2 | 79% | 0.794 | 80% | 0.804 | S | S | * | * | cis | 114.5 | 109.5 | -1.9 | 0 | 0 | 0 | 0 | 0 | 113.4 | ||||
| 37 | R | 31.4 | Very low | 33.3 | Very low | 241 Ų | 241 | 142.3 Ų | 142.3 | 91% | 0.909 | 81% | 0.813 | S | S | * | * | trans | -171.7 | 110.3 | 154.6 | 179.4 | 166.1 | -78.3 | -143 | -4.8 | 110.4 | ||||
| 38 | A | 36.1 | Very low | 33.4 | Very low | 85 Ų | 85 | 140 Ų | 140 | 70% | 0.702 | 81% | 0.812 | S | S | * | * | trans | -84.4 | 170.4 | 153.2 | 0 | 0 | 0 | 0 | 0 | 109.3 | ||||
| 39 | P | 42.8 | Very low | 33.6 | Very low | 128 Ų | 128 | 138.2 Ų | 138.2 | 83% | 0.831 | 82% | 0.816 | S | S | * | * | -135.4 | 161.6 | 97.3 | 37.6 | -27.8 | 0 | 0 | 0 | 114.2 | |||||
| 40 | S | 33.9 | Very low | 33.8 | Very low | 101 Ų | 101 | 137 Ų | 137 | 71% | 0.706 | 81% | 0.813 | S | S | * | * | trans | -108.9 | -176.7 | 172.8 | 57.9 | 0 | 0 | 0 | 0 | 110.9 | ||||
| 41 | S | 33 | Very low | 34 | Very low | 123 Ų | 123 | 144.2 Ų | 144.2 | 86% | 0.86 | 82% | 0.82 | S | S | * | * | trans | 80.1 | 142.1 | 167 | 77.8 | 0 | 0 | 0 | 0 | 117.9 | ||||
| 42 | G | 32.9 | Very low | 33.9 | Very low | 74 Ų | 74 | 142.1 Ų | 142.1 | 76% | 0.763 | 81% | 0.814 | S | S | * | * | trans | 151.7 | 55.2 | 174.6 | 0 | 0 | 0 | 0 | 0 | 115.3 | ||||
| 43 | D | 37.3 | Very low | 33.9 | Very low | 170 Ų | 170 | 145.1 Ų | 145.1 | 91% | 0.909 | 82% | 0.816 | S | S | * | * | trans | -63.9 | 128.7 | 165.3 | -63.4 | -80.7 | 0 | 0 | 0 | 110.8 | ||||
| 44 | A | 34.9 | Very low | 33.9 | Very low | 106 Ų | 106 | 141.6 Ų | 141.6 | 88% | 0.876 | 81% | 0.81 | S | S | * | * | trans | -153.5 | 122.9 | 164.5 | 0 | 0 | 0 | 0 | 0 | 113.5 | ||||
| 45 | K | 33.4 | Very low | 34.6 | Very low | 192 Ų | 192 | 136.8 Ų | 136.8 | 84% | 0.835 | 81% | 0.806 | S | S | * | * | trans | -78.6 | 153.5 | -177.8 | -148.5 | -167.6 | 178.5 | -179.3 | 0 | 112.2 | ||||
| 46 | M | 35.1 | Very low | 35.1 | Very low | 150 Ų | 150 | 137.8 Ų | 137.8 | 74% | 0.739 | 81% | 0.81 | S | S | * | * | trans | 74.3 | 119.1 | 137.4 | -165.3 | 162.8 | 175.6 | 0 | 0 | 122.2 | ||||
| 47 | A | 34.5 | Very low | 35.4 | Very low | 90 Ų | 90 | 137.8 Ų | 137.8 | 74% | 0.744 | 81% | 0.81 | S | S | * | * | trans | 173.2 | 105.7 | 135.4 | 0 | 0 | 0 | 0 | 0 | 106.9 | ||||
| 48 | E | 33.1 | Very low | 35.9 | Very low | 176 Ų | 176 | 132 Ų | 132 | 82% | 0.822 | 81% | 0.805 | S | S | * | * | 55.8 | 114.9 | 77.9 | -162.4 | 170.4 | 151.7 | 0 | 0 | 114.6 | |||||
| 49 | G | 32 | Very low | 36.3 | Very low | 81 Ų | 81 | 139.4 Ų | 139.4 | 84% | 0.835 | 82% | 0.815 | S | S | * | * | trans | -169.4 | 79.6 | -179.6 | 0 | 0 | 0 | 0 | 0 | 110.6 | ||||
| 50 | A | 34 | Very low | 36.1 | Very low | 83 Ų | 83 | 140 Ų | 140 | 69% | 0.686 | 81% | 0.811 | S | S | * | * | trans | -87.8 | 173.5 | -174 | 0 | 0 | 0 | 0 | 0 | 113.8 | ||||
| 51 | R | 37.3 | Very low | 36.7 | Very low | 247 Ų | 247 | 146.8 Ų | 146.8 | 93% | 0.932 | 82% | 0.821 | S | S | * | * | trans | 86.5 | 147.7 | 166.5 | -53.3 | -175.2 | -171.7 | -118.8 | 1.1 | 116.2 | ||||
| 52 | A | 31.9 | Very low | 36.9 | Very low | 83 Ų | 83 | 148.7 Ų | 148.7 | 69% | 0.686 | 82% | 0.822 | S | S | * | * | cis | -167 | 141.5 | -21.3 | 0 | 0 | 0 | 0 | 0 | 111.9 | ||||
| 53 | R | 32.8 | Very low | 37.1 | Very low | 255 Ų | 255 | 148.4 Ų | 148.4 | 96% | 0.962 | 82% | 0.819 | S | S | * | * | 47.9 | 108.7 | 128.1 | -159.8 | -172.6 | -150.2 | -149 | 7.6 | 119.5 | |||||
| 54 | G | 32.7 | Very low | 37.6 | Very low | 73 Ų | 73 | 146.6 Ų | 146.6 | 75% | 0.753 | 82% | 0.817 | S | S | * | * | trans | 177.2 | 140.8 | 158.4 | 0 | 0 | 0 | 0 | 0 | 113.6 | ||||
| 55 | P | 45.8 | Very low | 37.7 | Very low | 116 Ų | 116 | 146.5 Ų | 146.5 | 75% | 0.753 | 82% | 0.815 | S | S | * | * | trans | -129.3 | -179.3 | -151.3 | 44.2 | -29.5 | 0 | 0 | 0 | 116.8 | ||||
| 56 | R | 42.3 | Very low | 37.9 | Very low | 243 Ų | 243 | 141.3 Ų | 141.3 | 92% | 0.917 | 82% | 0.816 | S | S | * | * | trans | 78.5 | 122.2 | 161.4 | -63.5 | 175.1 | 177.9 | 165.2 | -1.7 | 117.6 | ||||
| 57 | G | 36.3 | Very low | 38 | Very low | 76 Ų | 76 | 137.8 Ų | 137.8 | 78% | 0.784 | 82% | 0.819 | S | S | * | * | trans | -168.9 | 63.9 | 168.7 | 0 | 0 | 0 | 0 | 0 | 109.8 | R59 | G57-R59 PolarHBondContact O-N 3.46Š| ||
| 58 | C | 41.2 | Very low | 38.2 | Very low | 120 Ų | 120 | 138.6 Ų | 138.6 | 81% | 0.811 | 83% | 0.825 | S | S | * | * | trans | -62.8 | 128.4 | 172.2 | -57.4 | 0 | 0 | 0 | 0 | 108.8 | ||||
| 59 | R | 45.6 | Very low | 38.3 | Very low | 241 Ų | 241 | 133.8 Ų | 133.8 | 91% | 0.909 | 82% | 0.823 | S | S | * | * | trans | -146.1 | 91.8 | 162.4 | -137.3 | 175.5 | -167.4 | 154.9 | 5 | 109.6 | G57 R61 | G57-R59 PolarHBondContact O-N 3.46Å; R59-R61 PolarHBondContact O-N 3.37Å | ||
| 60 | D | 39 | Very low | 38.7 | Very low | 139 Ų | 139 | 139.3 Ų | 139.3 | 74% | 0.743 | 82% | 0.824 | S | S | * | * | trans | -56.8 | 131.8 | 167.9 | -51.4 | -75.8 | 0 | 0 | 0 | 109.5 | ||||
| 61 | R | 46.7 | Very low | 38.8 | Very low | 244 Ų | 244 | 144.2 Ų | 144.2 | 92% | 0.921 | 84% | 0.835 | S | S | * | * | trans | -143.8 | 97 | 153.7 | -99.7 | -159.2 | 168.8 | -176 | -3.4 | 109 | R59 | R59-R61 PolarHBondContact O-N 3.37Š| ||
| 62 | D | 36.7 | Very low | 38.7 | Very low | 163 Ų | 163 | 137 Ų | 137 | 87% | 0.872 | 83% | 0.829 | S | S | * | * | trans | -55.8 | 142.6 | 162.1 | -59.9 | -73.8 | 0 | 0 | 0 | 110.9 | ||||
| 63 | G | 36.8 | Very low | 39.1 | Very low | 69 Ų | 69 | 137.3 Ų | 137.3 | 71% | 0.711 | 83% | 0.831 | S | S | * | * | trans | 169.6 | 88.2 | -179 | 0 | 0 | 0 | 0 | 0 | 111.5 | ||||
| 64 | P | 47.1 | Very low | 39.3 | Very low | 132 Ų | 132 | 129.7 Ų | 129.7 | 86% | 0.857 | 82% | 0.822 | S | S | * | * | trans | -88.2 | 127.7 | -173.7 | 33.1 | -32.4 | 0 | 0 | 0 | 112.2 | ||||
| 65 | A | 38.2 | Very low | 39.7 | Very low | 103 Ų | 103 | 138.2 Ų | 138.2 | 85% | 0.851 | 83% | 0.832 | S | S | * | * | trans | -166.1 | 140.2 | 157.3 | 0 | 0 | 0 | 0 | 0 | 112.9 | ||||
| 66 | G | 37.7 | Very low | 39.4 | Very low | 83 Ų | 83 | 141.1 Ų | 141.1 | 86% | 0.856 | 83% | 0.828 | S | S | * | * | trans | 79.2 | 92.6 | 147.3 | 0 | 0 | 0 | 0 | 0 | 117.3 | ||||
| 67 | G | 37.1 | Very low | 39.1 | Very low | 77 Ų | 77 | 133.5 Ų | 133.5 | 79% | 0.794 | 83% | 0.825 | S | S | * | * | trans | -75.3 | 152.9 | 169.3 | 0 | 0 | 0 | 0 | 0 | 114.1 | ||||
| 68 | A | 37.7 | Very low | 39.4 | Very low | 106 Ų | 106 | 134.5 Ų | 134.5 | 88% | 0.876 | 81% | 0.805 | S | S | * | * | trans | 41.8 | 87.6 | 138.6 | 0 | 0 | 0 | 0 | 0 | 120.2 | ||||
| 69 | G | 36.6 | Very low | 39.1 | Very low | 75 Ų | 75 | 131.2 Ų | 131.2 | 77% | 0.773 | 79% | 0.792 | S | S | * | * | 90 | 167.4 | 113.1 | 0 | 0 | 0 | 0 | 0 | 120.8 | |||||
| 70 | K | 39.2 | Very low | 39 | Very low | 197 Ų | 197 | 124.2 Ų | 124.2 | 86% | 0.857 | 78% | 0.779 | S | S | * | * | trans | 76.1 | 102.2 | 173.7 | -60.4 | -174.5 | 177.3 | -177.5 | 0 | 118 | ||||
| 71 | M | 37.1 | Very low | 39.2 | Very low | 187 Ų | 187 | 122.1 Ų | 122.1 | 92% | 0.921 | 78% | 0.776 | S | S | * | * | 35.9 | 124.6 | 122.7 | -58.6 | 171.1 | 177.6 | 0 | 0 | 118.7 | |||||
| 72 | A | 35 | Very low | 39 | Very low | 96 Ų | 96 | 114.5 Ų | 114.5 | 79% | 0.793 | 76% | 0.756 | S | S | * | * | -178 | 156.9 | 106.2 | 0 | 0 | 0 | 0 | 0 | 113.8 | |||||
| 73 | A | 39.9 | Very low | 39.2 | Very low | 88 Ų | 88 | 112 Ų | 112 | 73% | 0.727 | 75% | 0.747 | S | S | * | * | trans | 57.7 | 85.2 | 152.4 | 0 | 0 | 0 | 0 | 0 | 118.3 | R75 | A73-R75 PolarHBondContact O-N 3.17Š| ||
| 74 | A | 36.9 | Very low | 39.2 | Very low | 95 Ų | 95 | 115.4 Ų | 115.4 | 79% | 0.785 | 75% | 0.748 | S | S | * | * | trans | -47.7 | 126.1 | 139.2 | 0 | 0 | 0 | 0 | 0 | 109.1 | R76 | A74-R76 PolarHBondContact O-N 3.05Š| ||
| 75 | R | 40.4 | Very low | 39.4 | Very low | 253 Ų | 253 | 111.9 Ų | 111.9 | 96% | 0.955 | 73% | 0.727 | S | S | * | * | trans | -71.2 | 71 | 168.1 | -83.1 | -169.8 | 172.4 | -137 | 0.6 | 109.6 | A73 G77 | A73-R75 PolarHBondContact O-N 3.17Å; R75-G77 VanDerWaalsContact C-N 3.29Å; R75-G77 PolarHBondContact O-N 2.98Å | ||
| 76 | R | 40.3 | Very low | 40 | Very low | 177 Ų | 177 | 109.9 Ų | 109.9 | 67% | 0.668 | 71% | 0.706 | S | S | * | * | trans | -66.3 | 94.5 | 164.1 | -155.6 | -173.7 | -172 | -168.6 | 0.7 | 105.5 | A74 R78 | A74-R76 PolarHBondContact O-N 3.05Å; R76-R78 HydrophobicContact CG-CB 4.15Å; R76-R78 PolarHBondContact O-N 3.42Å | ||
| 77 | G | 35.3 | Very low | 40.8 | Very low | 83 Ų | 83 | 111.2 Ų | 111.2 | 86% | 0.856 | 70% | 0.697 | S | S | * | * | trans | -67 | 53.1 | 170.2 | 0 | 0 | 0 | 0 | 0 | 111.2 | R75 G79 | R75-G77 VanDerWaalsContact C-N 3.29Å; R75-G77 PolarHBondContact O-N 2.98Å; G77-G79 VanDerWaalsContact C-N 3.35Å; G77-G79 PolarHBondContact O-N 3.32Å | ||
| 78 | R | 43.7 | Very low | 41.2 | Very low | 96 Ų | 96 | 111.5 Ų | 111.5 | 36% | 0.362 | 69% | 0.685 | S | S | . | * | trans | -82.9 | 87.9 | -179.7 | -166.8 | 165.4 | -162.1 | -165.7 | -2.2 | 107.8 | R76 S80 E153 | R76-R78 HydrophobicContact CG-CB 4.15Å; R76-R78 PolarHBondContact O-N 3.42Å; R78-S80 PolarHBondContact O-N 2.96Å; R78-E153 IonicContact CZ-OE1 2.72Å; R78-E153 IonicContact CZ-OE2 3.49Å; R78-E153 IonicContact NH1-OE1 3.54Å; R78-E153 PolarHBondContact NH1-OE1 3.19Å; R78-E153 IonicContact NH1-OE2 3.08Å; R78-E153 PolarHBondContact NH1-OE2 2.95Å; R78-E153 IonicContact NH2-OE1 2.76Å; R78-E153 PolarHBondContact NH2-OE1 2.89Å; R78-E153 IonicContact NH2-OE2 2.77Å; R78-E153 PolarHBondContact NH2-OE2 3.2Å | ||
| 79 | G | 35.1 | Very low | 41.8 | Very low | 52 Ų | 52 | 110.3 Ų | 110.3 | 54% | 0.536 | 66% | 0.664 | S | S | . | * | trans | -45.7 | 137.2 | 171.9 | 0 | 0 | 0 | 0 | 0 | 110.8 | G77 S81 | G77-G79 VanDerWaalsContact C-N 3.35Å; G77-G79 PolarHBondContact O-N 3.32Å; G79-S81 PolarHBondContact O-N 3.48Å | ||
| 80 | S | 42 | Very low | 42.7 | Very low | 93 Ų | 93 | 113.6 Ų | 113.6 | 65% | 0.65 | 66% | 0.659 | S | S | * | * | S | Bend | trans | -73.7 | 51.2 | -167.7 | -175.8 | 0 | 0 | 0 | 0 | 113.9 | R78 | R78-S80 PolarHBondContact O-N 2.96Š|
| 81 | S | 42.8 | Very low | 43.6 | Very low | 95 Ų | 95 | 110.6 Ų | 110.6 | 66% | 0.664 | 65% | 0.65 | S | S | * | * | trans | -93.4 | -18.3 | -178.7 | -51.8 | 0 | 0 | 0 | 0 | 113.4 | G79 V83 | G79-S81 PolarHBondContact O-N 3.48Å; S81-V83 VanDerWaalsContact C-N 3.34Å; S81-V83 PolarHBondContact O-N 2.9Å | ||
