| 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 | 41.5 | Very low | 42.2 | Very low | 249 Ų | 249 | 172.4 Ų | 172.4 | 100% | 1.227 | 85% | 0.846 | S | S | * | * | 0 | 127.3 | 0 | -88.7 | 164.9 | 169.9 | 0 | 0 | 107.5 | |||||
| 2 | N | 35.6 | Very low | 42.1 | Very low | 143 Ų | 143 | 166.3 Ų | 166.3 | 77% | 0.765 | 83% | 0.83 | S | S | * | * | trans | -39.6 | 146.5 | 173.6 | -94.3 | -57.9 | 0 | 0 | 0 | 113.2 | ||||
| 3 | Y | 44.4 | Very low | 41.7 | Very low | 220 Ų | 220 | 162.2 Ų | 162.2 | 86% | 0.863 | 83% | 0.826 | S | S | * | * | -165 | 139.1 | 116.7 | -92.1 | -70.8 | 0 | 0 | 0 | 111.4 | |||||
| 4 | E | 46.5 | Very low | 41.8 | Very low | 181 Ų | 181 | 159.1 Ų | 159.1 | 85% | 0.846 | 83% | 0.827 | S | S | * | * | trans | -51.7 | 166.9 | 177.2 | -54 | 172.2 | 127.5 | 0 | 0 | 113.2 | ||||
| 5 | G | 46.2 | Very low | 41.5 | Very low | 73 Ų | 73 | 162.1 Ų | 162.1 | 75% | 0.753 | 84% | 0.835 | S | S | * | * | cis | 179 | 174.1 | 16.9 | 0 | 0 | 0 | 0 | 0 | 110.4 | ||||
| 6 | Y | 34.6 | Very low | 41.8 | Very low | 212 Ų | 212 | 164.1 Ų | 164.1 | 83% | 0.831 | 84% | 0.836 | S | S | * | * | trans | -62.9 | 140.9 | -175.1 | -93.2 | -111.3 | 0 | 0 | 0 | 114.8 | ||||
| 7 | T | 48.8 | Very low | 41.9 | Very low | 140 Ų | 140 | 162.2 Ų | 162.2 | 86% | 0.859 | 84% | 0.837 | S | S | * | * | trans | -153.1 | 116.2 | 135.6 | 21.8 | 0 | 0 | 0 | 0 | 110.2 | ||||
| 8 | N | 37.9 | Very low | 42.1 | Very low | 124 Ų | 124 | 157.5 Ų | 157.5 | 66% | 0.663 | 84% | 0.835 | S | S | * | * | trans | -87.7 | 131 | 168.6 | -94.6 | -86.3 | 0 | 0 | 0 | 108.9 | ||||
| 9 | I | 45.3 | Very low | 42 | Very low | 162 Ų | 162 | 161.6 Ų | 161.6 | 83% | 0.831 | 84% | 0.84 | S | S | * | * | trans | -123.8 | 115.2 | 163.9 | -59.8 | -178 | 0 | 0 | 0 | 107.1 | ||||
| 10 | Y | 34.3 | Very low | 42.1 | Very low | 206 Ų | 206 | 162.1 Ų | 162.1 | 81% | 0.808 | 83% | 0.831 | S | S | * | * | trans | -72.7 | 142.2 | 175.7 | -89.6 | -105.4 | 0 | 0 | 0 | 111.1 | ||||
| 11 | H | 49 | Very low | 42.5 | Very low | 186 Ų | 186 | 159.3 Ų | 159.3 | 86% | 0.861 | 82% | 0.818 | S | S | * | * | trans | -138.9 | 130.7 | 152.7 | -141.4 | -93.2 | 0 | 0 | 0 | 109.6 | ||||
| 12 | P | 40.9 | Very low | 43.2 | Very low | 100 Ų | 100 | 151.9 Ų | 151.9 | 65% | 0.649 | 79% | 0.788 | S | S | * | * | trans | -93.5 | 173.9 | -169.1 | 36.9 | -34.2 | 0 | 0 | 0 | 113 | ||||
| 13 | S | 37.6 | Very low | 44.1 | Very low | 112 Ų | 112 | 149.3 Ų | 149.3 | 78% | 0.783 | 78% | 0.782 | S | S | * | * | trans | 94.6 | 103.7 | 162.3 | 74.5 | 0 | 0 | 0 | 0 | 118 | ||||
| 14 | S | 43.1 | Very low | 44.5 | Very low | 120 Ų | 120 | 147 Ų | 147 | 84% | 0.839 | 78% | 0.779 | S | S | * | * | trans | -174.8 | 97.4 | 136.4 | -77.7 | 0 | 0 | 0 | 0 | 109.5 | K16 | S14-K16 PolarHBondContact O-N 3.26Š| ||
| 15 | Q | 37.7 | Very low | 44.7 | Very low | 204 Ų | 204 | 144.6 Ų | 144.6 | 95% | 0.953 | 77% | 0.769 | S | S | * | * | trans | -61.5 | 127.7 | 167.3 | -88.8 | 168.7 | -37 | 0 | 0 | 109.8 | ||||
| 16 | K | 45.9 | Very low | 44.7 | Very low | 193 Ų | 193 | 150 Ų | 150 | 84% | 0.839 | 78% | 0.775 | S | S | * | * | trans | -119.9 | 140.5 | 158.3 | -83.4 | -176.4 | 176.8 | 176.7 | 0 | 108.7 | S14 | S14-K16 PolarHBondContact O-N 3.26Š| ||
| 17 | P | 43.7 | Very low | 45 | Very low | 132 Ų | 132 | 149 Ų | 149 | 86% | 0.857 | 78% | 0.775 | S | S | * | * | P | Polyproline II helix | trans | -72.2 | 131.6 | -171.9 | -9.1 | 26 | 0 | 0 | 0 | 111.1 | ||