| 82 | T | 44.3 | Very low | 44.4 | Very low | 84 Ų | 84 | 106.9 Ų | 106.9 | 52% | 0.515 | 63% | 0.633 | S | S | . | * | S | Bend | trans | -71.9 | -25 | -175.4 | -42.7 | 0 | 0 | 0 | 0 | 113.4 | ||
| 83 | V | 40.2 | Very low | 45.6 | Very low | 111 Ų | 111 | 104.8 Ų | 104.8 | 67% | 0.673 | 61% | 0.606 | S | S | * | * | S | Bend | trans | -97.4 | -25.6 | -169.3 | -171.2 | 0 | 0 | 0 | 0 | 113.3 | S81 S86 | S81-V83 VanDerWaalsContact C-N 3.34Å; S81-V83 PolarHBondContact O-N 2.9Å; V83-S86 PolarHBondContact O-OG 3.01Å |
| 84 | L | 37.3 | Very low | 46.3 | Very low | 141 Ų | 141 | 109 Ų | 109 | 74% | 0.738 | 60% | 0.604 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -82.4 | -12.2 | -178.5 | -67 | 171.9 | 0 | 0 | 0 | 113.9 | P88 | L84-P88 WeakPolarHBondContact O-CD 3.36Š|
| 85 | S | 49.8 | Very low | 47.3 | Very low | 58 Ų | 58 | 109.9 Ų | 109.9 | 41% | 0.406 | 60% | 0.595 | S | S | . | * | T | Hydrogen-bonded Turn | trans | -84.5 | -15.4 | -174.2 | -160.7 | 0 | 0 | 0 | 0 | 114.1 | V87 L89 | S85-V87 PolarHBondContact O-N 3.26Å; S85-L89 WeakPolarHBondContact O-CB 3.36Å; S85-L89 PolarHBondContact O-N 3.06Å |
| 86 | S | 52.2 | Low | 48.2 | Very low | 61 Ų | 61 | 99.3 Ų | 99.3 | 43% | 0.427 | 56% | 0.56 | S | S | . | * | H | α-helix | trans | -64.9 | -43.2 | -171.6 | 53.7 | 0 | 0 | 0 | 0 | 113.9 | V83 Q90 | V83-S86 PolarHBondContact O-OG 3.01Å; S86-Q90 WeakPolarHBondContact O-CB 3.47Å; S86-Q90 PolarHBondContact O-N 2.76Å |
| 87 | V | 54.1 | Low | 49.1 | Very low | 110 Ų | 110 | 92.1 Ų | 92.1 | 67% | 0.667 | 54% | 0.541 | S | S | * | . | H | α-helix | trans | -80.4 | -48.9 | -176 | -174.7 | 0 | 0 | 0 | 0 | 113.1 | S85 L89 Q90 M91 | S85-V87 PolarHBondContact O-N 3.26Å; V87-L89 PolarHBondContact O-N 3.38Å; V87-Q90 PolarHBondContact O-N 3.03Å; V87-M91 WeakPolarHBondContact O-CB 3.31Å; V87-M91 PolarHBondContact O-N 3.22Å |
| 88 | P | 46.3 | Very low | 50 | Low | 83 Ų | 83 | 91.1 Ų | 91.1 | 54% | 0.539 | 52% | 0.518 | S | S | . | . | H | α-helix | trans | -67.3 | -39.4 | -177.9 | -19 | 33 | 0 | 0 | 0 | 112.3 | L84 M91 L92 | L84-P88 WeakPolarHBondContact O-CD 3.36Å; P88-M91 PolarHBondContact O-N 2.99Å; P88-L92 WeakPolarHBondContact O-CB 3.28Å; P88-L92 PolarHBondContact O-N 3.49Å |
| 89 | L | 48.6 | Very low | 50.7 | Low | 82 Ų | 82 | 94.3 Ų | 94.3 | 43% | 0.429 | 53% | 0.532 | S | S | . | . | H | α-helix | trans | -67.2 | -40.5 | 178.9 | -166.3 | 83.8 | 0 | 0 | 0 | 111.5 | S85 V87 L92 F93 | S85-L89 WeakPolarHBondContact O-CB 3.36Å; S85-L89 PolarHBondContact O-N 3.06Å; V87-L89 PolarHBondContact O-N 3.38Å; L89-L92 WeakPolarHBondContact O-CB 3.32Å; L89-L92 PolarHBondContact O-N 2.95Å; L89-F93 HydrophobicContact CD1-CE2 4.46Å; L89-F93 HydrophobicContact CD2-CD2 4.48Å; L89-F93 HydrophobicContact CD2-CE2 3.69Å; L89-F93 HydrophobicContact CD2-CZ 4.43Å; L89-F93 HydrophobicContact CG-CD2 4.12Å; L89-F93 HydrophobicContact CG-CE2 3.65Å; L89-F93 HydrophobicContact CG-CZ 4.36Å; L89-F93 WeakPolarHBondContact O-CD2 3.32Å; L89-F93 PolarHBondContact O-N 2.73Å |
| 90 | Q | 56.9 | Low | 51.9 | Low | 143 Ų | 143 | 93.1 Ų | 93.1 | 67% | 0.668 | 51% | 0.511 | S | S | * | . | H | α-helix | trans | -67.6 | -37.7 | 176.4 | -175.5 | 168.6 | -10.7 | 0 | 0 | 111.8 | S86 V87 L92 F93 Y94 | S86-Q90 WeakPolarHBondContact O-CB 3.47Å; S86-Q90 PolarHBondContact O-N 2.76Å; V87-Q90 PolarHBondContact O-N 3.03Å; Q90-L92 VanDerWaalsContact C-N 3.34Å; Q90-F93 PolarHBondContact O-N 2.94Å; Q90-Y94 WeakPolarHBondContact O-CB 3.21Å; Q90-Y94 PolarHBondContact O-N 2.95Å |
| 91 | M | 56.5 | Low | 52.7 | Low | 135 Ų | 135 | 91.3 Ų | 91.3 | 67% | 0.665 | 50% | 0.502 | S | S | * | . | H | α-helix | trans | -63.7 | -40.6 | 171 | -165.2 | 68.5 | 177 | 0 | 0 | 111.4 | V87 P88 Y94 L95 | V87-M91 WeakPolarHBondContact O-CB 3.31Å; V87-M91 PolarHBondContact O-N 3.22Å; P88-M91 PolarHBondContact O-N 2.99Å; M91-Y94 PolarHBondContact O-N 3.25Å; M91-L95 VanDerWaalsContact O-CB 3.31Å; M91-L95 WeakPolarHBondContact O-CB 3.3Å; M91-L95 PolarHBondContact O-N 3.38Å |
| 92 | L | 55.1 | Low | 53.5 | Low | 108 Ų | 108 | 92 Ų | 92 | 57% | 0.565 | 50% | 0.497 | S | S | * | . | H | α-helix | trans | -63 | -43.7 | 176.3 | -149 | 81.4 | 0 | 0 | 0 | 111.5 | P88 L89 Q90 L95 S96 | P88-L92 WeakPolarHBondContact O-CB 3.28Å; P88-L92 PolarHBondContact O-N 3.49Å; L89-L92 WeakPolarHBondContact O-CB 3.32Å; L89-L92 PolarHBondContact O-N 2.95Å; Q90-L92 VanDerWaalsContact C-N 3.34Å; L92-L95 PolarHBondContact O-N 3.31Å; L92-S96 WeakPolarHBondContact O-CB 3.46Å; L92-S96 PolarHBondContact O-N 2.97Å; L92-S96 PolarHBondContact O-OG 3.25Å |
| 93 | F | 59.3 | Low | 54.4 | Low | 52 Ų | 52 | 93.5 Ų | 93.5 | 23% | 0.228 | 49% | 0.494 | C | S | . | . | H | α-helix | trans | -64.4 | -39.7 | 174.7 | -75.5 | -51.9 | 0 | 0 | 0 | 113 | L89 Q90 L95 S96 G97 R142 L143 | L89-F93 HydrophobicContact CD1-CE2 4.46Å; L89-F93 HydrophobicContact CD2-CD2 4.48Å; L89-F93 HydrophobicContact CD2-CE2 3.69Å; L89-F93 HydrophobicContact CD2-CZ 4.43Å; L89-F93 HydrophobicContact CG-CD2 4.12Å; L89-F93 HydrophobicContact CG-CE2 3.65Å; L89-F93 HydrophobicContact CG-CZ 4.36Å; L89-F93 WeakPolarHBondContact O-CD2 3.32Å; L89-F93 PolarHBondContact O-N 2.73Å; Q90-F93 PolarHBondContact O-N 2.94Å; F93-L95 VanDerWaalsContact C-N 3.35Å; F93-S96 PolarHBondContact O-N 3.48Å; F93-G97 PolarHBondContact O-N 3.46Å; F93-R142 HydrophobicContact CE1-CG 4.47Å; F93-L143 HydrophobicContact CB-CD2 3.83Å; F93-L143 HydrophobicContact CD1-CD2 3.88Å; F93-L143 HydrophobicContact CG-CD2 4.07Å |
| 94 | Y | 55.1 | Low | 55.4 | Low | 177 Ų | 177 | 91.7 Ų | 91.7 | 69% | 0.694 | 48% | 0.478 | S | S | * | . | H | α-helix | trans | -66.4 | -40 | 177 | -157.9 | -87.9 | 0 | 0 | 0 | 111.5 | Q90 M91 T98 | Q90-Y94 WeakPolarHBondContact O-CB 3.21Å; Q90-Y94 PolarHBondContact O-N 2.95Å; M91-Y94 PolarHBondContact O-N 3.25Å; Y94-T98 VanDerWaalsContact O-CB 3.3Å; Y94-T98 WeakPolarHBondContact O-CB 3.48Å; Y94-T98 PolarHBondContact O-N 3.47Å; Y94-T98 PolarHBondContact O-OG1 3.02Å |
| 95 | L | 57.1 | Low | 56.8 | Low | 113 Ų | 113 | 89.5 Ų | 89.5 | 59% | 0.592 | 47% | 0.466 | S | S | * | . | H | α-helix | trans | -67 | -44 | 174.6 | -172.5 | 66.3 | 0 | 0 | 0 | 111.7 | M91 L92 F93 T98 Y99 | M91-L95 VanDerWaalsContact O-CB 3.31Å; M91-L95 WeakPolarHBondContact O-CB 3.3Å; M91-L95 PolarHBondContact O-N 3.38Å; L92-L95 PolarHBondContact O-N 3.31Å; F93-L95 VanDerWaalsContact C-N 3.35Å; L95-T98 PolarHBondContact O-N 3.45Å; L95-Y99 WeakPolarHBondContact O-CB 3.46Å; L95-Y99 PolarHBondContact O-N 3.29Å |
| 96 | S | 59.8 | Low | 57.5 | Low | 32 Ų | 32 | 89.6 Ų | 89.6 | 22% | 0.224 | 47% | 0.47 | C | S | . | . | H | α-helix | trans | -61.7 | -47.5 | 175 | -63.1 | 0 | 0 | 0 | 0 | 111.7 | L92 F93 T98 Y99 Y100 E139 | L92-S96 WeakPolarHBondContact O-CB 3.46Å; L92-S96 PolarHBondContact O-N 2.97Å; L92-S96 PolarHBondContact O-OG 3.25Å; F93-S96 PolarHBondContact O-N 3.48Å; S96-T98 VanDerWaalsContact C-N 3.33Å; S96-T98 PolarHBondContact O-N 2.97Å; S96-Y99 PolarHBondContact O-N 3.42Å; S96-Y100 VanDerWaalsContact O-CB 3.27Å; S96-Y100 WeakPolarHBondContact O-CB 3.33Å; S96-Y100 PolarHBondContact O-N 2.78Å; S96-E139 WeakPolarHBondContact CB-OE1 3.44Å |
| 97 | G | 58.9 | Low | 58.2 | Low | 25 Ų | 25 | 88 Ų | 88 | 26% | 0.258 | 46% | 0.458 | S | S | . | . | H | α-helix | trans | -62.5 | -36.8 | 176.4 | 0 | 0 | 0 | 0 | 0 | 113.5 | F93 A101 | F93-G97 PolarHBondContact O-N 3.46Å; G97-A101 WeakPolarHBondContact O-CB 3.39Å; G97-A101 PolarHBondContact O-N 3.01Å |
| 98 | T | 55.6 | Low | 58.7 | Low | 62 Ų | 62 | 85.5 Ų | 85.5 | 38% | 0.38 | 44% | 0.44 | S | S | . | . | H | α-helix | trans | -71.9 | -42.8 | 176.2 | -58.5 | 0 | 0 | 0 | 0 | 111.4 | Y94 L95 S96 Y100 A101 L102 | Y94-T98 VanDerWaalsContact O-CB 3.3Å; Y94-T98 WeakPolarHBondContact O-CB 3.48Å; Y94-T98 PolarHBondContact O-N 3.47Å; Y94-T98 PolarHBondContact O-OG1 3.02Å; L95-T98 PolarHBondContact O-N 3.45Å; S96-T98 VanDerWaalsContact C-N 3.33Å; S96-T98 PolarHBondContact O-N 2.97Å; T98-Y100 VanDerWaalsContact C-N 3.34Å; T98-A101 PolarHBondContact O-N 2.86Å; T98-L102 HydrophobicContact CG2-CD1 4.32Å; T98-L102 WeakPolarHBondContact O-CG 3.47Å; T98-L102 PolarHBondContact O-N 3.47Å |
| 99 | Y | 58.4 | Low | 59.8 | Low | 164 Ų | 164 | 86.6 Ų | 86.6 | 64% | 0.643 | 44% | 0.441 | S | S | * | . | H | α-helix | trans | -61.1 | -43.2 | 173.3 | -179.8 | -95.2 | 0 | 0 | 0 | 111.2 | L95 S96 L102 Y103 | L95-Y99 WeakPolarHBondContact O-CB 3.46Å; L95-Y99 PolarHBondContact O-N 3.29Å; S96-Y99 PolarHBondContact O-N 3.42Å; Y99-L102 PolarHBondContact O-N 3Å; Y99-Y103 WeakPolarHBondContact O-CB 3.47Å; Y99-Y103 PolarHBondContact O-N 3.43Å |
| 100 | Y | 59.3 | Low | 60.8 | Low | 26 Ų | 26 | 88.8 Ų | 88.8 | 10% | 0.102 | 45% | 0.451 | C | S | . | . | H | α-helix | trans | -58.6 | -48.1 | 173.1 | -174.9 | -75.3 | 0 | 0 | 0 | 111.2 | S96 T98 L102 Y103 F104 L132 M135 G136 E139 | S96-Y100 VanDerWaalsContact O-CB 3.27Å; S96-Y100 WeakPolarHBondContact O-CB 3.33Å; S96-Y100 PolarHBondContact O-N 2.78Å; T98-Y100 VanDerWaalsContact C-N 3.34Å; Y100-L102 VanDerWaalsContact C-N 3.33Å; Y100-L102 PolarHBondContact O-N 2.93Å; Y100-Y103 PolarHBondContact O-N 3.48Å; Y100-F104 HydrophobicContact CD1-CB 4.43Å; Y100-F104 HydrophobicContact CE1-CB 4.02Å; Y100-F104 HydrophobicContact CE1-CD2 4.08Å; Y100-F104 HydrophobicContact CE1-CG 4.45Å; Y100-F104 VanDerWaalsContact O-CB 3.28Å; Y100-F104 WeakPolarHBondContact O-CB 3.29Å; Y100-F104 PolarHBondContact O-N 2.92Å; Y100-L132 PolarHBondContact OH-O 3.39Å; Y100-M135 HydrophobicContact CD2-CE 3.72Å; Y100-M135 HydrophobicContact CD2-SD 4.08Å; Y100-M135 HydrophobicContact CE2-CB 3.99Å; Y100-M135 HydrophobicContact CE2-CE 3.31Å; Y100-M135 HydrophobicContact CE2-CG 4.37Å; Y100-M135 WeakPolarHBondContact CE2-O 3.49Å; Y100-M135 HydrophobicContact CE2-SD 3.57Å; Y100-M135 VanDerWaalsContact CE2-SD 3.57Å; Y100-G136 VanDerWaalsContact CZ-CA 3.44Å; Y100-G136 WeakPolarHBondContact OH-CA 3.37Å; Y100-G136 PolarHBondContact OH-N 3.47Å; Y100-E139 HydrophobicContact CD2-CB 3.77Å; Y100-E139 HydrophobicContact CD2-CG 3.85Å; Y100-E139 HydrophobicContact CE2-CB 4.06Å; Y100-E139 HydrophobicContact CG-CB 4.36Å; Y100-E139 HydrophobicContact CG-CG 4.11Å |