| 18 | G | 45.7 | Very low | 45 | Very low | 78 Ų | 78 | 146.9 Ų | 146.9 | 80% | 0.804 | 77% | 0.766 | S | S | * | * | P | Polyproline II helix | trans | -73.2 | 134.7 | -179.4 | 0 | 0 | 0 | 0 | 0 | 113 | ||
| 19 | Y | 39.2 | Very low | 45.1 | Very low | 236 Ų | 236 | 150 Ų | 150 | 93% | 0.925 | 78% | 0.777 | S | S | * | * | P | Polyproline II helix | trans | -72 | 129.1 | 173.4 | -150.6 | -94.8 | 0 | 0 | 0 | 109.5 | N21 | Y19-N21 PolarHBondContact O-N 3.44Š|
| 20 | Y | 44.8 | Very low | 45.1 | Very low | 170 Ų | 170 | 150.5 Ų | 150.5 | 67% | 0.667 | 77% | 0.773 | S | S | * | * | P | Polyproline II helix | trans | -74.1 | 122.3 | 178.8 | -172.2 | -94.6 | 0 | 0 | 0 | 110.4 | P22 | Y20-P22 HydrophobicContact CE1-CB 4.24Š|
| 21 | N | 50.2 | Low | 45.5 | Very low | 104 Ų | 104 | 146.1 Ų | 146.1 | 56% | 0.556 | 77% | 0.773 | S | S | * | * | trans | -102.7 | 111.7 | 173.3 | -169.4 | -10.6 | 0 | 0 | 0 | 109.7 | Y19 S23 | Y19-N21 PolarHBondContact O-N 3.44Å; N21-S23 PolarHBondContact ND2-OG 3.47Å; N21-S23 PolarHBondContact O-N 3Å; N21-S23 PolarHBondContact OD1-N 3.01Å; N21-S23 PolarHBondContact OD1-OG 2.96Å; N21-S23 VanDerWaalsContact OD1-OG 3.06Å | ||
| 22 | P | 56 | Low | 44.7 | Very low | 93 Ų | 93 | 147.6 Ų | 147.6 | 60% | 0.604 | 77% | 0.772 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -71.1 | 7.5 | -175.2 | 24.5 | -30.7 | 0 | 0 | 0 | 115.5 | Y20 | Y20-P22 HydrophobicContact CE1-CB 4.24Š|
| 23 | S | 54 | Low | 44.8 | Very low | 90 Ų | 90 | 151.2 Ų | 151.2 | 63% | 0.629 | 78% | 0.781 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -88.1 | -0.8 | -177.2 | 62.2 | 0 | 0 | 0 | 0 | 115.9 | N21 | N21-S23 PolarHBondContact ND2-OG 3.47Å; N21-S23 PolarHBondContact O-N 3Å; N21-S23 PolarHBondContact OD1-N 3.01Å; N21-S23 PolarHBondContact OD1-OG 2.96Å; N21-S23 VanDerWaalsContact OD1-OG 3.06Å |
| 24 | E | 53.3 | Low | 45 | Very low | 171 Ų | 171 | 153.6 Ų | 153.6 | 80% | 0.799 | 79% | 0.785 | S | S | * | * | trans | -109.5 | 14 | -173 | -67.4 | -171.5 | 143.2 | 0 | 0 | 115.1 | Q26 | E24-Q26 PolarHBondContact O-N 3.34Š| ||
| 25 | M | 51.1 | Low | 44.8 | Very low | 130 Ų | 130 | 151.6 Ų | 151.6 | 64% | 0.64 | 78% | 0.775 | S | S | * | * | trans | -77.2 | 86.7 | 175.1 | -75.6 | -167.3 | -70.3 | 0 | 0 | 112 | ||||
| 26 | Q | 46 | Very low | 45 | Very low | 186 Ų | 186 | 149 Ų | 149 | 87% | 0.869 | 77% | 0.768 | S | S | * | * | trans | -96 | 103.8 | 169 | -167 | 153.9 | -33.6 | 0 | 0 | 110 | E24 S28 | E24-Q26 PolarHBondContact O-N 3.34Å; Q26-S28 PolarHBondContact O-N 2.8Å | ||
| 27 | F | 40 | Very low | 44.9 | Very low | 191 Ų | 191 | 148.2 Ų | 148.2 | 84% | 0.838 | 77% | 0.772 | S | S | * | * | trans | -71.5 | 114.9 | 173.8 | -97.6 | -99.9 | 0 | 0 | 0 | 110.3 | ||||
| 28 | S | 49.8 | Very low | 44.6 | Very low | 97 Ų | 97 | 149.3 Ų | 149.3 | 68% | 0.678 | 77% | 0.769 | S | S | * | * | P | Polyproline II helix | trans | -84.2 | 117.1 | 170.2 | 28.6 | 0 | 0 | 0 | 0 | 111 | Q26 | Q26-S28 PolarHBondContact O-N 2.8Š|
| 29 | Q | 40.6 | Very low | 44.5 | Very low | 189 Ų | 189 | 151.2 Ų | 151.2 | 88% | 0.883 | 77% | 0.767 | S | S | * | * | P | Polyproline II helix | trans | -68.3 | 125.9 | 167.3 | -75.9 | 177.3 | -79.8 | 0 | 0 | 110.1 | ||
| 30 | F | 45.2 | Very low | 44.4 | Very low | 173 Ų | 173 | 144.8 Ų | 144.8 | 76% | 0.759 | 76% | 0.757 | S | S | * | * | P | Polyproline II helix | trans | -87.1 | 125.7 | 168.4 | -82.5 | -87.8 | 0 | 0 | 0 | 110.2 | ||
| 31 | S | 41.7 | Very low | 44.3 | Very low | 114 Ų | 114 | 145.7 Ų | 145.7 | 80% | 0.797 | 77% | 0.767 | S | S | * | * | P | Polyproline II helix | trans | -100.3 | 134.4 | 171.1 | -61 | 0 | 0 | 0 | 0 | 109.5 | E33 | S31-E33 PolarHBondContact O-N 3.23Š|
| 32 | Y | 33.1 | Very low | 44 | Very low | 217 Ų | 217 | 147 Ų | 147 | 85% | 0.851 | 78% | 0.781 | S | S | * | * | trans | -94.3 | 90.8 | -174.3 | -46 | -88.7 | 0 | 0 | 0 | 110.6 | ||||
| 33 | E | 42.3 | Very low | 43.2 | Very low | 176 Ų | 176 | 149.8 Ų | 149.8 | 82% | 0.822 | 79% | 0.79 | S | S | * | * | trans | -152.9 | 71 | 175.4 | -151.4 | 163.5 | 125.9 | 0 | 0 | 113.3 | S31 | S31-E33 PolarHBondContact O-N 3.23Š| ||
| 34 | N | 41.2 | Very low | 42.7 | Very low | 162 Ų | 162 | 153.5 Ų | 153.5 | 87% | 0.866 | 80% | 0.802 | S | S | * | * | trans | 169.2 | 121.8 | 136.5 | -106.6 | -83.9 | 0 | 0 | 0 | 111.1 | ||||
| 35 | A | 39.7 | Very low | 42.3 | Very low | 78 Ų | 78 | 151.8 Ų | 151.8 | 65% | 0.645 | 80% | 0.798 | S | S | * | * | trans | -99.1 | 143.8 | 170.1 | 0 | 0 | 0 | 0 | 0 | 110.1 | ||||
| 36 | N | 41.4 | Very low | 41.8 | Very low | 150 Ų | 150 | 151.9 Ų | 151.9 | 80% | 0.802 | 81% | 0.808 | S | S | * | * | trans | 87.2 | 104.2 | 164 | -55.3 | -40.8 | 0 | 0 | 0 | 118.2 | ||||
| 37 | L | 42.9 | Very low | 41.3 | Very low | 176 Ų | 176 | 151.3 Ų | 151.3 | 92% | 0.921 | 80% | 0.803 | S | S | * | * | 164.6 | 112.3 | 115.4 | -84.9 | 151.4 | 0 | 0 | 0 | 109 | |||||
| 38 | I | 39.4 | Very low | 41.5 | Very low | 155 Ų | 155 | 148 Ų | 148 | 80% | 0.795 | 80% | 0.804 | S | S | * | * | trans | -94.4 | 147.5 | 175.7 | -46.4 | 167.9 | 0 | 0 | 0 | 108 | ||||
| 39 | P | 42.8 | Very low | 40.9 | Very low | 118 Ų | 118 | 151.5 Ų | 151.5 | 77% | 0.766 | 81% | 0.809 | S | S | * | * | -145.9 | 126.2 | 100.2 | 26.5 | -4.6 | 0 | 0 | 0 | 116.4 | |||||
| 40 | S | 37.8 | Very low | 41 | Very low | 101 Ų | 101 | 148.4 Ų | 148.4 | 71% | 0.706 | 80% | 0.803 | S | S | * | * | trans | 26.6 | 115.8 | 142.3 | 57.9 | 0 | 0 | 0 | 0 | 122.3 | ||||
| 41 | Q | 42.9 | Very low | 40.7 | Very low | 189 Ų | 189 | 148.6 Ų | 148.6 | 88% | 0.883 | 81% | 0.806 | S | S | * | * | trans | -136.9 | 135.8 | 134.4 | -77.6 | -158.1 | -20.7 | 0 | 0 | 109.8 | ||||
| 42 | P | 42.4 | Very low | 40.3 | Very low | 130 Ų | 130 | 153.6 Ų | 153.6 | 84% | 0.844 | 81% | 0.809 | S | S | * | * | trans | -88.9 | 125.6 | -174.6 | 32.5 | -28.9 | 0 | 0 | 0 | 111.7 | ||||
| 43 | I | 40.3 | Very low | 40.7 | Very low | 153 Ų | 153 | 148.2 Ų | 148.2 | 79% | 0.785 | 80% | 0.804 | S | S | * | * | trans | -114.8 | 119.4 | 162.9 | -72.4 | 175.2 | 0 | 0 | 0 | 107.7 | L45 | I43-L45 HydrophobicContact CG2-CD1 4.01Å; I43-L45 PolarHBondContact O-N 3.08Å | ||
| 44 | N | 43.2 | Very low | 40.4 | Very low | 168 Ų | 168 | 145.9 Ų | 145.9 | 90% | 0.898 | 81% | 0.806 | S | S | * | * | trans | -63.8 | 118.2 | 176.8 | -105.7 | -34.1 | 0 | 0 | 0 | 111 | ||||
| 45 | L | 45.2 | Very low | 40.3 | Very low | 134 Ų | 134 | 141.5 Ų | 141.5 | 70% | 0.702 | 80% | 0.8 | S | S | * | * | trans | -130.3 | 140.8 | 155 | -79.4 | 100.3 | 0 | 0 | 0 | 108.3 | I43 F47 | I43-L45 HydrophobicContact CG2-CD1 4.01Å; I43-L45 PolarHBondContact O-N 3.08Å; L45-F47 PolarHBondContact O-N 3.3Å | ||
| 46 | P | 39.5 | Very low | 40.4 | Very low | 132 Ų | 132 | 142.1 Ų | 142.1 | 86% | 0.857 | 81% | 0.805 | S | S | * | * | trans | -73.9 | 106.2 | -178 | 30.6 | -30.8 | 0 | 0 | 0 | 108.9 | ||||
| 47 | F | 37 | Very low | 40.3 | Very low | 175 Ų | 175 | 141.9 Ų | 141.9 | 77% | 0.768 | 80% | 0.802 | S | S | * | * | trans | -128.2 | 122 | 163.6 | -118.4 | -90.7 | 0 | 0 | 0 | 107.4 | L45 Q49 | L45-F47 PolarHBondContact O-N 3.3Å; F47-Q49 PolarHBondContact O-N 3.38Å | ||