| 101 | A | 58.6 | Low | 61.2 | Low | 55 Ų | 55 | 82.9 Ų | 82.9 | 46% | 0.455 | 42% | 0.424 | S | S | . | . | H | α-helix | trans | -62.7 | -39 | 179.5 | 0 | 0 | 0 | 0 | 0 | 112.4 | G97 T98 L105 | G97-A101 WeakPolarHBondContact O-CB 3.39Å; G97-A101 PolarHBondContact O-N 3.01Å; T98-A101 PolarHBondContact O-N 2.86Å; A101-L105 WeakPolarHBondContact O-CB 3.34Å; A101-L105 PolarHBondContact O-N 2.77Å |
| 102 | L | 59.5 | Low | 61.7 | Low | 110 Ų | 110 | 79.6 Ų | 79.6 | 58% | 0.576 | 41% | 0.411 | S | S | * | . | H | α-helix | trans | -68.7 | -42 | 174.8 | -69.5 | 171.6 | 0 | 0 | 0 | 112 | T98 Y99 Y100 L105 A106 | T98-L102 HydrophobicContact CG2-CD1 4.32Å; T98-L102 WeakPolarHBondContact O-CG 3.47Å; T98-L102 PolarHBondContact O-N 3.47Å; Y99-L102 PolarHBondContact O-N 3Å; Y100-L102 VanDerWaalsContact C-N 3.33Å; Y100-L102 PolarHBondContact O-N 2.93Å; L102-L105 PolarHBondContact O-N 2.72Å; L102-A106 VanDerWaalsContact O-CB 3.3Å; L102-A106 WeakPolarHBondContact O-CB 3.5Å; L102-A106 PolarHBondContact O-N 2.97Å |
| 103 | Y | 62.7 | Low | 62.5 | Low | 115 Ų | 115 | 81.8 Ų | 81.8 | 45% | 0.451 | 41% | 0.413 | S | S | . | . | H | α-helix | trans | -62 | -47 | 174.5 | -176.4 | -92.2 | 0 | 0 | 0 | 111 | Y99 Y100 L105 A106 T107 M135 | Y99-Y103 WeakPolarHBondContact O-CB 3.47Å; Y99-Y103 PolarHBondContact O-N 3.43Å; Y100-Y103 PolarHBondContact O-N 3.48Å; Y103-L105 VanDerWaalsContact C-N 3.34Å; Y103-L105 PolarHBondContact O-N 2.92Å; Y103-A106 PolarHBondContact O-N 3.44Å; Y103-T107 WeakPolarHBondContact O-CB 3.38Å; Y103-T107 PolarHBondContact O-N 3.36Å; Y103-T107 PolarHBondContact O-OG1 3.35Å; Y103-M135 HydrophobicContact CD1-CE 3.81Å; Y103-M135 HydrophobicContact CE1-CE 3.9Å |
| 104 | F | 62.7 | Low | 62.7 | Low | 74 Ų | 74 | 85.2 Ų | 85.2 | 33% | 0.325 | 43% | 0.428 | S | S | . | . | H | α-helix | trans | -55.3 | -48.9 | 174.8 | -179.1 | -80.5 | 0 | 0 | 0 | 111.5 | Y100 L108 L132 | Y100-F104 HydrophobicContact CD1-CB 4.43Å; Y100-F104 HydrophobicContact CE1-CB 4.02Å; Y100-F104 HydrophobicContact CE1-CD2 4.08Å; Y100-F104 HydrophobicContact CE1-CG 4.45Å; Y100-F104 VanDerWaalsContact O-CB 3.28Å; Y100-F104 WeakPolarHBondContact O-CB 3.29Å; Y100-F104 PolarHBondContact O-N 2.92Å; F104-L108 HydrophobicContact CE1-CD2 4.2Å; F104-L108 VanDerWaalsContact O-CB 3.25Å; F104-L108 WeakPolarHBondContact O-CB 3.46Å; F104-L108 PolarHBondContact O-N 3.49Å; F104-L132 HydrophobicContact CD1-CD2 4.48Å; F104-L132 HydrophobicContact CD2-CD1 4Å; F104-L132 HydrophobicContact CD2-CD2 3.65Å; F104-L132 HydrophobicContact CD2-CG 3.45Å; F104-L132 VanDerWaalsContact CD2-CG 3.45Å; F104-L132 HydrophobicContact CE1-CD2 4.31Å; F104-L132 HydrophobicContact CE2-CD2 3.44Å; F104-L132 VanDerWaalsContact CE2-CD2 3.44Å; F104-L132 HydrophobicContact CE2-CG 3.53Å; F104-L132 HydrophobicContact CG-CD1 4.47Å; F104-L132 HydrophobicContact CG-CD2 4.16Å; F104-L132 HydrophobicContact CG-CG 4.25Å; F104-L132 HydrophobicContact CZ-CD2 3.79Å; F104-L132 HydrophobicContact CZ-CG 4.38Å |
| 105 | L | 66.1 | Low | 63.2 | Low | 95 Ų | 95 | 78.4 Ų | 78.4 | 50% | 0.497 | 41% | 0.407 | S | S | . | . | H | α-helix | trans | -66.6 | -40.8 | -179.4 | -174.9 | 62.9 | 0 | 0 | 0 | 112.1 | A101 L102 Y103 L108 L109 | A101-L105 WeakPolarHBondContact O-CB 3.34Å; A101-L105 PolarHBondContact O-N 2.77Å; L102-L105 PolarHBondContact O-N 2.72Å; Y103-L105 VanDerWaalsContact C-N 3.34Å; Y103-L105 PolarHBondContact O-N 2.92Å; L105-L108 PolarHBondContact O-N 2.76Å; L105-L109 HydrophobicContact CD1-CD1 4.14Å; L105-L109 WeakPolarHBondContact O-CB 3.48Å; L105-L109 PolarHBondContact O-N 3.49Å |
| 106 | A | 64.9 | Low | 63.6 | Low | 59 Ų | 59 | 80.7 Ų | 80.7 | 49% | 0.488 | 41% | 0.414 | S | S | . | . | H | α-helix | trans | -65.8 | -43.9 | 177.2 | 0 | 0 | 0 | 0 | 0 | 112 | L102 Y103 L109 M110 | L102-A106 VanDerWaalsContact O-CB 3.3Å; L102-A106 WeakPolarHBondContact O-CB 3.5Å; L102-A106 PolarHBondContact O-N 2.97Å; Y103-A106 PolarHBondContact O-N 3.44Å; A106-L109 PolarHBondContact O-N 3.01Å; A106-M110 WeakPolarHBondContact O-CB 3.25Å; A106-M110 PolarHBondContact O-N 3.48Å |
| 107 | T | 65.5 | Low | 63.9 | Low | 28 Ų | 28 | 83.3 Ų | 83.3 | 17% | 0.172 | 43% | 0.429 | C | S | . | . | H | α-helix | trans | -64.7 | -43.3 | 175 | -56.6 | 0 | 0 | 0 | 0 | 110.9 | Y103 L109 M110 I111 L132 | Y103-T107 WeakPolarHBondContact O-CB 3.38Å; Y103-T107 PolarHBondContact O-N 3.36Å; Y103-T107 PolarHBondContact O-OG1 3.35Å; T107-L109 PolarHBondContact O-N 3.45Å; T107-M110 PolarHBondContact O-N 3.5Å; T107-I111 HydrophobicContact CG2-CD1 3.88Å; T107-I111 HydrophobicContact CG2-CG1 4.41Å; T107-I111 WeakPolarHBondContact O-CB 3.38Å; T107-I111 VanDerWaalsContact O-CG1 3.25Å; T107-I111 WeakPolarHBondContact O-CG1 3.48Å; T107-I111 PolarHBondContact O-N 3.27Å; T107-L132 HydrophobicContact CG2-CD1 3.8Å |
| 108 | L | 66 | Low | 63.7 | Low | 57 Ų | 57 | 89.1 Ų | 89.1 | 30% | 0.298 | 45% | 0.447 | S | S | . | . | H | α-helix | trans | -60.6 | -42.9 | 175.8 | -172 | 70.6 | 0 | 0 | 0 | 112.1 | F104 L105 M110 I111 T112 | F104-L108 HydrophobicContact CE1-CD2 4.2Å; F104-L108 VanDerWaalsContact O-CB 3.25Å; F104-L108 WeakPolarHBondContact O-CB 3.46Å; F104-L108 PolarHBondContact O-N 3.49Å; L105-L108 PolarHBondContact O-N 2.76Å; L108-M110 VanDerWaalsContact C-N 3.35Å; L108-I111 PolarHBondContact O-N 2.89Å; L108-T112 WeakPolarHBondContact O-CG2 3.37Å; L108-T112 PolarHBondContact O-N 3.3Å; L108-T112 PolarHBondContact O-OG1 3.47Å |
| 109 | L | 69.8 | Low | 63.8 | Low | 106 Ų | 106 | 92.2 Ų | 92.2 | 56% | 0.555 | 47% | 0.471 | S | S | * | . | H | α-helix | trans | -63.3 | -39 | 174.3 | -110.3 | 69.1 | 0 | 0 | 0 | 112.4 | L105 A106 T107 T112 Y113 | L105-L109 HydrophobicContact CD1-CD1 4.14Å; L105-L109 WeakPolarHBondContact O-CB 3.48Å; L105-L109 PolarHBondContact O-N 3.49Å; A106-L109 PolarHBondContact O-N 3.01Å; T107-L109 PolarHBondContact O-N 3.45Å; L109-T112 PolarHBondContact O-OG1 2.85Å; L109-Y113 WeakPolarHBondContact O-CB 3.47Å; L109-Y113 PolarHBondContact O-N 3Å |
| 110 | M | 67.9 | Low | 63.6 | Low | 128 Ų | 128 | 86.1 Ų | 86.1 | 63% | 0.631 | 45% | 0.452 | S | S | * | . | H | α-helix | trans | -69.1 | -37.8 | 178 | -163.5 | 64.2 | 66.4 | 0 | 0 | 111.4 | A106 T107 L108 K114 | A106-M110 WeakPolarHBondContact O-CB 3.25Å; A106-M110 PolarHBondContact O-N 3.48Å; T107-M110 PolarHBondContact O-N 3.5Å; L108-M110 VanDerWaalsContact C-N 3.35Å; M110-K114 WeakPolarHBondContact O-CB 3.42Å; M110-K114 PolarHBondContact O-N 2.97Å |
| 111 | I | 66.1 | Low | 63.8 | Low | 19 Ų | 19 | 88.7 Ų | 88.7 | 10% | 0.097 | 47% | 0.472 | C | S | . | . | H | α-helix | trans | -63.1 | -50.6 | 173.9 | -72.3 | 167.8 | 0 | 0 | 0 | 110.6 | T107 L108 K114 S115 L125 D128 | T107-I111 HydrophobicContact CG2-CD1 3.88Å; T107-I111 HydrophobicContact CG2-CG1 4.41Å; T107-I111 WeakPolarHBondContact O-CB 3.38Å; T107-I111 VanDerWaalsContact O-CG1 3.25Å; T107-I111 WeakPolarHBondContact O-CG1 3.48Å; T107-I111 PolarHBondContact O-N 3.27Å; L108-I111 PolarHBondContact O-N 2.89Å; I111-K114 PolarHBondContact O-N 3.5Å; I111-S115 PolarHBondContact O-N 3.02Å; I111-S115 PolarHBondContact O-OG 3.07Å; I111-L125 HydrophobicContact CG2-CD2 3.77Å; I111-D128 HydrophobicContact CD1-CB 3.91Å; I111-D128 WeakPolarHBondContact CD1-OD2 3.43Å; I111-D128 HydrophobicContact CG1-CB 4.41Å; I111-D128 VanDerWaalsContact CG1-OD2 3.31Å; I111-D128 WeakPolarHBondContact CG1-OD2 3.35Å |
| 112 | T | 66.9 | Low | 63.9 | Low | 67 Ų | 67 | 93.1 Ų | 93.1 | 41% | 0.411 | 48% | 0.483 | S | S | . | . | H | α-helix | trans | -67.2 | -42.9 | -179.5 | 54.8 | 0 | 0 | 0 | 0 | 111.9 | L108 L109 K114 S115 E116 | L108-T112 WeakPolarHBondContact O-CG2 3.37Å; L108-T112 PolarHBondContact O-N 3.3Å; L108-T112 PolarHBondContact O-OG1 3.47Å; L109-T112 PolarHBondContact O-OG1 2.85Å; T112-K114 VanDerWaalsContact C-N 3.28Å; T112-K114 PolarHBondContact O-N 3.45Å; T112-S115 WeakPolarHBondContact CA-OG 3.43Å; T112-S115 PolarHBondContact O-N 2.94Å; T112-S115 PolarHBondContact O-OG 3.48Å; T112-E116 WeakPolarHBondContact O-CG 3.3Å; T112-E116 PolarHBondContact O-N 2.91Å; T112-E116 VanDerWaalsContact O-N 3.08Å |
| 113 | Y | 71.9 | Confident | 64 | Low | 154 Ų | 154 | 95.6 Ų | 95.6 | 60% | 0.604 | 49% | 0.491 | S | S | * | . | H | α-helix | trans | -56.9 | -44 | 173.1 | 178.9 | -104.2 | 0 | 0 | 0 | 111.7 | L109 V117 | L109-Y113 WeakPolarHBondContact O-CB 3.47Å; L109-Y113 PolarHBondContact O-N 3Å; Y113-V117 HydrophobicContact CD2-CG2 4.24Å; Y113-V117 HydrophobicContact CE1-CG2 4.38Å; Y113-V117 HydrophobicContact CE2-CG2 3.86Å; Y113-V117 WeakPolarHBondContact O-CB 3.44Å; Y113-V117 WeakPolarHBondContact O-CG2 3.2Å; Y113-V117 PolarHBondContact O-N 2.91Å; Y113-V117 VanDerWaalsContact O-N 3.12Å |
| 114 | K | 63.8 | Low | 63.9 | Low | 123 Ų | 123 | 97.7 Ų | 97.7 | 54% | 0.535 | 50% | 0.5 | S | S | . | . | H | α-helix | trans | -70.4 | -33.5 | 179.4 | -169.6 | 167.6 | -177.3 | 174.5 | 0 | 113 | M110 I111 T112 F118 | M110-K114 WeakPolarHBondContact O-CB 3.42Å; M110-K114 PolarHBondContact O-N 2.97Å; I111-K114 PolarHBondContact O-N 3.5Å; T112-K114 VanDerWaalsContact C-N 3.28Å; T112-K114 PolarHBondContact O-N 3.45Å; K114-F118 PolarHBondContact O-N 3.43Å |
| 115 | S | 64.7 | Low | 64 | Low | 35 Ų | 35 | 96.2 Ų | 96.2 | 25% | 0.245 | 50% | 0.495 | C | S | . | . | H | α-helix | trans | -73.2 | -29.1 | 177.5 | 63.1 | 0 | 0 | 0 | 0 | 113.9 | I111 T112 F118 | I111-S115 PolarHBondContact O-N 3.02Å; I111-S115 PolarHBondContact O-OG 3.07Å; T112-S115 WeakPolarHBondContact CA-OG 3.43Å; T112-S115 PolarHBondContact O-N 2.94Å; T112-S115 PolarHBondContact O-OG 3.48Å; S115-F118 CarbonylContact C-O 3.52Å; S115-F118 VanDerWaalsContact O-O 3.14Å |
| 116 | E | 67.2 | Low | 63.8 | Low | 161 Ų | 161 | 96.2 Ų | 96.2 | 75% | 0.752 | 50% | 0.498 | S | S | * | . | H | α-helix | trans | -78.6 | -42.3 | 174.9 | -63.8 | -60.6 | 128.8 | 0 | 0 | 111.9 | T112 | T112-E116 WeakPolarHBondContact O-CG 3.3Å; T112-E116 PolarHBondContact O-N 2.91Å; T112-E116 VanDerWaalsContact O-N 3.08Å |
| 117 | V | 64.1 | Low | 63.6 | Low | 87 Ų | 87 | 96 Ų | 96 | 53% | 0.527 | 49% | 0.489 | S | S | . | . | H | α-helix | trans | -80.9 | -37.6 | -175.7 | 176.3 | 0 | 0 | 0 | 0 | 112.7 | Y113 | Y113-V117 HydrophobicContact CD2-CG2 4.24Å; Y113-V117 HydrophobicContact CE1-CG2 4.38Å; Y113-V117 HydrophobicContact CE2-CG2 3.86Å; Y113-V117 WeakPolarHBondContact O-CB 3.44Å; Y113-V117 WeakPolarHBondContact O-CG2 3.2Å; Y113-V117 PolarHBondContact O-N 2.91Å; Y113-V117 VanDerWaalsContact O-N 3.12Å |
| 118 | F | 56.1 | Low | 63.6 | Low | 146 Ų | 146 | 97.8 Ų | 97.8 | 64% | 0.64 | 50% | 0.497 | S | S | * | . | S | Bend | trans | -114.9 | 121.3 | 170.6 | -92.3 | -102.1 | 0 | 0 | 0 | 108.1 | K114 S115 C120 | K114-F118 PolarHBondContact O-N 3.43Å; S115-F118 CarbonylContact C-O 3.52Å; S115-F118 VanDerWaalsContact O-O 3.14Å; F118-C120 PolarHBondContact O-N 2.86Å |
| 119 | S | 57.5 | Low | 63.5 | Low | 127 Ų | 127 | 99.5 Ų | 99.5 | 89% | 0.888 | 51% | 0.506 | S | S | * | . | trans | -66.5 | 76.3 | 168.7 | -56.1 | 0 | 0 | 0 | 0 | 110.3 | ||||
| 120 | C | 54.3 | Low | 63.2 | Low | 37 Ų | 37 | 97.3 Ų | 97.3 | 25% | 0.25 | 50% | 0.503 | C | S | . | . | trans | -82.4 | 144.2 | -166.4 | -132.4 | 0 | 0 | 0 | 0 | 110.4 | F118 H122 | F118-C120 PolarHBondContact O-N 2.86Å; C120-H122 PolarHBondContact O-N 3.45Å | ||
| 121 | P | 63.8 | Low | 62.9 | Low | 79 Ų | 79 | 92.7 Ų | 92.7 | 51% | 0.513 | 48% | 0.481 | S | S | . | . | trans | -60.2 | 129.3 | -179.6 | -21.8 | 32.1 | 0 | 0 | 0 | 111.4 | H123 Y124 | P121-H123 PolarHBondContact O-N 2.93Å; P121-Y124 HydrophobicContact CB-CD2 4Å; P121-Y124 HydrophobicContact CB-CE2 4.21Å; P121-Y124 HydrophobicContact CG-CD2 4.23Å; P121-Y124 HydrophobicContact CG-CE2 4.25Å; P121-Y124 PolarHBondContact O-N 3.07Å; P121-Y124 VanDerWaalsContact O-N 3.11Å | ||
| 122 | H | 61.2 | Low | 62.9 | Low | 149 Ų | 149 | 92.2 Ų | 92.2 | 69% | 0.69 | 48% | 0.479 | S | S | * | . | H | α-helix | trans | -53.3 | -29.1 | -171.5 | -83.2 | 28.9 | 0 | 0 | 0 | 114.7 | C120 Y124 L125 V126 | C120-H122 PolarHBondContact O-N 3.45Å; H122-Y124 VanDerWaalsContact C-N 3.29Å; H122-Y124 PolarHBondContact O-N 3.23Å; H122-L125 PolarHBondContact O-N 3.47Å; H122-V126 WeakPolarHBondContact O-CG2 3.02Å; H122-V126 PolarHBondContact O-N 3.43Å |
| 123 | H | 59.8 | Low | 62.6 | Low | 162 Ų | 162 | 96.1 Ų | 96.1 | 75% | 0.75 | 49% | 0.49 | S | S | * | . | H | α-helix | trans | -61.1 | -35.5 | -178.8 | -71.9 | 22.8 | 0 | 0 | 0 | 112.9 | P121 L127 | P121-H123 PolarHBondContact O-N 2.93Å; H123-L127 WeakPolarHBondContact O-CB 3.11Å; H123-L127 PolarHBondContact O-N 3.44Å; H123-L127 VanDerWaalsContact O-N 3.07Å |
| 124 | Y | 60.7 | Low | 62 | Low | 159 Ų | 159 | 92.1 Ų | 92.1 | 62% | 0.624 | 48% | 0.479 | S | S | * | . | H | α-helix | trans | -72.4 | -39.6 | 178.5 | -62.8 | -74 | 0 | 0 | 0 | 111.9 | P121 H122 L127 D128 | P121-Y124 HydrophobicContact CB-CD2 4Å; P121-Y124 HydrophobicContact CB-CE2 4.21Å; P121-Y124 HydrophobicContact CG-CD2 4.23Å; P121-Y124 HydrophobicContact CG-CE2 4.25Å; P121-Y124 PolarHBondContact O-N 3.07Å; P121-Y124 VanDerWaalsContact O-N 3.11Å; H122-Y124 VanDerWaalsContact C-N 3.29Å; H122-Y124 PolarHBondContact O-N 3.23Å; Y124-L127 PolarHBondContact O-N 3.03Å; Y124-D128 WeakPolarHBondContact O-CB 3.17Å; Y124-D128 PolarHBondContact O-N 3Å |
| 125 | L | 64.8 | Low | 61.8 | Low | 42 Ų | 42 | 89.2 Ų | 89.2 | 22% | 0.22 | 47% | 0.468 | C | S | . | . | H | α-helix | trans | -64.9 | -40.6 | 175.8 | -64.9 | 169.6 | 0 | 0 | 0 | 111.9 | I111 H122 D128 L129 | I111-L125 HydrophobicContact CG2-CD2 3.77Å; H122-L125 PolarHBondContact O-N 3.47Å; L125-D128 PolarHBondContact O-N 3.44Å; L125-L129 WeakPolarHBondContact O-CB 3.41Å; L125-L129 PolarHBondContact O-N 3.43Å |
| 126 | V | 62.9 | Low | 61.6 | Low | 95 Ų | 95 | 88.6 Ų | 88.6 | 58% | 0.576 | 47% | 0.467 | S | S | * | . | H | α-helix | trans | -66.5 | -39.4 | 176.7 | 171.2 | 0 | 0 | 0 | 0 | 111.3 | H122 A130 | H122-V126 WeakPolarHBondContact O-CG2 3.02Å; H122-V126 PolarHBondContact O-N 3.43Å; V126-A130 VanDerWaalsContact O-CB 3.27Å; V126-A130 WeakPolarHBondContact O-CB 3.38Å; V126-A130 PolarHBondContact O-N 3.48Å |
| 127 | L | 61.6 | Low | 61.1 | Low | 55 Ų | 55 | 85 Ų | 85 | 29% | 0.288 | 45% | 0.452 | S | S | . | . | H | α-helix | trans | -63.6 | -47.4 | 176.4 | -159.9 | 102.9 | 0 | 0 | 0 | 111 | H123 Y124 L129 A130 L131 W178 | H123-L127 WeakPolarHBondContact O-CB 3.11Å; H123-L127 PolarHBondContact O-N 3.44Å; H123-L127 VanDerWaalsContact O-N 3.07Å; Y124-L127 PolarHBondContact O-N 3.03Å; L127-L129 VanDerWaalsContact C-N 3.34Å; L127-L129 PolarHBondContact O-N 3.22Å; L127-A130 PolarHBondContact O-N 3.34Å; L127-L131 VanDerWaalsContact O-CB 3.24Å; L127-L131 WeakPolarHBondContact O-CB 3.46Å; L127-L131 PolarHBondContact O-N 3.4Å; L127-W178 HydrophobicContact CD1-CZ2 4.14Å |
| 128 | D | 63.7 | Low | 60.9 | Low | 65 Ų | 65 | 82.7 Ų | 82.7 | 35% | 0.348 | 44% | 0.437 | S | S | . | . | H | α-helix | trans | -64 | -38.4 | -179.9 | -144.2 | 7.2 | 0 | 0 | 0 | 111.6 | I111 Y124 L125 L131 L132 | I111-D128 HydrophobicContact CD1-CB 3.91Å; I111-D128 WeakPolarHBondContact CD1-OD2 3.43Å; I111-D128 HydrophobicContact CG1-CB 4.41Å; I111-D128 VanDerWaalsContact CG1-OD2 3.31Å; I111-D128 WeakPolarHBondContact CG1-OD2 3.35Å; Y124-D128 WeakPolarHBondContact O-CB 3.17Å; Y124-D128 PolarHBondContact O-N 3Å; L125-D128 PolarHBondContact O-N 3.44Å; D128-L131 WeakPolarHBondContact O-CB 3.41Å; D128-L131 PolarHBondContact O-N 3.49Å; D128-L132 WeakPolarHBondContact O-CB 3.42Å; D128-L132 PolarHBondContact O-N 3.38Å |
| 129 | L | 65.3 | Low | 61.1 | Low | 94 Ų | 94 | 77 Ų | 77 | 49% | 0.492 | 41% | 0.412 | S | S | . | . | H | α-helix | trans | -71 | -38.8 | 175.1 | -171.5 | 65.2 | 0 | 0 | 0 | 113 | L125 L127 L131 L132 F133 | L125-L129 WeakPolarHBondContact O-CB 3.41Å; L125-L129 PolarHBondContact O-N 3.43Å; L127-L129 VanDerWaalsContact C-N 3.34Å; L127-L129 PolarHBondContact O-N 3.22Å; L129-L131 VanDerWaalsContact C-N 3.3Å; L129-L132 HydrophobicContact CD1-CD2 4.37Å; L129-L132 WeakPolarHBondContact O-CB 3.35Å; L129-L132 PolarHBondContact O-N 3.19Å; L129-F133 PolarHBondContact O-N 3.37Å |
| 130 | A | 63.1 | Low | 61.1 | Low | 59 Ų | 59 | 73.7 Ų | 73.7 | 49% | 0.488 | 39% | 0.392 | S | S | . | . | H | α-helix | trans | -65 | -37.3 | 175.2 | 0 | 0 | 0 | 0 | 0 | 111.6 | V126 L127 F133 L134 | V126-A130 VanDerWaalsContact O-CB 3.27Å; V126-A130 WeakPolarHBondContact O-CB 3.38Å; V126-A130 PolarHBondContact O-N 3.48Å; L127-A130 PolarHBondContact O-N 3.34Å; A130-F133 PolarHBondContact O-N 2.91Å; A130-L134 WeakPolarHBondContact O-CB 3.47Å; A130-L134 PolarHBondContact O-N 3.25Å |
| 131 | L | 60.9 | Low | 61.4 | Low | 32 Ų | 32 | 76 Ų | 76 | 17% | 0.168 | 40% | 0.402 | C | S | . | . | H | α-helix | trans | -64.7 | -45.4 | 174.9 | -166.5 | 64.8 | 0 | 0 | 0 | 111.6 | L127 D128 L129 F133 L134 M135 F175 | L127-L131 VanDerWaalsContact O-CB 3.24Å; L127-L131 WeakPolarHBondContact O-CB 3.46Å; L127-L131 PolarHBondContact O-N 3.4Å; D128-L131 WeakPolarHBondContact O-CB 3.41Å; D128-L131 PolarHBondContact O-N 3.49Å; L129-L131 VanDerWaalsContact C-N 3.3Å; L131-F133 VanDerWaalsContact C-N 3.26Å; L131-F133 PolarHBondContact O-N 2.74Å; L131-L134 PolarHBondContact O-N 3.05Å; L131-M135 PolarHBondContact O-N 3.11Å; L131-F175 HydrophobicContact CD1-CD2 4.36Å; L131-F175 HydrophobicContact CD1-CE1 4.04Å; L131-F175 HydrophobicContact CD1-CE2 3.65Å; L131-F175 HydrophobicContact CD1-CZ 3.49Å; L131-F175 VanDerWaalsContact CD1-CZ 3.49Å; L131-F175 HydrophobicContact CD2-CE1 3.54Å; L131-F175 HydrophobicContact CD2-CE2 4.49Å; L131-F175 HydrophobicContact CD2-CZ 3.5Å; L131-F175 HydrophobicContact CG-CE1 4.15Å; L131-F175 HydrophobicContact CG-CE2 4.22Å; L131-F175 HydrophobicContact CG-CZ 3.62Å |
| 132 | L | 65.8 | Low | 61.5 | Low | 9 Ų | 9 | 76.6 Ų | 76.6 | 5% | 0.047 | 39% | 0.394 | C | S | . | . | H | α-helix | trans | -60.3 | -34.7 | 174.2 | -158.6 | 71.4 | 0 | 0 | 0 | 112.4 | Y100 F104 T107 D128 L129 | Y100-L132 PolarHBondContact OH-O 3.39Å; F104-L132 HydrophobicContact CD1-CD2 4.48Å; F104-L132 HydrophobicContact CD2-CD1 4Å; F104-L132 HydrophobicContact CD2-CD2 3.65Å; F104-L132 HydrophobicContact CD2-CG 3.45Å; F104-L132 VanDerWaalsContact CD2-CG 3.45Å; F104-L132 HydrophobicContact CE1-CD2 4.31Å; F104-L132 HydrophobicContact CE2-CD2 3.44Å; F104-L132 VanDerWaalsContact CE2-CD2 3.44Å; F104-L132 HydrophobicContact CE2-CG 3.53Å; F104-L132 HydrophobicContact CG-CD1 4.47Å; F104-L132 HydrophobicContact CG-CD2 4.16Å; F104-L132 HydrophobicContact CG-CG 4.25Å; F104-L132 HydrophobicContact CZ-CD2 3.79Å; F104-L132 HydrophobicContact CZ-CG 4.38Å; T107-L132 HydrophobicContact CG2-CD1 3.8Å; D128-L132 WeakPolarHBondContact O-CB 3.42Å; D128-L132 PolarHBondContact O-N 3.38Å; L129-L132 HydrophobicContact CD1-CD2 4.37Å; L129-L132 WeakPolarHBondContact O-CB 3.35Å; L129-L132 PolarHBondContact O-N 3.19Å |
| 133 | F | 61.9 | Low | 61.5 | Low | 149 Ų | 149 | 72.6 Ų | 72.6 | 65% | 0.654 | 38% | 0.377 | S | S | * | . | H | α-helix | trans | -74.5 | -42 | 175.2 | -162.5 | -104.2 | 0 | 0 | 0 | 112.1 | L129 A130 L131 G136 I137 | L129-F133 PolarHBondContact O-N 3.37Å; A130-F133 PolarHBondContact O-N 2.91Å; L131-F133 VanDerWaalsContact C-N 3.26Å; L131-F133 PolarHBondContact O-N 2.74Å; F133-G136 PolarHBondContact O-N 2.99Å; F133-G136 VanDerWaalsContact O-N 3.16Å; F133-I137 HydrophobicContact CD1-CD1 3.72Å; F133-I137 HydrophobicContact CD1-CG1 4.41Å; F133-I137 HydrophobicContact CE1-CD1 3.75Å; F133-I137 HydrophobicContact CE1-CG1 4.37Å; F133-I137 WeakPolarHBondContact O-CG1 3.37Å; F133-I137 PolarHBondContact O-N 3.03Å |
| 134 | L | 59.7 | Low | 61.4 | Low | 70 Ų | 70 | 71.2 Ų | 71.2 | 37% | 0.366 | 37% | 0.366 | S | S | . | . | H | α-helix | trans | -65.2 | -42.9 | 179.8 | -176.5 | 56.4 | 0 | 0 | 0 | 112.2 | A130 L131 G136 I137 L138 L171 | A130-L134 WeakPolarHBondContact O-CB 3.47Å; A130-L134 PolarHBondContact O-N 3.25Å; L131-L134 PolarHBondContact O-N 3.05Å; L134-G136 PolarHBondContact O-N 3.04Å; L134-I137 PolarHBondContact O-N 3.31Å; L134-L138 HydrophobicContact CD1-CD1 3.99Å; L134-L138 HydrophobicContact CG-CD1 4.22Å; L134-L138 WeakPolarHBondContact O-CD1 3.44Å; L134-L138 PolarHBondContact O-N 3.4Å; L134-L138 VanDerWaalsContact O-N 3.07Å; L134-L171 HydrophobicContact CD2-CD1 3.55Å; L134-L171 HydrophobicContact CG-CD1 4.08Å |