| 48 | S | 43.8 | Very low | 39.9 | Very low | 122 Ų | 122 | 144.4 Ų | 144.4 | 85% | 0.853 | 80% | 0.801 | S | S | * | * | trans | -59.5 | 105.8 | 173.1 | -51.5 | 0 | 0 | 0 | 0 | 108.8 | ||||
| 49 | Q | 37.5 | Very low | 40.2 | Very low | 170 Ų | 170 | 145.7 Ų | 145.7 | 79% | 0.794 | 80% | 0.804 | S | S | * | * | trans | -76 | 121 | 178.2 | -70.9 | -78.8 | -59.5 | 0 | 0 | 109.4 | F47 Q51 | F47-Q49 PolarHBondContact O-N 3.38Å; Q49-Q51 PolarHBondContact O-N 2.94Å | ||
| 50 | V | 41.8 | Very low | 40 | Very low | 123 Ų | 123 | 149.8 Ų | 149.8 | 75% | 0.745 | 81% | 0.813 | S | S | * | * | trans | -75.8 | 109.9 | 164.9 | -126.2 | 0 | 0 | 0 | 0 | 107.2 | Y52 | V50-Y52 HydrophobicContact CB-CE2 4.45Å; V50-Y52 PolarHBondContact O-N 3.46Å | ||
| 51 | Q | 37.9 | Very low | 40.4 | Very low | 178 Ų | 178 | 153.9 Ų | 153.9 | 83% | 0.832 | 82% | 0.818 | S | S | * | * | trans | -85 | 102.8 | -178.9 | -173.7 | 171.9 | -87.5 | 0 | 0 | 109.7 | Q49 | Q49-Q51 PolarHBondContact O-N 2.94Š| ||
| 52 | Y | 33.3 | Very low | 40.8 | Very low | 218 Ų | 218 | 154.2 Ų | 154.2 | 86% | 0.855 | 82% | 0.819 | S | S | * | * | trans | -91.7 | 103.6 | 161.6 | -74.1 | -86.4 | 0 | 0 | 0 | 108.3 | V50 | V50-Y52 HydrophobicContact CB-CE2 4.45Å; V50-Y52 PolarHBondContact O-N 3.46Å | ||
| 53 | S | 42 | Very low | 41 | Very low | 105 Ų | 105 | 154.2 Ų | 154.2 | 73% | 0.734 | 81% | 0.808 | S | S | * | * | trans | -106.3 | 110.9 | 167.3 | -172.7 | 0 | 0 | 0 | 0 | 108.4 | ||||
| 54 | S | 37.1 | Very low | 41.6 | Very low | 126 Ų | 126 | 151.4 Ų | 151.4 | 88% | 0.881 | 80% | 0.795 | S | S | * | * | trans | -92.3 | 128 | 167.7 | -169.1 | 0 | 0 | 0 | 0 | 108.2 | ||||
| 55 | G | 39.1 | Very low | 41.9 | Very low | 71 Ų | 71 | 150.6 Ų | 150.6 | 73% | 0.732 | 78% | 0.78 | S | S | * | * | trans | 99.4 | 95.4 | 159.8 | 0 | 0 | 0 | 0 | 0 | 115.6 | ||||
| 56 | A | 41.1 | Very low | 42.6 | Very low | 91 Ų | 91 | 152.9 Ų | 152.9 | 75% | 0.752 | 79% | 0.787 | S | S | * | * | trans | -164.6 | 112.9 | 139.6 | 0 | 0 | 0 | 0 | 0 | 110.2 | ||||
| 57 | I | 40.4 | Very low | 43.5 | Very low | 144 Ų | 144 | 152.6 Ų | 152.6 | 74% | 0.738 | 78% | 0.779 | S | S | * | * | trans | 59.1 | 117 | 136.7 | -44.8 | -61.7 | 0 | 0 | 0 | 117.9 | E59 | I57-E59 PolarHBondContact O-N 3.27Å; I57-E59 VanDerWaalsContact O-N 3.14Å | ||
| 58 | Y | 34.2 | Very low | 44.1 | Very low | 229 Ų | 229 | 148.6 Ų | 148.6 | 90% | 0.898 | 76% | 0.762 | S | S | * | * | trans | -47.4 | 108.2 | 165 | -45.1 | -88.3 | 0 | 0 | 0 | 111.6 | ||||
| 59 | E | 44.6 | Very low | 44.8 | Very low | 182 Ų | 182 | 146.2 Ų | 146.2 | 85% | 0.85 | 74% | 0.744 | S | S | * | * | trans | -110.7 | 110.6 | 154.7 | -85.3 | -172.2 | 153.7 | 0 | 0 | 106.7 | I57 K61 | I57-E59 PolarHBondContact O-N 3.27Å; I57-E59 VanDerWaalsContact O-N 3.14Å; E59-K61 VanDerWaalsContact C-N 3.33Å; E59-K61 PolarHBondContact O-N 2.91Å | ||
| 60 | E | 38 | Very low | 45.8 | Very low | 205 Ų | 205 | 142.3 Ų | 142.3 | 96% | 0.958 | 73% | 0.733 | S | S | * | * | trans | -55.8 | 98.1 | 163.7 | -80.3 | 174 | 140.3 | 0 | 0 | 108 | ||||
| 61 | K | 48.2 | Very low | 46.3 | Very low | 187 Ų | 187 | 141.5 Ų | 141.5 | 81% | 0.813 | 72% | 0.724 | S | S | * | * | trans | -89.6 | 114.9 | 162.6 | -121.6 | 176.9 | -180 | 175.5 | 0 | 106 | E59 E63 | E59-K61 VanDerWaalsContact C-N 3.33Å; E59-K61 PolarHBondContact O-N 2.91Å; K61-E63 PolarHBondContact O-N 3.04Å | ||
| 62 | E | 49.7 | Very low | 46.8 | Very low | 195 Ų | 195 | 137.7 Ų | 137.7 | 91% | 0.911 | 71% | 0.709 | S | S | * | * | trans | -45.4 | 105.5 | 166.8 | -75.1 | 172.9 | 144.4 | 0 | 0 | 108.3 | D64 | E62-D64 PolarHBondContact O-N 3.44Å; E62-D64 VanDerWaalsContact O-N 3.12Å | ||
| 63 | E | 46.9 | Very low | 47.7 | Very low | 130 Ų | 130 | 132.8 Ų | 132.8 | 61% | 0.607 | 69% | 0.694 | S | S | * | * | trans | -68.9 | 106.4 | 171.7 | -72 | -173.9 | -174.3 | 0 | 0 | 106 | K61 Y65 | K61-E63 PolarHBondContact O-N 3.04Å; E63-Y65 HydrophobicContact CB-CD1 4.24Å; E63-Y65 HydrophobicContact CB-CD2 3.97Å; E63-Y65 HydrophobicContact CB-CE1 3.8Å; E63-Y65 HydrophobicContact CB-CE2 3.53Å; E63-Y65 HydrophobicContact CB-CG 4.31Å; E63-Y65 VanDerWaalsContact CB-CZ 3.43Å; E63-Y65 WeakPolarHBondContact O-CD2 3.34Å; E63-Y65 PolarHBondContact O-N 3.19Å; E63-Y65 WeakPolarHBondContact OE2-CE1 3.42Å; E63-Y65 PolarHBondContact OE2-OH 2.83Å | ||
| 64 | D | 52.1 | Low | 48.2 | Very low | 95 Ų | 95 | 134.9 Ų | 134.9 | 51% | 0.508 | 69% | 0.692 | S | S | . | * | trans | -69.8 | 72 | 171.4 | -176.5 | 13.5 | 0 | 0 | 0 | 108.9 | E62 E66 N67 | E62-D64 PolarHBondContact O-N 3.44Å; E62-D64 VanDerWaalsContact O-N 3.12Å; D64-E66 PolarHBondContact O-N 3.46Å; D64-E66 VanDerWaalsContact O-N 3.08Å; D64-N67 PolarHBondContact O-N 3.28Å; D64-N67 PolarHBondContact OD2-ND2 3.49Å | ||
| 65 | Y | 51.1 | Low | 49.1 | Very low | 150 Ų | 150 | 135.1 Ų | 135.1 | 59% | 0.588 | 68% | 0.683 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -61.3 | -7.3 | 175.6 | -61.6 | -73.4 | 0 | 0 | 0 | 112.9 | E63 E68 | E63-Y65 HydrophobicContact CB-CD1 4.24Å; E63-Y65 HydrophobicContact CB-CD2 3.97Å; E63-Y65 HydrophobicContact CB-CE1 3.8Å; E63-Y65 HydrophobicContact CB-CE2 3.53Å; E63-Y65 HydrophobicContact CB-CG 4.31Å; E63-Y65 VanDerWaalsContact CB-CZ 3.43Å; E63-Y65 WeakPolarHBondContact O-CD2 3.34Å; E63-Y65 PolarHBondContact O-N 3.19Å; E63-Y65 WeakPolarHBondContact OE2-CE1 3.42Å; E63-Y65 PolarHBondContact OE2-OH 2.83Å; Y65-E68 WeakPolarHBondContact O-CG 3.49Å |
| 66 | E | 58.4 | Low | 49.7 | Very low | 182 Ų | 182 | 135.1 Ų | 135.1 | 85% | 0.85 | 68% | 0.683 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -86.4 | -19.6 | 179.7 | -114.5 | -179.8 | 165.7 | 0 | 0 | 112.7 | D64 | D64-E66 PolarHBondContact O-N 3.46Å; D64-E66 VanDerWaalsContact O-N 3.08Å |
| 67 | N | 58.7 | Low | 50.3 | Low | 127 Ų | 127 | 134.4 Ų | 134.4 | 68% | 0.679 | 67% | 0.666 | S | S | * | * | S | Bend | trans | -111.4 | 8.9 | -179.6 | -75.7 | -55.6 | 0 | 0 | 0 | 113.9 | D64 | D64-N67 PolarHBondContact O-N 3.28Å; D64-N67 PolarHBondContact OD2-ND2 3.49Å |
| 68 | E | 49.8 | Very low | 51.2 | Low | 90 Ų | 90 | 131 Ų | 131 | 42% | 0.421 | 65% | 0.648 | S | S | . | * | S | Bend | trans | -78.7 | 128.8 | 172.6 | 67.3 | -172.4 | 176.6 | 0 | 0 | 110.7 | Y65 | Y65-E68 WeakPolarHBondContact O-CG 3.49Š|
| 69 | P | 59.6 | Low | 52.3 | Low | 73 Ų | 73 | 126.9 Ų | 126.9 | 47% | 0.474 | 64% | 0.636 | S | S | . | * | P | Polyproline II helix | trans | -58.4 | 142.8 | 167.9 | 25.2 | -31 | 0 | 0 | 0 | 108.5 | L71 | P69-L71 PolarHBondContact O-N 3.49Š|
| 70 | P | 58.2 | Low | 52.8 | Low | 87 Ų | 87 | 122.1 Ų | 122.1 | 57% | 0.565 | 62% | 0.623 | S | S | * | * | P | Polyproline II helix | trans | -55.5 | 137.6 | -171.4 | 22.8 | -33.4 | 0 | 0 | 0 | 111 | L72 E73 | P70-L72 PolarHBondContact O-N 3.13Å; P70-E73 WeakPolarHBondContact O-CB 3.49Å; P70-E73 PolarHBondContact O-N 3.05Å |