| 135 | M | 59 | Low | 61.2 | Low | 62 Ų | 62 | 66 Ų | 66 | 31% | 0.305 | 35% | 0.349 | S | S | . | . | H | α-helix | trans | -59.1 | -35.6 | 173.7 | -130 | -89.5 | -76.3 | 0 | 0 | 111 | Y100 Y103 L131 L138 E139 L171 | Y100-M135 HydrophobicContact CD2-CE 3.72Å; Y100-M135 HydrophobicContact CD2-SD 4.08Å; Y100-M135 HydrophobicContact CE2-CB 3.99Å; Y100-M135 HydrophobicContact CE2-CE 3.31Å; Y100-M135 HydrophobicContact CE2-CG 4.37Å; Y100-M135 WeakPolarHBondContact CE2-O 3.49Å; Y100-M135 HydrophobicContact CE2-SD 3.57Å; Y100-M135 VanDerWaalsContact CE2-SD 3.57Å; Y103-M135 HydrophobicContact CD1-CE 3.81Å; Y103-M135 HydrophobicContact CE1-CE 3.9Å; L131-M135 PolarHBondContact O-N 3.11Å; M135-L138 PolarHBondContact O-N 2.9Å; M135-E139 PolarHBondContact O-N 3.43Å; M135-L171 HydrophobicContact CG-CD2 4.39Å |
| 136 | G | 60.8 | Low | 60.8 | Low | 22 Ų | 22 | 65.1 Ų | 65.1 | 23% | 0.227 | 35% | 0.35 | C | S | . | . | H | α-helix | trans | -71.7 | -34.2 | 178.1 | 0 | 0 | 0 | 0 | 0 | 113.1 | Y100 F133 L134 A140 | Y100-G136 VanDerWaalsContact CZ-CA 3.44Å; Y100-G136 WeakPolarHBondContact OH-CA 3.37Å; Y100-G136 PolarHBondContact OH-N 3.47Å; F133-G136 PolarHBondContact O-N 2.99Å; F133-G136 VanDerWaalsContact O-N 3.16Å; L134-G136 PolarHBondContact O-N 3.04Å; G136-A140 WeakPolarHBondContact O-CB 3.44Å; G136-A140 PolarHBondContact O-N 2.9Å |
| 137 | I | 56.8 | Low | 60.4 | Low | 86 Ų | 86 | 65.2 Ų | 65.2 | 44% | 0.441 | 35% | 0.351 | S | S | . | . | H | α-helix | trans | -65.4 | -41.6 | 171.4 | -67.2 | 164.9 | 0 | 0 | 0 | 110.6 | F133 L134 A140 L141 | F133-I137 HydrophobicContact CD1-CD1 3.72Å; F133-I137 HydrophobicContact CD1-CG1 4.41Å; F133-I137 HydrophobicContact CE1-CD1 3.75Å; F133-I137 HydrophobicContact CE1-CG1 4.37Å; F133-I137 WeakPolarHBondContact O-CG1 3.37Å; F133-I137 PolarHBondContact O-N 3.03Å; L134-I137 PolarHBondContact O-N 3.31Å; I137-A140 PolarHBondContact O-N 3.39Å; I137-L141 VanDerWaalsContact O-CB 3.3Å; I137-L141 WeakPolarHBondContact O-CB 3.46Å; I137-L141 PolarHBondContact O-N 3.17Å |
| 138 | L | 60.1 | Low | 59.9 | Low | 37 Ų | 37 | 68.6 Ų | 68.6 | 19% | 0.194 | 36% | 0.36 | C | S | . | . | H | α-helix | trans | -63.6 | -45.1 | 176.5 | -89.8 | 76.2 | 0 | 0 | 0 | 111.6 | L134 M135 L141 R142 L171 | L134-L138 HydrophobicContact CD1-CD1 3.99Å; L134-L138 HydrophobicContact CG-CD1 4.22Å; L134-L138 WeakPolarHBondContact O-CD1 3.44Å; L134-L138 PolarHBondContact O-N 3.4Å; L134-L138 VanDerWaalsContact O-N 3.07Å; M135-L138 PolarHBondContact O-N 2.9Å; L138-L141 PolarHBondContact O-N 2.96Å; L138-R142 WeakPolarHBondContact O-CB 3.45Å; L138-R142 PolarHBondContact O-N 2.82Å; L138-L171 HydrophobicContact CD2-CD2 3.89Å |
| 139 | E | 59.2 | Low | 59.4 | Low | 26 Ų | 26 | 66.6 Ų | 66.6 | 12% | 0.121 | 35% | 0.354 | C | S | . | . | H | α-helix | trans | -68.4 | -38.6 | 178.7 | -164 | 77.2 | 144 | 0 | 0 | 111.7 | S96 Y100 M135 L141 R142 L143 | S96-E139 WeakPolarHBondContact CB-OE1 3.44Å; Y100-E139 HydrophobicContact CD2-CB 3.77Å; Y100-E139 HydrophobicContact CD2-CG 3.85Å; Y100-E139 HydrophobicContact CE2-CB 4.06Å; Y100-E139 HydrophobicContact CG-CB 4.36Å; Y100-E139 HydrophobicContact CG-CG 4.11Å; M135-E139 PolarHBondContact O-N 3.43Å; E139-L141 VanDerWaalsContact C-N 3.34Å; E139-L141 PolarHBondContact O-N 3.13Å; E139-R142 VanDerWaalsContact O-CB 3.3Å; E139-R142 WeakPolarHBondContact O-CB 3.41Å; E139-R142 PolarHBondContact O-N 3.46Å; E139-R142 WeakPolarHBondContact OE2-CD 3.48Å; E139-R142 IonicContact OE2-NH1 3.58Å; E139-L143 WeakPolarHBondContact O-CG 3.17Å; E139-L143 PolarHBondContact O-N 3.23Å |
| 140 | A | 58.7 | Low | 58.8 | Low | 58 Ų | 58 | 68.6 Ų | 68.6 | 48% | 0.479 | 37% | 0.366 | S | S | . | . | H | α-helix | trans | -61.7 | -40.4 | 171.9 | 0 | 0 | 0 | 0 | 0 | 112.1 | G136 I137 R142 L143 Y144 | G136-A140 WeakPolarHBondContact O-CB 3.44Å; G136-A140 PolarHBondContact O-N 2.9Å; I137-A140 PolarHBondContact O-N 3.39Å; A140-R142 VanDerWaalsContact C-N 3.34Å; A140-L143 PolarHBondContact O-N 3.19Å; A140-Y144 VanDerWaalsContact O-CB 3.25Å; A140-Y144 WeakPolarHBondContact O-CB 3.3Å; A140-Y144 PolarHBondContact O-N 3.36Å |
| 141 | L | 58.8 | Low | 58.1 | Low | 85 Ų | 85 | 72.2 Ų | 72.2 | 45% | 0.445 | 38% | 0.376 | S | S | . | . | H | α-helix | trans | -65.8 | -37.3 | 174.3 | -175.2 | 61.8 | 0 | 0 | 0 | 111.3 | I137 L138 E139 Y144 L145 | I137-L141 VanDerWaalsContact O-CB 3.3Å; I137-L141 WeakPolarHBondContact O-CB 3.46Å; I137-L141 PolarHBondContact O-N 3.17Å; L138-L141 PolarHBondContact O-N 2.96Å; E139-L141 VanDerWaalsContact C-N 3.34Å; E139-L141 PolarHBondContact O-N 3.13Å; L141-Y144 PolarHBondContact O-N 3.37Å; L141-L145 HydrophobicContact CD1-CD1 4.18Å; L141-L145 HydrophobicContact CD1-CG 4.32Å; L141-L145 HydrophobicContact CG-CD1 3.9Å; L141-L145 HydrophobicContact CG-CG 4.46Å; L141-L145 WeakPolarHBondContact O-CB 3.3Å; L141-L145 WeakPolarHBondContact O-CD1 3.31Å; L141-L145 WeakPolarHBondContact O-CG 3.4Å; L141-L145 PolarHBondContact O-N 3.32Å |
| 142 | R | 66.2 | Low | 57.3 | Low | 92 Ų | 92 | 72.5 Ų | 72.5 | 35% | 0.347 | 38% | 0.379 | S | S | . | . | H | α-helix | trans | -62.3 | -46.5 | 174.9 | -157 | 179 | -153.5 | -168.5 | 6.1 | 112.1 | F93 L138 E139 A140 L145 G146 L164 | F93-R142 HydrophobicContact CE1-CG 4.47Å; L138-R142 WeakPolarHBondContact O-CB 3.45Å; L138-R142 PolarHBondContact O-N 2.82Å; E139-R142 VanDerWaalsContact O-CB 3.3Å; E139-R142 WeakPolarHBondContact O-CB 3.41Å; E139-R142 PolarHBondContact O-N 3.46Å; E139-R142 WeakPolarHBondContact OE2-CD 3.48Å; E139-R142 IonicContact OE2-NH1 3.58Å; A140-R142 VanDerWaalsContact C-N 3.34Å; R142-L145 PolarHBondContact O-N 3.18Å; R142-G146 PolarHBondContact O-N 3.35Å; R142-L164 HydrophobicContact CB-CD2 3.9Å; R142-L164 HydrophobicContact CG-CD1 3.84Å; R142-L164 HydrophobicContact CG-CD2 3.77Å; R142-L164 HydrophobicContact CG-CG 4.5Å |
| 143 | L | 62.2 | Low | 56.5 | Low | 65 Ų | 65 | 77.5 Ų | 77.5 | 34% | 0.34 | 40% | 0.403 | S | S | . | . | H | α-helix | trans | -66.8 | -39.1 | 175.5 | -68.5 | 168.4 | 0 | 0 | 0 | 112.1 | F93 E139 A140 G146 T147 | F93-L143 HydrophobicContact CB-CD2 3.83Å; F93-L143 HydrophobicContact CD1-CD2 3.88Å; F93-L143 HydrophobicContact CG-CD2 4.07Å; E139-L143 WeakPolarHBondContact O-CG 3.17Å; E139-L143 PolarHBondContact O-N 3.23Å; A140-L143 PolarHBondContact O-N 3.19Å; L143-G146 PolarHBondContact O-N 3.05Å; L143-T147 WeakPolarHBondContact O-CG2 3.43Å; L143-T147 PolarHBondContact O-N 3.44Å; L143-T147 PolarHBondContact O-OG1 3.48Å |
| 144 | Y | 58.4 | Low | 56.1 | Low | 133 Ų | 133 | 74.4 Ų | 74.4 | 52% | 0.522 | 41% | 0.405 | S | S | . | . | H | α-helix | trans | -63.9 | -44.6 | 174.4 | -175.5 | -97.8 | 0 | 0 | 0 | 111.6 | A140 L141 T147 R148 | A140-Y144 VanDerWaalsContact O-CB 3.25Å; A140-Y144 WeakPolarHBondContact O-CB 3.3Å; A140-Y144 PolarHBondContact O-N 3.36Å; L141-Y144 PolarHBondContact O-N 3.37Å; Y144-T147 PolarHBondContact O-OG1 2.87Å; Y144-R148 HydrophobicContact CD1-CG 4.2Å; Y144-R148 HydrophobicContact CE1-CG 3.92Å; Y144-R148 HydrophobicContact CE2-CG 4.26Å; Y144-R148 HydrophobicContact CG-CG 4.47Å; Y144-R148 VanDerWaalsContact O-CB 3.31Å; Y144-R148 WeakPolarHBondContact O-CB 3.37Å; Y144-R148 WeakPolarHBondContact O-CG 3.21Å; Y144-R148 PolarHBondContact O-N 3.36Å |
| 145 | L | 56 | Low | 55.4 | Low | 50 Ų | 50 | 78.9 Ų | 78.9 | 26% | 0.262 | 42% | 0.424 | S | S | . | . | H | α-helix | trans | -67.7 | -38 | 176.4 | -69.8 | 165.9 | 0 | 0 | 0 | 111.7 | L141 R142 R148 G149 A160 L164 | L141-L145 HydrophobicContact CD1-CD1 4.18Å; L141-L145 HydrophobicContact CD1-CG 4.32Å; L141-L145 HydrophobicContact CG-CD1 3.9Å; L141-L145 HydrophobicContact CG-CG 4.46Å; L141-L145 WeakPolarHBondContact O-CB 3.3Å; L141-L145 WeakPolarHBondContact O-CD1 3.31Å; L141-L145 WeakPolarHBondContact O-CG 3.4Å; L141-L145 PolarHBondContact O-N 3.32Å; R142-L145 PolarHBondContact O-N 3.18Å; L145-R148 PolarHBondContact O-N 2.91Å; L145-G149 PolarHBondContact O-N 3.37Å; L145-A160 HydrophobicContact CB-CB 4.01Å; L145-A160 HydrophobicContact CD1-CB 3.94Å; L145-A160 HydrophobicContact CD2-CB 3.95Å; L145-A160 HydrophobicContact CG-CB 4.17Å; L145-L164 HydrophobicContact CD1-CD1 4.44Å |
| 146 | G | 56.1 | Low | 54.5 | Low | 23 Ų | 23 | 83.6 Ų | 83.6 | 24% | 0.237 | 44% | 0.438 | C | S | . | . | H | α-helix | trans | -60.6 | -47.5 | 174.1 | 0 | 0 | 0 | 0 | 0 | 113 | R142 L143 | R142-G146 PolarHBondContact O-N 3.35Å; L143-G146 PolarHBondContact O-N 3.05Å |
| 147 | T | 53.8 | Low | 53.8 | Low | 97 Ų | 97 | 85.9 Ų | 85.9 | 60% | 0.595 | 45% | 0.449 | S | S | * | . | H | α-helix | trans | -68.7 | -32.4 | 177.4 | 50.9 | 0 | 0 | 0 | 0 | 113.2 | L143 Y144 | L143-T147 WeakPolarHBondContact O-CG2 3.43Å; L143-T147 PolarHBondContact O-N 3.44Å; L143-T147 PolarHBondContact O-OG1 3.48Å; Y144-T147 PolarHBondContact O-OG1 2.87Å |
| 148 | R | 51.6 | Low | 53.4 | Low | 126 Ų | 126 | 87.5 Ų | 87.5 | 48% | 0.475 | 46% | 0.457 | S | S | . | . | H | α-helix | trans | -81.3 | -28 | 177.7 | -63.4 | -73.7 | -78.2 | 172.4 | -4.6 | 113.3 | Y144 L145 N150 L151 T152 | Y144-R148 HydrophobicContact CD1-CG 4.2Å; Y144-R148 HydrophobicContact CE1-CG 3.92Å; Y144-R148 HydrophobicContact CE2-CG 4.26Å; Y144-R148 HydrophobicContact CG-CG 4.47Å; Y144-R148 VanDerWaalsContact O-CB 3.31Å; Y144-R148 WeakPolarHBondContact O-CB 3.37Å; Y144-R148 WeakPolarHBondContact O-CG 3.21Å; Y144-R148 PolarHBondContact O-N 3.36Å; L145-R148 PolarHBondContact O-N 2.91Å; R148-N150 VanDerWaalsContact C-N 3.32Å; R148-N150 PolarHBondContact O-N 2.87Å; R148-L151 PolarHBondContact O-N 3.03Å; R148-T152 PolarHBondContact O-OG1 2.85Å |
| 149 | G | 54 | Low | 52.9 | Low | 23 Ų | 23 | 88.7 Ų | 88.7 | 24% | 0.237 | 47% | 0.473 | C | S | . | . | H | α-helix | trans | -63.2 | -35.5 | 176.8 | 0 | 0 | 0 | 0 | 0 | 113.2 | L145 L151 T152 | L145-G149 PolarHBondContact O-N 3.37Å; G149-L151 PolarHBondContact O-N 2.92Å; G149-L151 VanDerWaalsContact O-N 3.13Å; G149-T152 PolarHBondContact O-N 3.39Å |
| 150 | N | 51.2 | Low | 52.5 | Low | 136 Ų | 136 | 88 Ų | 88 | 73% | 0.727 | 47% | 0.471 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -59.5 | -24.1 | 177.8 | -171.2 | 64.3 | 0 | 0 | 0 | 114.1 | R148 | R148-N150 VanDerWaalsContact C-N 3.32Å; R148-N150 PolarHBondContact O-N 2.87Å |
| 151 | L | 49.2 | Very low | 52 | Low | 135 Ų | 135 | 88.1 Ų | 88.1 | 71% | 0.707 | 47% | 0.469 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -99.6 | -3.4 | -178.4 | -78 | 164.5 | 0 | 0 | 0 | 114.2 | R148 G149 | R148-L151 PolarHBondContact O-N 3.03Å; G149-L151 PolarHBondContact O-N 2.92Å; G149-L151 VanDerWaalsContact O-N 3.13Å |