| 71 | L | 51.2 | Low | 53.5 | Low | 107 Ų | 107 | 117.4 Ų | 117.4 | 56% | 0.56 | 60% | 0.6 | S | S | * | * | H | α-helix | trans | -51.8 | -12.1 | -177.6 | -65 | 172.8 | 0 | 0 | 0 | 115.1 | P69 E74 L75 | P69-L71 PolarHBondContact O-N 3.49Å; L71-E74 VanDerWaalsContact CD2-OE2 3.29Å; L71-E74 WeakPolarHBondContact CD2-OE2 3.22Å; L71-L75 WeakPolarHBondContact O-CA 3.49Å; L71-L75 WeakPolarHBondContact O-CB 3.42Å; L71-L75 PolarHBondContact O-N 3.39Å |
| 72 | L | 49.2 | Very low | 53.9 | Low | 97 Ų | 97 | 112.4 Ų | 112.4 | 51% | 0.508 | 58% | 0.582 | S | S | . | * | H | α-helix | trans | -78.2 | -24.2 | 172.3 | -72.7 | 162.8 | 0 | 0 | 0 | 113.8 | P70 L75 G76 I77 | P70-L72 PolarHBondContact O-N 3.13Å; L72-L75 CarbonylContact O-C 3.3Å; L72-L75 VanDerWaalsContact O-C 3.3Å; L72-G76 PolarHBondContact O-N 2.82Å; L72-I77 HydrophobicContact CD2-CB 4.44Å; L72-I77 PolarHBondContact O-N 2.92Å |
| 73 | E | 53.1 | Low | 54.3 | Low | 116 Ų | 116 | 108 Ų | 108 | 54% | 0.542 | 57% | 0.568 | S | S | . | * | H | α-helix | trans | -77.7 | -35.4 | 169.8 | -169.5 | 167.9 | -169.9 | 0 | 0 | 110.5 | P70 | P70-E73 WeakPolarHBondContact O-CB 3.49Å; P70-E73 PolarHBondContact O-N 3.05Å |
| 74 | E | 52.5 | Low | 54.6 | Low | 149 Ų | 149 | 108 Ų | 108 | 70% | 0.696 | 57% | 0.568 | S | S | * | * | H | α-helix | trans | -76.6 | -26.9 | 171 | -156.2 | 172.3 | -159.9 | 0 | 0 | 112.6 | L71 | L71-E74 VanDerWaalsContact CD2-OE2 3.29Å; L71-E74 WeakPolarHBondContact CD2-OE2 3.22Å |
| 75 | L | 55.8 | Low | 54.5 | Low | 130 Ų | 130 | 108.3 Ų | 108.3 | 68% | 0.681 | 57% | 0.565 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -108.1 | 44.8 | 176.3 | -152.6 | 80.2 | 0 | 0 | 0 | 111 | L71 L72 I77 | L71-L75 WeakPolarHBondContact O-CA 3.49Å; L71-L75 WeakPolarHBondContact O-CB 3.42Å; L71-L75 PolarHBondContact O-N 3.39Å; L72-L75 CarbonylContact O-C 3.3Å; L72-L75 VanDerWaalsContact O-C 3.3Å; L75-I77 PolarHBondContact O-N 3.17Å |
| 76 | G | 51.3 | Low | 54.6 | Low | 71 Ų | 71 | 104.6 Ų | 104.6 | 73% | 0.732 | 56% | 0.558 | S | S | * | * | T | Hydrogen-bonded Turn | trans | 57.8 | 5.4 | 156.4 | 0 | 0 | 0 | 0 | 0 | 120 | L72 | L72-G76 PolarHBondContact O-N 2.82Š|
| 77 | I | 52.7 | Low | 54.2 | Low | 77 Ų | 77 | 99.8 Ų | 99.8 | 40% | 0.395 | 54% | 0.544 | S | S | . | . | trans | -118.1 | 79.4 | -171.4 | -63 | -178.1 | 0 | 0 | 0 | 110.1 | L72 L75 F79 I82 | L72-I77 HydrophobicContact CD2-CB 4.44Å; L72-I77 PolarHBondContact O-N 2.92Å; L75-I77 PolarHBondContact O-N 3.17Å; I77-F79 HydrophobicContact CG2-CD2 3.61Å; I77-F79 HydrophobicContact CG2-CE1 4.35Å; I77-F79 HydrophobicContact CG2-CE2 3.28Å; I77-F79 HydrophobicContact CG2-CG 4.27Å; I77-F79 HydrophobicContact CG2-CZ 3.7Å; I77-F79 PolarHBondContact O-N 3.28Å; I77-I82 HydrophobicContact CG2-CD1 4.48Å | ||
| 78 | N | 59.2 | Low | 53.7 | Low | 71 Ų | 71 | 95.8 Ų | 95.8 | 38% | 0.38 | 53% | 0.526 | S | S | . | . | trans | -86.8 | 94.7 | 161.7 | -85.6 | -57.9 | 0 | 0 | 0 | 109.5 | S80 H81 I82 | N78-S80 PolarHBondContact O-N 3.28Å; N78-H81 HydrophobicContact CB-CB 3.69Å; N78-H81 WeakPolarHBondContact O-CA 3.12Å; N78-H81 VanDerWaalsContact O-CB 3.23Å; N78-H81 WeakPolarHBondContact O-CB 3.41Å; N78-H81 PolarHBondContact O-N 3.22Å; N78-I82 PolarHBondContact O-N 3Å; N78-I82 VanDerWaalsContact O-N 3.12Å | ||
| 79 | F | 57.7 | Low | 53.7 | Low | 143 Ų | 143 | 95.8 Ų | 95.8 | 63% | 0.627 | 53% | 0.532 | S | S | * | . | H | α-helix | trans | -57.2 | -29.6 | 176.4 | -78.4 | -81.8 | 0 | 0 | 0 | 113.4 | I77 H81 I82 V83 | I77-F79 HydrophobicContact CG2-CD2 3.61Å; I77-F79 HydrophobicContact CG2-CE1 4.35Å; I77-F79 HydrophobicContact CG2-CE2 3.28Å; I77-F79 HydrophobicContact CG2-CG 4.27Å; I77-F79 HydrophobicContact CG2-CZ 3.7Å; I77-F79 PolarHBondContact O-N 3.28Å; F79-H81 VanDerWaalsContact C-N 3.31Å; F79-I82 HydrophobicContact CD1-CD1 4.2Å; F79-I82 PolarHBondContact O-N 3.27Å; F79-V83 PolarHBondContact O-N 3.06Å; F79-V83 VanDerWaalsContact O-N 3.12Å |
| 80 | S | 55.9 | Low | 53.4 | Low | 83 Ų | 83 | 95.5 Ų | 95.5 | 58% | 0.58 | 53% | 0.526 | S | S | * | . | H | α-helix | trans | -62.9 | -36.8 | 171.1 | 51.4 | 0 | 0 | 0 | 0 | 112.2 | N78 Q84 | N78-S80 PolarHBondContact O-N 3.28Å; S80-Q84 WeakPolarHBondContact O-CB 3.37Å; S80-Q84 PolarHBondContact O-N 3.41Å |
| 81 | H | 51.7 | Low | 53.1 | Low | 105 Ų | 105 | 96.5 Ų | 96.5 | 49% | 0.486 | 53% | 0.526 | S | S | . | . | H | α-helix | trans | -73.7 | -30.6 | 176.1 | -150.9 | -136.3 | 0 | 0 | 0 | 112 | N78 F79 K85 | N78-H81 HydrophobicContact CB-CB 3.69Å; N78-H81 WeakPolarHBondContact O-CA 3.12Å; N78-H81 VanDerWaalsContact O-CB 3.23Å; N78-H81 WeakPolarHBondContact O-CB 3.41Å; N78-H81 PolarHBondContact O-N 3.22Å; F79-H81 VanDerWaalsContact C-N 3.31Å; H81-K85 VanDerWaalsContact O-CB 3.23Å; H81-K85 WeakPolarHBondContact O-CB 3.47Å; H81-K85 VanDerWaalsContact O-CG 3.26Å; H81-K85 WeakPolarHBondContact O-CG 3.37Å; H81-K85 PolarHBondContact O-N 2.9Å |
| 82 | I | 56.8 | Low | 52.8 | Low | 83 Ų | 83 | 94.7 Ų | 94.7 | 43% | 0.426 | 52% | 0.521 | S | S | . | . | H | α-helix | trans | -68.1 | -49.6 | 175.8 | -61.8 | 173 | 0 | 0 | 0 | 110.3 | I77 N78 F79 Q84 K85 T86 | I77-I82 HydrophobicContact CG2-CD1 4.48Å; N78-I82 PolarHBondContact O-N 3Å; N78-I82 VanDerWaalsContact O-N 3.12Å; F79-I82 HydrophobicContact CD1-CD1 4.2Å; F79-I82 PolarHBondContact O-N 3.27Å; I82-Q84 PolarHBondContact O-N 3.28Å; I82-K85 CarbonylContact O-C 3.57Å; I82-K85 PolarHBondContact O-N 2.71Å; I82-T86 WeakPolarHBondContact O-CB 3.36Å; I82-T86 PolarHBondContact O-N 2.92Å; I82-T86 PolarHBondContact O-OG1 3.26Å |
| 83 | V | 58 | Low | 52.5 | Low | 102 Ų | 102 | 99 Ų | 99 | 62% | 0.618 | 54% | 0.536 | S | S | * | . | H | α-helix | trans | -66 | -38 | -179.9 | 176 | 0 | 0 | 0 | 0 | 112.1 | F79 T86 S87 | F79-V83 PolarHBondContact O-N 3.06Å; F79-V83 VanDerWaalsContact O-N 3.12Å; V83-T86 PolarHBondContact O-N 2.84Å; V83-S87 WeakPolarHBondContact O-CB 3.18Å; V83-S87 PolarHBondContact O-N 3.39Å |
| 84 | Q | 53 | Low | 51.8 | Low | 131 Ų | 131 | 97.3 Ų | 97.3 | 61% | 0.612 | 53% | 0.527 | S | S | * | . | H | α-helix | trans | -74 | -26.8 | 176.9 | -147.9 | 169.9 | 6 | 0 | 0 | 112.1 | S80 I82 S88 K94 | S80-Q84 WeakPolarHBondContact O-CB 3.37Å; S80-Q84 PolarHBondContact O-N 3.41Å; I82-Q84 PolarHBondContact O-N 3.28Å; Q84-S88 WeakPolarHBondContact O-CB 3.35Å; Q84-S88 PolarHBondContact O-OG 3.29Å; Q84-K94 PolarHBondContact O-NZ 3.49Å |
| 85 | K | 51.4 | Low | 51 | Low | 100 Ų | 100 | 99.1 Ų | 99.1 | 44% | 0.435 | 54% | 0.535 | S | S | . | . | H | α-helix | trans | -69.2 | -44.9 | 164.3 | -80.7 | 178.5 | 179.8 | -176.4 | 0 | 111.9 | H81 I82 S87 V89 | H81-K85 VanDerWaalsContact O-CB 3.23Å; H81-K85 WeakPolarHBondContact O-CB 3.47Å; H81-K85 VanDerWaalsContact O-CG 3.26Å; H81-K85 WeakPolarHBondContact O-CG 3.37Å; H81-K85 PolarHBondContact O-N 2.9Å; I82-K85 CarbonylContact O-C 3.57Å; I82-K85 PolarHBondContact O-N 2.71Å; K85-S87 PolarHBondContact O-N 3.19Å; K85-V89 VanDerWaalsContact O-CG2 3.28Å; K85-V89 WeakPolarHBondContact O-CG2 3.5Å; K85-V89 PolarHBondContact O-N 3.4Å |
| 86 | T | 52.7 | Low | 50.5 | Low | 73 Ų | 73 | 96.1 Ų | 96.1 | 45% | 0.448 | 53% | 0.525 | S | S | . | . | H | α-helix | trans | -62.8 | -42 | 178.6 | -55.1 | 0 | 0 | 0 | 0 | 112.8 | I82 V83 | I82-T86 WeakPolarHBondContact O-CB 3.36Å; I82-T86 PolarHBondContact O-N 2.92Å; I82-T86 PolarHBondContact O-OG1 3.26Å; V83-T86 PolarHBondContact O-N 2.84Å |