| 152 | T | 43.9 | Very low | 51.6 | Low | 39 Ų | 39 | 90 Ų | 90 | 24% | 0.239 | 48% | 0.478 | C | S | . | . | S | Bend | trans | -133.5 | 86.8 | -175.2 | 45.3 | 0 | 0 | 0 | 0 | 111.4 | R148 G149 A154 | R148-T152 PolarHBondContact O-OG1 2.85Å; G149-T152 PolarHBondContact O-N 3.39Å; T152-A154 PolarHBondContact O-N 2.9Å |
| 153 | E | 48.4 | Very low | 50.9 | Low | 114 Ų | 114 | 88.3 Ų | 88.3 | 53% | 0.533 | 48% | 0.484 | S | S | . | . | trans | -57 | 129.1 | 178.2 | -56.3 | -158.1 | 106.9 | 0 | 0 | 112.2 | R78 | R78-E153 IonicContact CZ-OE1 2.72Å; R78-E153 IonicContact CZ-OE2 3.49Å; R78-E153 IonicContact NH1-OE1 3.54Å; R78-E153 PolarHBondContact NH1-OE1 3.19Å; R78-E153 IonicContact NH1-OE2 3.08Å; R78-E153 PolarHBondContact NH1-OE2 2.95Å; R78-E153 IonicContact NH2-OE1 2.76Å; R78-E153 PolarHBondContact NH2-OE1 2.89Å; R78-E153 IonicContact NH2-OE2 2.77Å; R78-E153 PolarHBondContact NH2-OE2 3.2Å | ||
| 154 | A | 53.7 | Low | 50.6 | Low | 84 Ų | 84 | 87 Ų | 87 | 69% | 0.694 | 48% | 0.478 | S | S | * | . | S | Bend | trans | 95.4 | -34.3 | 158.4 | 0 | 0 | 0 | 0 | 0 | 121.2 | T152 | T152-A154 PolarHBondContact O-N 2.9Š|
| 155 | E | 46.1 | Very low | 50.2 | Low | 164 Ų | 164 | 83.3 Ų | 83.3 | 77% | 0.766 | 47% | 0.469 | S | S | * | . | S | Bend | trans | -119.4 | -37.7 | -172.8 | -66 | -176 | 160.8 | 0 | 0 | 115.5 | P157 L158 | E155-P157 VanDerWaalsContact C-CD 3.48Å; E155-L158 PolarHBondContact O-N 3.18Å |
| 156 | R | 39.9 | Very low | 50 | Low | 161 Ų | 161 | 83.4 Ų | 83.4 | 61% | 0.608 | 48% | 0.477 | S | S | * | . | H | α-helix | trans | -68.3 | -31.8 | -175.1 | -61.4 | -168.3 | 178.3 | 174.6 | -1.4 | 116.5 | L158 A160 | R156-L158 PolarHBondContact O-N 3Å; R156-A160 VanDerWaalsContact O-CB 3.3Å; R156-A160 WeakPolarHBondContact O-CB 3.45Å; R156-A160 PolarHBondContact O-N 3.45Å |
| 157 | P | 46.4 | Very low | 49.9 | Very low | 70 Ų | 70 | 83.4 Ų | 83.4 | 46% | 0.455 | 48% | 0.477 | S | S | . | . | H | α-helix | trans | -69 | -22.9 | 177.9 | 27.2 | -33.8 | 0 | 0 | 0 | 113 | E155 A160 S161 | E155-P157 VanDerWaalsContact C-CD 3.48Å; P157-A160 WeakPolarHBondContact O-CB 3.3Å; P157-A160 PolarHBondContact O-N 3.33Å; P157-S161 PolarHBondContact O-N 2.84Å; P157-S161 PolarHBondContact O-OG 2.89Å |
| 158 | L | 47.4 | Very low | 49.9 | Very low | 119 Ų | 119 | 81.9 Ų | 81.9 | 62% | 0.623 | 47% | 0.467 | S | S | * | . | H | α-helix | trans | -79 | -42.6 | -178.7 | -154.3 | 161.9 | 0 | 0 | 0 | 111.2 | E155 R156 A160 S161 L162 | E155-L158 PolarHBondContact O-N 3.18Å; R156-L158 PolarHBondContact O-N 3Å; L158-A160 VanDerWaalsContact C-N 3.29Å; L158-A160 PolarHBondContact O-N 2.81Å; L158-S161 PolarHBondContact O-N 3.39Å; L158-S161 PolarHBondContact O-OG 3.43Å; L158-L162 WeakPolarHBondContact O-CB 3.2Å; L158-L162 PolarHBondContact O-N 3.48Å |
| 159 | A | 50 | Low | 49.8 | Very low | 62 Ų | 62 | 78.5 Ų | 78.5 | 51% | 0.512 | 47% | 0.467 | S | S | . | . | H | α-helix | trans | -64.7 | -34.2 | 168.3 | 0 | 0 | 0 | 0 | 0 | 112 | L162 A163 | A159-L162 PolarHBondContact O-N 2.8Å; A159-A163 WeakPolarHBondContact O-CB 3.48Å; A159-A163 PolarHBondContact O-N 3.02Å |
| 160 | A | 51.3 | Low | 49.7 | Very low | 11 Ų | 11 | 83.7 Ų | 83.7 | 9% | 0.091 | 49% | 0.488 | C | S | . | . | H | α-helix | trans | -64.9 | -45.7 | 175.6 | 0 | 0 | 0 | 0 | 0 | 112.6 | L145 R156 P157 L158 A163 L164 | L145-A160 HydrophobicContact CB-CB 4.01Å; L145-A160 HydrophobicContact CD1-CB 3.94Å; L145-A160 HydrophobicContact CD2-CB 3.95Å; L145-A160 HydrophobicContact CG-CB 4.17Å; R156-A160 VanDerWaalsContact O-CB 3.3Å; R156-A160 WeakPolarHBondContact O-CB 3.45Å; R156-A160 PolarHBondContact O-N 3.45Å; P157-A160 WeakPolarHBondContact O-CB 3.3Å; P157-A160 PolarHBondContact O-N 3.33Å; L158-A160 VanDerWaalsContact C-N 3.29Å; L158-A160 PolarHBondContact O-N 2.81Å; A160-A163 PolarHBondContact O-N 2.89Å; A160-L164 WeakPolarHBondContact O-CB 3.07Å; A160-L164 WeakPolarHBondContact O-CD1 3.19Å; A160-L164 WeakPolarHBondContact O-CG 3.31Å; A160-L164 PolarHBondContact O-N 3.4Å |
| 161 | S | 47.6 | Very low | 49.8 | Very low | 61 Ų | 61 | 78.3 Ų | 78.3 | 43% | 0.427 | 46% | 0.459 | S | S | . | . | H | α-helix | trans | -63.6 | -41.5 | 174.4 | 54.2 | 0 | 0 | 0 | 0 | 111.5 | P157 L158 A163 L164 T165 | P157-S161 PolarHBondContact O-N 2.84Å; P157-S161 PolarHBondContact O-OG 2.89Å; L158-S161 PolarHBondContact O-N 3.39Å; L158-S161 PolarHBondContact O-OG 3.43Å; S161-A163 PolarHBondContact O-N 3.29Å; S161-L164 PolarHBondContact O-N 2.98Å; S161-T165 PolarHBondContact O-N 2.87Å; S161-T165 PolarHBondContact O-OG1 3.18Å; S161-T165 VanDerWaalsContact O-OG1 3.07Å |
| 162 | L | 51.1 | Low | 49.7 | Very low | 124 Ų | 124 | 73.1 Ų | 73.1 | 65% | 0.649 | 44% | 0.435 | S | S | * | . | H | α-helix | trans | -61.3 | -43.7 | 177.3 | -159 | 82.5 | 0 | 0 | 0 | 112.2 | L158 A159 T165 A166 | L158-L162 WeakPolarHBondContact O-CB 3.2Å; L158-L162 PolarHBondContact O-N 3.48Å; A159-L162 PolarHBondContact O-N 2.8Å; L162-T165 PolarHBondContact O-N 2.92Å; L162-A166 WeakPolarHBondContact O-CB 3.43Å; L162-A166 PolarHBondContact O-N 2.84Å |
| 163 | A | 51.4 | Low | 50 | Low | 57 Ų | 57 | 73.6 Ų | 73.6 | 47% | 0.471 | 44% | 0.442 | S | S | . | . | H | α-helix | trans | -67.3 | -35.2 | 176.5 | 0 | 0 | 0 | 0 | 0 | 112.5 | A159 A160 S161 G167 | A159-A163 WeakPolarHBondContact O-CB 3.48Å; A159-A163 PolarHBondContact O-N 3.02Å; A160-A163 PolarHBondContact O-N 2.89Å; S161-A163 PolarHBondContact O-N 3.29Å; A163-G167 PolarHBondContact O-N 2.89Å |
| 164 | L | 54.3 | Low | 50.1 | Low | 38 Ų | 38 | 73.7 Ų | 73.7 | 20% | 0.199 | 44% | 0.439 | C | S | . | . | H | α-helix | trans | -66.2 | -47.7 | 172.7 | -81.6 | 158.9 | 0 | 0 | 0 | 111.4 | R142 L145 A160 S161 A166 G167 T168 | R142-L164 HydrophobicContact CB-CD2 3.9Å; R142-L164 HydrophobicContact CG-CD1 3.84Å; R142-L164 HydrophobicContact CG-CD2 3.77Å; R142-L164 HydrophobicContact CG-CG 4.5Å; L145-L164 HydrophobicContact CD1-CD1 4.44Å; A160-L164 WeakPolarHBondContact O-CB 3.07Å; A160-L164 WeakPolarHBondContact O-CD1 3.19Å; A160-L164 WeakPolarHBondContact O-CG 3.31Å; A160-L164 PolarHBondContact O-N 3.4Å; S161-L164 PolarHBondContact O-N 2.98Å; L164-A166 VanDerWaalsContact C-N 3.35Å; L164-A166 PolarHBondContact O-N 3.46Å; L164-G167 PolarHBondContact O-N 3Å; L164-T168 PolarHBondContact O-N 3Å; L164-T168 PolarHBondContact O-OG1 2.93Å |
| 165 | T | 51.8 | Low | 49.9 | Very low | 56 Ų | 56 | 72.3 Ų | 72.3 | 34% | 0.344 | 42% | 0.417 | S | S | . | . | H | α-helix | trans | -59.9 | -43.9 | 176.6 | -56.4 | 0 | 0 | 0 | 0 | 111.3 | S161 L162 T168 A169 | S161-T165 PolarHBondContact O-N 2.87Å; S161-T165 PolarHBondContact O-OG1 3.18Å; S161-T165 VanDerWaalsContact O-OG1 3.07Å; L162-T165 PolarHBondContact O-N 2.92Å; T165-T168 WeakPolarHBondContact CA-OG1 3.3Å; T165-T168 PolarHBondContact O-N 3.45Å; T165-T168 PolarHBondContact O-OG1 2.97Å; T165-A169 VanDerWaalsContact O-CB 3.25Å; T165-A169 WeakPolarHBondContact O-CB 3.41Å; T165-A169 PolarHBondContact O-N 3.45Å |
| 166 | A | 51.1 | Low | 50 | Low | 51 Ų | 51 | 69.2 Ų | 69.2 | 42% | 0.421 | 41% | 0.405 | S | S | . | . | H | α-helix | trans | -63.8 | -41.6 | 174.7 | 0 | 0 | 0 | 0 | 0 | 112.5 | L162 L164 A169 L170 | L162-A166 WeakPolarHBondContact O-CB 3.43Å; L162-A166 PolarHBondContact O-N 2.84Å; L164-A166 VanDerWaalsContact C-N 3.35Å; L164-A166 PolarHBondContact O-N 3.46Å; A166-A169 PolarHBondContact O-N 2.82Å; A166-L170 WeakPolarHBondContact O-CB 3.3Å; A166-L170 WeakPolarHBondContact O-CG 3.33Å; A166-L170 PolarHBondContact O-N 2.97Å |
| 167 | G | 52.8 | Low | 50.5 | Low | 23 Ų | 23 | 68.6 Ų | 68.6 | 24% | 0.237 | 41% | 0.413 | C | S | . | . | H | α-helix | trans | -64.1 | -44 | 176.4 | 0 | 0 | 0 | 0 | 0 | 112.9 | A163 L164 L171 | A163-G167 PolarHBondContact O-N 2.89Å; L164-G167 PolarHBondContact O-N 3Å; G167-L171 VanDerWaalsContact O-CB 3.3Å; G167-L171 WeakPolarHBondContact O-CB 3.21Å; G167-L171 PolarHBondContact O-N 2.98Å |
| 168 | T | 54.1 | Low | 50.2 | Low | 65 Ų | 65 | 72.5 Ų | 72.5 | 40% | 0.399 | 42% | 0.419 | S | S | . | . | H | α-helix | trans | -67.7 | -36.4 | 175 | 49.7 | 0 | 0 | 0 | 0 | 112.3 | L164 T165 S172 | L164-T168 PolarHBondContact O-N 3Å; L164-T168 PolarHBondContact O-OG1 2.93Å; T165-T168 WeakPolarHBondContact CA-OG1 3.3Å; T165-T168 PolarHBondContact O-N 3.45Å; T165-T168 PolarHBondContact O-OG1 2.97Å; T168-S172 WeakPolarHBondContact O-CB 3.5Å; T168-S172 PolarHBondContact O-N 2.84Å |
| 169 | A | 50.4 | Low | 49.9 | Very low | 56 Ų | 56 | 69.5 Ų | 69.5 | 46% | 0.463 | 40% | 0.401 | S | S | . | . | H | α-helix | trans | -68.4 | -44.3 | 177.1 | 0 | 0 | 0 | 0 | 0 | 112.2 | T165 A166 S172 A173 | T165-A169 VanDerWaalsContact O-CB 3.25Å; T165-A169 WeakPolarHBondContact O-CB 3.41Å; T165-A169 PolarHBondContact O-N 3.45Å; A166-A169 PolarHBondContact O-N 2.82Å; A169-S172 PolarHBondContact O-N 3.35Å; A169-A173 WeakPolarHBondContact O-CB 3.28Å; A169-A173 PolarHBondContact O-N 3.31Å |
| 170 | L | 51.6 | Low | 49.5 | Very low | 131 Ų | 131 | 71.8 Ų | 71.8 | 69% | 0.686 | 41% | 0.409 | S | S | * | . | H | α-helix | trans | -62.3 | -43.4 | 174.8 | -81.5 | 163.1 | 0 | 0 | 0 | 111.9 | A166 A173 Y174 | A166-L170 WeakPolarHBondContact O-CB 3.3Å; A166-L170 WeakPolarHBondContact O-CG 3.33Å; A166-L170 PolarHBondContact O-N 2.97Å; L170-A173 PolarHBondContact O-N 2.81Å; L170-Y174 WeakPolarHBondContact O-CB 3.27Å; L170-Y174 PolarHBondContact O-N 2.97Å |
| 171 | L | 53.6 | Low | 49.1 | Very low | 23 Ų | 23 | 78.8 Ų | 78.8 | 12% | 0.12 | 44% | 0.444 | C | S | . | . | H | α-helix | trans | -64.6 | -44.3 | 176.6 | -170.2 | 62.7 | 0 | 0 | 0 | 111 | L134 M135 L138 G167 Y174 F175 | L134-L171 HydrophobicContact CD2-CD1 3.55Å; L134-L171 HydrophobicContact CG-CD1 4.08Å; M135-L171 HydrophobicContact CG-CD2 4.39Å; L138-L171 HydrophobicContact CD2-CD2 3.89Å; G167-L171 VanDerWaalsContact O-CB 3.3Å; G167-L171 WeakPolarHBondContact O-CB 3.21Å; G167-L171 PolarHBondContact O-N 2.98Å; L171-Y174 PolarHBondContact O-N 3.38Å; L171-F175 HydrophobicContact CD1-CD2 4.45Å; L171-F175 HydrophobicContact CD1-CE2 4.39Å; L171-F175 HydrophobicContact CG-CD2 4.1Å; L171-F175 HydrophobicContact CG-CE2 4.11Å; L171-F175 VanDerWaalsContact O-CD2 3.3Å; L171-F175 WeakPolarHBondContact O-CD2 3.21Å; L171-F175 PolarHBondContact O-N 3.36Å |
| 172 | S | 47.6 | Very low | 49 | Very low | 27 Ų | 27 | 81.7 Ų | 81.7 | 19% | 0.189 | 46% | 0.459 | C | S | . | . | H | α-helix | trans | -65.2 | -37.6 | 177.8 | -175.4 | 0 | 0 | 0 | 0 | 112.9 | T168 A169 F175 L176 | T168-S172 WeakPolarHBondContact O-CB 3.5Å; T168-S172 PolarHBondContact O-N 2.84Å; A169-S172 PolarHBondContact O-N 3.35Å; S172-F175 WeakPolarHBondContact O-CB 3.18Å; S172-F175 PolarHBondContact O-N 2.77Å; S172-L176 WeakPolarHBondContact O-CD1 3.25Å; S172-L176 PolarHBondContact O-N 2.98Å |
| 173 | A | 49.7 | Very low | 49.1 | Very low | 48 Ų | 48 | 81.9 Ų | 81.9 | 40% | 0.397 | 46% | 0.46 | S | S | . | . | H | α-helix | trans | -66.4 | -42.4 | 174.6 | 0 | 0 | 0 | 0 | 0 | 112.1 | A169 L170 F175 L176 L177 | A169-A173 WeakPolarHBondContact O-CB 3.28Å; A169-A173 PolarHBondContact O-N 3.31Å; L170-A173 PolarHBondContact O-N 2.81Å; A173-F175 VanDerWaalsContact C-N 3.3Å; A173-F175 PolarHBondContact O-N 3.27Å; A173-L176 PolarHBondContact O-N 2.94Å; A173-L177 WeakPolarHBondContact O-CD1 3.24Å; A173-L177 WeakPolarHBondContact O-CG 3.41Å; A173-L177 PolarHBondContact O-N 2.79Å |
| 174 | Y | 49.8 | Very low | 48.8 | Very low | 117 Ų | 117 | 90.6 Ų | 90.6 | 46% | 0.459 | 48% | 0.481 | S | S | . | . | H | α-helix | trans | -60 | -40.2 | 173.8 | -178.8 | -99.8 | 0 | 0 | 0 | 111.8 | L170 L171 | L170-Y174 WeakPolarHBondContact O-CB 3.27Å; L170-Y174 PolarHBondContact O-N 2.97Å; L171-Y174 PolarHBondContact O-N 3.38Å |
| 175 | F | 49.6 | Very low | 48.4 | Very low | 55 Ų | 55 | 90.9 Ų | 90.9 | 24% | 0.241 | 49% | 0.489 | C | S | . | . | H | α-helix | trans | -63.7 | -51.6 | 172.6 | -95 | -72.5 | 0 | 0 | 0 | 113.2 | L131 L171 S172 A173 L177 W178 Q179 | L131-F175 HydrophobicContact CD1-CD2 4.36Å; L131-F175 HydrophobicContact CD1-CE1 4.04Å; L131-F175 HydrophobicContact CD1-CE2 3.65Å; L131-F175 HydrophobicContact CD1-CZ 3.49Å; L131-F175 VanDerWaalsContact CD1-CZ 3.49Å; L131-F175 HydrophobicContact CD2-CE1 3.54Å; L131-F175 HydrophobicContact CD2-CE2 4.49Å; L131-F175 HydrophobicContact CD2-CZ 3.5Å; L131-F175 HydrophobicContact CG-CE1 4.15Å; L131-F175 HydrophobicContact CG-CE2 4.22Å; L131-F175 HydrophobicContact CG-CZ 3.62Å; L171-F175 HydrophobicContact CD1-CD2 4.45Å; L171-F175 HydrophobicContact CD1-CE2 4.39Å; L171-F175 HydrophobicContact CG-CD2 4.1Å; L171-F175 HydrophobicContact CG-CE2 4.11Å; L171-F175 VanDerWaalsContact O-CD2 3.3Å; L171-F175 WeakPolarHBondContact O-CD2 3.21Å; L171-F175 PolarHBondContact O-N 3.36Å; S172-F175 WeakPolarHBondContact O-CB 3.18Å; S172-F175 PolarHBondContact O-N 2.77Å; A173-F175 VanDerWaalsContact C-N 3.3Å; A173-F175 PolarHBondContact O-N 3.27Å; F175-L177 PolarHBondContact O-N 3.37Å; F175-W178 PolarHBondContact O-N 3.23Å; F175-Q179 WeakPolarHBondContact O-CB 3.39Å; F175-Q179 PolarHBondContact O-N 2.97Å |
| 176 | L | 49 | Very low | 47.8 | Very low | 98 Ų | 98 | 92 Ų | 92 | 51% | 0.513 | 49% | 0.493 | S | S | . | . | H | α-helix | trans | -57.1 | -37.4 | -178.3 | -103.7 | 69.9 | 0 | 0 | 0 | 112.6 | S172 A173 W178 T180 | S172-L176 WeakPolarHBondContact O-CD1 3.25Å; S172-L176 PolarHBondContact O-N 2.98Å; A173-L176 PolarHBondContact O-N 2.94Å; L176-W178 PolarHBondContact O-N 2.76Å; L176-T180 WeakPolarHBondContact O-CG2 3.47Å; L176-T180 PolarHBondContact O-OG1 2.84Å |
| 177 | L | 49.3 | Very low | 47.2 | Very low | 148 Ų | 148 | 99.4 Ų | 99.4 | 78% | 0.775 | 51% | 0.51 | S | S | * | . | H | α-helix | trans | -72 | -13 | 178.6 | -73.8 | 163.4 | 0 | 0 | 0 | 114 | A173 F175 | A173-L177 WeakPolarHBondContact O-CD1 3.24Å; A173-L177 WeakPolarHBondContact O-CG 3.41Å; A173-L177 PolarHBondContact O-N 2.79Å; F175-L177 PolarHBondContact O-N 3.37Å |
| 178 | W | 41.7 | Very low | 47.3 | Very low | 152 Ų | 152 | 100.8 Ų | 100.8 | 58% | 0.576 | 52% | 0.519 | S | S | * | . | H | α-helix | trans | -119.9 | -22.6 | -176.6 | -153.4 | -77.8 | 0 | 0 | 0 | 113.7 | L127 F175 L176 | L127-W178 HydrophobicContact CD1-CZ2 4.14Å; F175-W178 PolarHBondContact O-N 3.23Å; L176-W178 PolarHBondContact O-N 2.76Å |
| 179 | Q | 40.2 | Very low | 47.3 | Very low | 56 Ų | 56 | 101 Ų | 101 | 26% | 0.262 | 52% | 0.517 | S | S | . | . | H | α-helix | trans | -101.4 | -8.5 | -168.9 | -166.6 | 168.6 | -2.7 | 0 | 0 | 115 | F175 L181 | F175-Q179 WeakPolarHBondContact O-CB 3.39Å; F175-Q179 PolarHBondContact O-N 2.97Å; Q179-L181 PolarHBondContact O-N 3.16Å |
| 180 | T | 41 | Very low | 47.3 | Very low | 111 Ų | 111 | 101.3 Ų | 101.3 | 68% | 0.681 | 52% | 0.516 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -64 | 14.4 | 178.3 | 34 | 0 | 0 | 0 | 0 | 115.6 | L176 | L176-T180 WeakPolarHBondContact O-CG2 3.47Å; L176-T180 PolarHBondContact O-OG1 2.84Å |
| 181 | L | 42.7 | Very low | 47.2 | Very low | 157 Ų | 157 | 97.3 Ų | 97.3 | 82% | 0.822 | 50% | 0.502 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -114.4 | -5 | -175.9 | -82.5 | 165 | 0 | 0 | 0 | 115.6 | Q179 | Q179-L181 PolarHBondContact O-N 3.16Š|
| 182 | V | 45.5 | Very low | 47.5 | Very low | 122 Ų | 122 | 100.2 Ų | 100.2 | 74% | 0.739 | 52% | 0.521 | S | S | * | . | S | Bend | trans | -133 | -69.5 | -166.2 | -158.9 | 0 | 0 | 0 | 0 | 119.1 | ||
| 183 | L | 53.3 | Low | 47.6 | Very low | 128 Ų | 128 | 102.5 Ų | 102.5 | 67% | 0.67 | 53% | 0.53 | S | S | * | . | trans | -144.9 | 154.8 | -149.7 | -146.5 | 65.9 | 0 | 0 | 0 | 118.2 | A185 D186 | L183-A185 PolarHBondContact O-N 3.31Å; L183-D186 PolarHBondContact O-N 2.9Å | ||
| 184 | W | 45 | Very low | 47.8 | Very low | 241 Ų | 241 | 106.5 Ų | 106.5 | 91% | 0.913 | 54% | 0.544 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -44.7 | -11.9 | 176.2 | -91.8 | 62 | 0 | 0 | 0 | 118.3 | D186 W187 | W184-D186 PolarHBondContact O-N 3.3Å; W184-W187 PolarHBondContact O-N 3.49Å |
| 185 | A | 47.3 | Very low | 48.1 | Very low | 44 Ų | 44 | 104 Ų | 104 | 36% | 0.364 | 55% | 0.549 | S | S | . | . | H | α-helix | trans | -61.6 | -21.8 | 178.1 | 0 | 0 | 0 | 0 | 0 | 113.3 | L183 W187 A188 L189 | L183-A185 PolarHBondContact O-N 3.31Å; A185-W187 PolarHBondContact O-N 3.07Å; A185-A188 PolarHBondContact O-N 2.9Å; A185-A188 VanDerWaalsContact O-N 3.11Å; A185-L189 PolarHBondContact O-N 3.41Å |
| 186 | D | 39 | Very low | 48.5 | Very low | 80 Ų | 80 | 105.2 Ų | 105.2 | 43% | 0.428 | 56% | 0.557 | S | S | . | * | H | α-helix | trans | -55.1 | -34 | 179.2 | -149.7 | 65.7 | 0 | 0 | 0 | 113.5 | L183 W184 S190 | L183-D186 PolarHBondContact O-N 2.9Å; W184-D186 PolarHBondContact O-N 3.3Å; D186-S190 WeakPolarHBondContact O-CB 3.45Å; D186-S190 PolarHBondContact O-N 2.89Å; D186-S190 PolarHBondContact O-OG 2.89Å |
| 187 | W | 38.7 | Very low | 48.7 | Very low | 206 Ų | 206 | 106.9 Ų | 106.9 | 78% | 0.78 | 56% | 0.562 | S | S | * | * | H | α-helix | trans | -70.6 | -42.4 | 176.8 | -175.9 | 81.9 | 0 | 0 | 0 | 112.6 | W184 A185 S190 A191 | W184-W187 PolarHBondContact O-N 3.49Å; A185-W187 PolarHBondContact O-N 3.07Å; W187-S190 PolarHBondContact O-N 3.18Å; W187-A191 WeakPolarHBondContact O-CB 3.3Å; W187-A191 PolarHBondContact O-N 3.02Å |
| 188 | A | 55.1 | Low | 49 | Very low | 51 Ų | 51 | 101.5 Ų | 101.5 | 42% | 0.421 | 54% | 0.542 | S | S | . | . | H | α-helix | trans | -69.4 | -35.5 | 178 | 0 | 0 | 0 | 0 | 0 | 111.9 | A185 T192 | A185-A188 PolarHBondContact O-N 2.9Å; A185-A188 VanDerWaalsContact O-N 3.11Å; A188-T192 WeakPolarHBondContact O-CB 3.34Å; A188-T192 PolarHBondContact O-N 3.03Å; A188-T192 PolarHBondContact O-OG1 2.88Å |
| 189 | L | 53 | Low | 49.7 | Very low | 70 Ų | 70 | 99.3 Ų | 99.3 | 37% | 0.366 | 54% | 0.541 | S | S | . | . | H | α-helix | trans | -62.3 | -49 | 170.9 | -85.3 | 160.3 | 0 | 0 | 0 | 111.5 | A185 A191 T192 L193 | A185-L189 PolarHBondContact O-N 3.41Å; L189-A191 PolarHBondContact O-N 3.41Å; L189-T192 PolarHBondContact O-N 2.99Å; L189-L193 WeakPolarHBondContact O-CB 3.33Å; L189-L193 WeakPolarHBondContact O-CG 3.25Å; L189-L193 PolarHBondContact O-N 3.43Å |
| 190 | S | 51.1 | Low | 50.4 | Low | 63 Ų | 63 | 99.8 Ų | 99.8 | 44% | 0.441 | 54% | 0.543 | S | S | . | . | H | α-helix | trans | -60.5 | -42.2 | 178 | -63 | 0 | 0 | 0 | 0 | 112.7 | D186 W187 L193 L194 | D186-S190 WeakPolarHBondContact O-CB 3.45Å; D186-S190 PolarHBondContact O-N 2.89Å; D186-S190 PolarHBondContact O-OG 2.89Å; W187-S190 PolarHBondContact O-N 3.18Å; S190-L193 PolarHBondContact O-N 2.96Å; S190-L194 WeakPolarHBondContact O-CB 3.48Å; S190-L194 PolarHBondContact O-N 3.29Å |
| 191 | A | 49.5 | Very low | 51.1 | Low | 47 Ų | 47 | 96.7 Ų | 96.7 | 39% | 0.388 | 53% | 0.529 | S | S | . | . | H | α-helix | trans | -64.1 | -39.3 | 175.2 | 0 | 0 | 0 | 0 | 0 | 112.5 | W187 L189 L194 A195 | W187-A191 WeakPolarHBondContact O-CB 3.3Å; W187-A191 PolarHBondContact O-N 3.02Å; L189-A191 PolarHBondContact O-N 3.41Å; A191-L194 PolarHBondContact O-N 3.39Å; A191-A195 WeakPolarHBondContact O-CB 3.49Å; A191-A195 PolarHBondContact O-N 2.99Å |
| 192 | T | 59.1 | Low | 52.1 | Low | 84 Ų | 84 | 93.3 Ų | 93.3 | 52% | 0.515 | 52% | 0.515 | S | S | . | . | H | α-helix | trans | -70.3 | -41.1 | 178.8 | -54.4 | 0 | 0 | 0 | 0 | 111.6 | A188 L189 A195 L196 | A188-T192 WeakPolarHBondContact O-CB 3.34Å; A188-T192 PolarHBondContact O-N 3.03Å; A188-T192 PolarHBondContact O-OG1 2.88Å; L189-T192 PolarHBondContact O-N 2.99Å; T192-A195 PolarHBondContact O-N 3.45Å; T192-L196 HydrophobicContact CG2-CD1 4.38Å; T192-L196 WeakPolarHBondContact O-CG 3.44Å; T192-L196 PolarHBondContact O-N 3.29Å |
| 193 | L | 51 | Low | 52.9 | Low | 74 Ų | 74 | 93 Ų | 93 | 39% | 0.387 | 51% | 0.508 | S | S | . | . | H | α-helix | trans | -60.1 | -45.2 | 172.7 | -78.4 | 165 | 0 | 0 | 0 | 111.5 | L189 S190 A195 L196 H197 | L189-L193 WeakPolarHBondContact O-CB 3.33Å; L189-L193 WeakPolarHBondContact O-CG 3.25Å; L189-L193 PolarHBondContact O-N 3.43Å; S190-L193 PolarHBondContact O-N 2.96Å; L193-A195 PolarHBondContact O-N 3.5Å; L193-L196 PolarHBondContact O-N 2.89Å; L193-H197 PolarHBondContact O-N 3.01Å |
| 194 | L | 53 | Low | 53.2 | Low | 132 Ų | 132 | 92.1 Ų | 92.1 | 69% | 0.691 | 50% | 0.501 | S | S | * | . | H | α-helix | trans | -63.9 | -39.4 | 177.9 | -170.1 | 68.1 | 0 | 0 | 0 | 112.2 | S190 A191 H197 G198 | S190-L194 WeakPolarHBondContact O-CB 3.48Å; S190-L194 PolarHBondContact O-N 3.29Å; A191-L194 PolarHBondContact O-N 3.39Å; L194-H197 PolarHBondContact O-N 2.99Å; L194-G198 PolarHBondContact O-N 3.39Å |
| 195 | A | 56.3 | Low | 54.1 | Low | 66 Ų | 66 | 85.3 Ų | 85.3 | 55% | 0.545 | 49% | 0.486 | S | S | . | . | H | α-helix | trans | -64.8 | -39.2 | 175.1 | 0 | 0 | 0 | 0 | 0 | 112.5 | A191 T192 L193 G198 L199 | A191-A195 WeakPolarHBondContact O-CB 3.49Å; A191-A195 PolarHBondContact O-N 2.99Å; T192-A195 PolarHBondContact O-N 3.45Å; L193-A195 PolarHBondContact O-N 3.5Å; A195-G198 PolarHBondContact O-N 3.33Å; A195-L199 WeakPolarHBondContact O-CB 3.35Å; A195-L199 PolarHBondContact O-N 2.95Å |
| 196 | L | 57.8 | Low | 55 | Low | 79 Ų | 79 | 87.6 Ų | 87.6 | 41% | 0.414 | 50% | 0.495 | S | S | . | . | H | α-helix | trans | -67.3 | -44.9 | 175.1 | -71.5 | 168.5 | 0 | 0 | 0 | 111.9 | T192 L193 G198 L199 E200 | T192-L196 HydrophobicContact CG2-CD1 4.38Å; T192-L196 WeakPolarHBondContact O-CG 3.44Å; T192-L196 PolarHBondContact O-N 3.29Å; L193-L196 PolarHBondContact O-N 2.89Å; L196-G198 VanDerWaalsContact C-N 3.34Å; L196-G198 PolarHBondContact O-N 3.07Å; L196-L199 PolarHBondContact O-N 3.29Å; L196-E200 WeakPolarHBondContact O-CB 3.46Å; L196-E200 PolarHBondContact O-N 3.37Å |
| 197 | H | 52.3 | Low | 56.1 | Low | 133 Ų | 133 | 85.9 Ų | 85.9 | 62% | 0.616 | 49% | 0.492 | S | S | * | . | H | α-helix | trans | -62.4 | -38.9 | 173.8 | -107.6 | 35.2 | 0 | 0 | 0 | 112.5 | L193 L194 E200 A201 | L193-H197 PolarHBondContact O-N 3.01Å; L194-H197 PolarHBondContact O-N 2.99Å; H197-E200 IonicContact ND1-OE2 3.81Å; H197-E200 PolarHBondContact O-N 2.92Å; H197-A201 WeakPolarHBondContact O-CB 3.27Å; H197-A201 PolarHBondContact O-N 3.18Å |
| 198 | G | 56 | Low | 57.3 | Low | 36 Ų | 36 | 81.3 Ų | 81.3 | 37% | 0.371 | 48% | 0.482 | S | S | . | . | H | α-helix | trans | -62.7 | -43.2 | 174.4 | 0 | 0 | 0 | 0 | 0 | 112.3 | L194 A195 L196 A201 V202 | L194-G198 PolarHBondContact O-N 3.39Å; A195-G198 PolarHBondContact O-N 3.33Å; L196-G198 VanDerWaalsContact C-N 3.34Å; L196-G198 PolarHBondContact O-N 3.07Å; G198-A201 PolarHBondContact O-N 3.04Å; G198-V202 WeakPolarHBondContact O-CG2 3.16Å; G198-V202 PolarHBondContact O-N 3.49Å |
| 199 | L | 56.2 | Low | 57.8 | Low | 105 Ų | 105 | 81.4 Ų | 81.4 | 55% | 0.55 | 48% | 0.483 | S | S | . | . | H | α-helix | trans | -66.3 | -39.3 | 176.4 | -173.5 | 62.2 | 0 | 0 | 0 | 112 | A195 L196 V202 L203 | A195-L199 WeakPolarHBondContact O-CB 3.35Å; A195-L199 PolarHBondContact O-N 2.95Å; L196-L199 PolarHBondContact O-N 3.29Å; L199-V202 PolarHBondContact O-N 2.92Å; L199-L203 HydrophobicContact CG-CD1 4.26Å; L199-L203 WeakPolarHBondContact O-CB 3.25Å; L199-L203 VanDerWaalsContact O-CG 3.29Å; L199-L203 WeakPolarHBondContact O-CG 3.31Å; L199-L203 PolarHBondContact O-N 3.45Å |
| 200 | E | 54.9 | Low | 58.4 | Low | 66 Ų | 66 | 81.4 Ų | 81.4 | 31% | 0.308 | 49% | 0.493 | S | S | . | . | H | α-helix | trans | -60.9 | -47.7 | 173.6 | -178.8 | 170.5 | -171.3 | 0 | 0 | 111.7 | L196 H197 V202 L203 Q204 | L196-E200 WeakPolarHBondContact O-CB 3.46Å; L196-E200 PolarHBondContact O-N 3.37Å; H197-E200 IonicContact ND1-OE2 3.81Å; H197-E200 PolarHBondContact O-N 2.92Å; E200-V202 PolarHBondContact O-N 3.17Å; E200-L203 PolarHBondContact O-N 3.35Å; E200-Q204 WeakPolarHBondContact O-CG 3.47Å; E200-Q204 PolarHBondContact O-N 2.98Å |
| 201 | A | 56.5 | Low | 58.9 | Low | 46 Ų | 46 | 87.1 Ų | 87.1 | 38% | 0.38 | 51% | 0.51 | S | S | . | . | H | α-helix | trans | -61.7 | -42.4 | 176.9 | 0 | 0 | 0 | 0 | 0 | 112.5 | H197 G198 L203 Q204 V205 | H197-A201 WeakPolarHBondContact O-CB 3.27Å; H197-A201 PolarHBondContact O-N 3.18Å; G198-A201 PolarHBondContact O-N 3.04Å; A201-L203 VanDerWaalsContact C-N 3.35Å; A201-L203 PolarHBondContact O-N 3.29Å; A201-Q204 PolarHBondContact O-N 2.94Å; A201-V205 WeakPolarHBondContact O-CG2 3.46Å; A201-V205 PolarHBondContact O-N 2.87Å |
| 202 | V | 63.2 | Low | 59.4 | Low | 87 Ų | 87 | 90.3 Ų | 90.3 | 53% | 0.527 | 53% | 0.525 | S | S | . | . | H | α-helix | trans | -62.2 | -42.3 | 175.8 | 169.6 | 0 | 0 | 0 | 0 | 111.2 | G198 L199 E200 V205 V206 | G198-V202 WeakPolarHBondContact O-CG2 3.16Å; G198-V202 PolarHBondContact O-N 3.49Å; L199-V202 PolarHBondContact O-N 2.92Å; E200-V202 PolarHBondContact O-N 3.17Å; V202-V205 PolarHBondContact O-N 2.92Å; V202-V206 HydrophobicContact CG1-CG2 4.39Å; V202-V206 WeakPolarHBondContact O-CB 3.19Å; V202-V206 VanDerWaalsContact O-CG2 3.3Å; V202-V206 WeakPolarHBondContact O-CG2 3.46Å; V202-V206 PolarHBondContact O-N 3.45Å |
| 203 | L | 62.4 | Low | 58.7 | Low | 114 Ų | 114 | 99.9 Ų | 99.9 | 60% | 0.597 | 55% | 0.551 | S | S | * | * | H | α-helix | trans | -64.4 | -39.9 | 176.8 | -73.7 | 165.6 | 0 | 0 | 0 | 112.1 | L199 E200 A201 A207 | L199-L203 HydrophobicContact CG-CD1 4.26Å; L199-L203 WeakPolarHBondContact O-CB 3.25Å; L199-L203 VanDerWaalsContact O-CG 3.29Å; L199-L203 WeakPolarHBondContact O-CG 3.31Å; L199-L203 PolarHBondContact O-N 3.45Å; E200-L203 PolarHBondContact O-N 3.35Å; A201-L203 VanDerWaalsContact C-N 3.35Å; A201-L203 PolarHBondContact O-N 3.29Å; L203-A207 WeakPolarHBondContact O-CB 3.35Å; L203-A207 PolarHBondContact O-N 3.29Å |
| 204 | Q | 60.2 | Low | 59.1 | Low | 111 Ų | 111 | 101.2 Ų | 101.2 | 52% | 0.519 | 56% | 0.559 | S | S | . | * | H | α-helix | trans | -63.4 | -46 | 174.4 | -70.3 | 175.1 | 8.1 | 0 | 0 | 111.8 | E200 A201 A207 I208 | E200-Q204 WeakPolarHBondContact O-CG 3.47Å; E200-Q204 PolarHBondContact O-N 2.98Å; A201-Q204 PolarHBondContact O-N 2.94Å; Q204-A207 PolarHBondContact O-N 3.34Å; Q204-I208 VanDerWaalsContact O-CG1 3.32Å; Q204-I208 WeakPolarHBondContact O-CG1 3.46Å; Q204-I208 PolarHBondContact O-N 2.88Å |
| 205 | V | 64.3 | Low | 59.4 | Low | 98 Ų | 98 | 99.5 Ų | 99.5 | 59% | 0.594 | 55% | 0.552 | S | S | * | * | H | α-helix | trans | -62.8 | -44.7 | 177.9 | 170.6 | 0 | 0 | 0 | 0 | 111.6 | A201 V202 A207 I208 A209 | A201-V205 WeakPolarHBondContact O-CG2 3.46Å; A201-V205 PolarHBondContact O-N 2.87Å; V202-V205 PolarHBondContact O-N 2.92Å; V205-A207 VanDerWaalsContact C-N 3.34Å; V205-A207 PolarHBondContact O-N 3.37Å; V205-I208 PolarHBondContact O-N 2.98Å; V205-A209 VanDerWaalsContact O-CB 3.31Å; V205-A209 WeakPolarHBondContact O-CB 3.36Å; V205-A209 PolarHBondContact O-N 2.68Å |
| 206 | V | 65.4 | Low | 59.6 | Low | 91 Ų | 91 | 101.4 Ų | 101.4 | 55% | 0.552 | 55% | 0.553 | S | S | * | * | H | α-helix | trans | -64.7 | -38.8 | 177.6 | 170.7 | 0 | 0 | 0 | 0 | 111.4 | V202 A210 | V202-V206 HydrophobicContact CG1-CG2 4.39Å; V202-V206 WeakPolarHBondContact O-CB 3.19Å; V202-V206 VanDerWaalsContact O-CG2 3.3Å; V202-V206 WeakPolarHBondContact O-CG2 3.46Å; V202-V206 PolarHBondContact O-N 3.45Å; V206-A210 VanDerWaalsContact O-CB 3.28Å; V206-A210 WeakPolarHBondContact O-CB 3.35Å; V206-A210 PolarHBondContact O-N 3.18Å |
| 207 | A | 61.6 | Low | 59.7 | Low | 45 Ų | 45 | 102.7 Ų | 102.7 | 37% | 0.372 | 56% | 0.561 | S | S | . | * | H | α-helix | trans | -63 | -48.5 | 174.9 | 0 | 0 | 0 | 0 | 0 | 111.7 | L203 Q204 V205 A209 A210 F211 | L203-A207 WeakPolarHBondContact O-CB 3.35Å; L203-A207 PolarHBondContact O-N 3.29Å; Q204-A207 PolarHBondContact O-N 3.34Å; V205-A207 VanDerWaalsContact C-N 3.34Å; V205-A207 PolarHBondContact O-N 3.37Å; A207-A209 PolarHBondContact O-N 2.98Å; A207-A210 PolarHBondContact O-N 3.33Å; A207-F211 WeakPolarHBondContact O-CD2 3.49Å; A207-F211 PolarHBondContact O-N 3.11Å |
| 208 | I | 64 | Low | 60.1 | Low | 109 Ų | 109 | 100.8 Ų | 100.8 | 56% | 0.559 | 56% | 0.558 | S | S | * | * | H | α-helix | trans | -59.7 | -48.5 | 177.3 | -66.8 | 163.7 | 0 | 0 | 0 | 110.3 | Q204 V205 A210 F211 T212 | Q204-I208 VanDerWaalsContact O-CG1 3.32Å; Q204-I208 WeakPolarHBondContact O-CG1 3.46Å; Q204-I208 PolarHBondContact O-N 2.88Å; V205-I208 PolarHBondContact O-N 2.98Å; I208-A210 PolarHBondContact O-N 2.99Å; I208-F211 PolarHBondContact O-N 3.12Å; I208-T212 HydrophobicContact CG2-CG2 4.33Å; I208-T212 WeakPolarHBondContact O-CG2 3.41Å; I208-T212 PolarHBondContact O-N 3.08Å; I208-T212 PolarHBondContact O-OG1 3.24Å |
| 209 | A | 66.2 | Low | 60.4 | Low | 54 Ų | 54 | 105.1 Ų | 105.1 | 45% | 0.446 | 57% | 0.57 | S | S | . | * | H | α-helix | trans | -59.1 | -34.7 | 178.5 | 0 | 0 | 0 | 0 | 0 | 113 | V205 A207 T212 | V205-A209 VanDerWaalsContact O-CB 3.31Å; V205-A209 WeakPolarHBondContact O-CB 3.36Å; V205-A209 PolarHBondContact O-N 2.68Å; A207-A209 PolarHBondContact O-N 2.98Å; A209-T212 WeakPolarHBondContact CA-OG1 3.36Å; A209-T212 PolarHBondContact O-OG1 2.95Å; A209-T212 VanDerWaalsContact O-OG1 3.05Å |
| 210 | A | 65.1 | Low | 60.7 | Low | 69 Ų | 69 | 105.1 Ų | 105.1 | 57% | 0.57 | 57% | 0.572 | S | S | * | * | H | α-helix | trans | -77.1 | -21 | 175.9 | 0 | 0 | 0 | 0 | 0 | 114 | V206 A207 I208 | V206-A210 VanDerWaalsContact O-CB 3.28Å; V206-A210 WeakPolarHBondContact O-CB 3.35Å; V206-A210 PolarHBondContact O-N 3.18Å; A207-A210 PolarHBondContact O-N 3.33Å; I208-A210 PolarHBondContact O-N 2.99Å |
| 211 | F | 61.4 | Low | 61.2 | Low | 183 Ų | 183 | 108.2 Ų | 108.2 | 80% | 0.803 | 59% | 0.592 | S | S | * | * | H | α-helix | trans | -86.9 | -23.5 | 171.5 | -83 | -66.9 | 0 | 0 | 0 | 113.2 | A207 I208 R213 | A207-F211 WeakPolarHBondContact O-CD2 3.49Å; A207-F211 PolarHBondContact O-N 3.11Å; I208-F211 PolarHBondContact O-N 3.12Å; F211-R213 VanDerWaalsContact C-N 3.27Å; F211-R213 PolarHBondContact O-N 3.29Å |
| 212 | T | 60.3 | Low | 61.5 | Low | 114 Ų | 114 | 113.3 Ų | 113.3 | 70% | 0.699 | 61% | 0.609 | S | S | * | * | trans | -84 | 9.6 | 178.2 | 51.8 | 0 | 0 | 0 | 0 | 114.5 | I208 A209 | I208-T212 HydrophobicContact CG2-CG2 4.33Å; I208-T212 WeakPolarHBondContact O-CG2 3.41Å; I208-T212 PolarHBondContact O-N 3.08Å; I208-T212 PolarHBondContact O-OG1 3.24Å; A209-T212 WeakPolarHBondContact CA-OG1 3.36Å; A209-T212 PolarHBondContact O-OG1 2.95Å; A209-T212 VanDerWaalsContact O-OG1 3.05Å | ||
| 213 | R | 44.7 | Very low | 61.4 | Low | 285 Ų | 285 | 115.7 Ų | 115.7 | 100% | 1.075 | 62% | 0.617 | S | S | * | * | trans | -132.4 | 0 | -174 | -172 | -179.7 | -173.7 | 179.7 | 4.6 | 112.6 | F211 | F211-R213 VanDerWaalsContact C-N 3.27Å; F211-R213 PolarHBondContact O-N 3.29Å |
Retrieved 213 of 213 residues in 76.5 ms
(Link to these results)