| 87 | S | 50.6 | Low | 50 | Low | 81 Ų | 81 | 95.8 Ų | 95.8 | 57% | 0.566 | 51% | 0.512 | S | S | * | . | H | α-helix | trans | -77 | -25.1 | -176.1 | -171.6 | 0 | 0 | 0 | 0 | 114.1 | V83 K85 | V83-S87 WeakPolarHBondContact O-CB 3.18Å; V83-S87 PolarHBondContact O-N 3.39Å; K85-S87 PolarHBondContact O-N 3.19Å |
| 88 | S | 48.3 | Very low | 49.8 | Very low | 43 Ų | 43 | 98.6 Ų | 98.6 | 30% | 0.301 | 52% | 0.523 | S | S | . | . | H | α-helix | trans | -89.2 | -20.9 | -179 | -73.6 | 0 | 0 | 0 | 0 | 113 | Q84 K94 | Q84-S88 WeakPolarHBondContact O-CB 3.35Å; Q84-S88 PolarHBondContact O-OG 3.29Å; S88-K94 WeakPolarHBondContact O-CB 3.48Å; S88-K94 WeakPolarHBondContact OG-CE 3.44Å |
| 89 | V | 49.8 | Very low | 49.2 | Very low | 89 Ų | 89 | 102.3 Ų | 102.3 | 54% | 0.539 | 54% | 0.538 | S | S | . | . | H | α-helix | trans | -80.1 | -25.1 | 175.1 | 176.9 | 0 | 0 | 0 | 0 | 112.5 | K85 L91 K94 | K85-V89 VanDerWaalsContact O-CG2 3.28Å; K85-V89 WeakPolarHBondContact O-CG2 3.5Å; K85-V89 PolarHBondContact O-N 3.4Å; V89-L91 PolarHBondContact O-N 3.38Å; V89-K94 HydrophobicContact CG2-CD 4.38Å |
| 90 | L | 52.1 | Low | 48.9 | Very low | 68 Ų | 68 | 99.7 Ų | 99.7 | 36% | 0.356 | 53% | 0.534 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -70.4 | -5.3 | 172.8 | -99.4 | 159.1 | 0 | 0 | 0 | 113.8 | L168 L172 W197 | L90-L168 HydrophobicContact CD1-CD2 4.04Å; L90-L168 HydrophobicContact CD2-CD2 3.65Å; L90-L168 HydrophobicContact CG-CD2 4.1Å; L90-L172 HydrophobicContact CD2-CD1 4.49Å; L90-W197 VanDerWaalsContact O-CZ2 3.3Å; L90-W197 WeakPolarHBondContact O-CZ2 3.42Å |
| 91 | L | 51.4 | Low | 48.8 | Very low | 108 Ų | 108 | 97.9 Ų | 97.9 | 57% | 0.565 | 52% | 0.517 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -119.6 | 141.2 | 175.6 | -146.5 | 70.3 | 0 | 0 | 0 | 107.6 | V89 F93 | V89-L91 PolarHBondContact O-N 3.38Å; L91-F93 PolarHBondContact O-N 3.17Å |
| 92 | P | 44.9 | Very low | 48.9 | Very low | 69 Ų | 69 | 99.1 Ų | 99.1 | 45% | 0.448 | 53% | 0.528 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -78 | 28.2 | -167.4 | 31.8 | -19.9 | 0 | 0 | 0 | 113 | W197 | P92-W197 HydrophobicContact CB-CH2 3.94Å; P92-W197 HydrophobicContact CB-CZ2 4.22Å; P92-W197 VanDerWaalsContact CD-CH2 3.46Å; P92-W197 HydrophobicContact CG-CH2 3.42Å; P92-W197 VanDerWaalsContact CG-CH2 3.42Å; P92-W197 HydrophobicContact CG-CZ2 4.13Å; P92-W197 HydrophobicContact CG-CZ3 4.04Å |
| 93 | F | 44.8 | Very low | 48.8 | Very low | 188 Ų | 188 | 100.7 Ų | 100.7 | 83% | 0.825 | 54% | 0.537 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -128.8 | 10.1 | -172.1 | -75.7 | -70.2 | 0 | 0 | 0 | 114.9 | L91 | L91-F93 PolarHBondContact O-N 3.17Š|
| 94 | K | 36.9 | Very low | 48.9 | Very low | 79 Ų | 79 | 98.1 Ų | 98.1 | 34% | 0.343 | 52% | 0.521 | S | S | . | . | trans | -110.4 | 121.6 | 170 | -154.5 | -164.4 | -133 | 174.5 | 0 | 111.9 | Q84 S88 V89 S96 | Q84-K94 PolarHBondContact O-NZ 3.49Å; S88-K94 WeakPolarHBondContact O-CB 3.48Å; S88-K94 WeakPolarHBondContact OG-CE 3.44Å; V89-K94 HydrophobicContact CG2-CD 4.38Å; K94-S96 PolarHBondContact O-N 3.22Å; K94-S96 VanDerWaalsContact O-N 3.08Å | ||
| 95 | E | 37.2 | Very low | 49.9 | Very low | 188 Ų | 188 | 96.6 Ų | 96.6 | 88% | 0.879 | 52% | 0.517 | S | S | * | . | trans | -58.2 | 106.9 | 166.4 | -60.8 | -175.3 | 132 | 0 | 0 | 109 | S97 | E95-S97 PolarHBondContact O-N 3Š| ||
| 96 | S | 44.8 | Very low | 51.2 | Low | 67 Ų | 67 | 96.1 Ų | 96.1 | 47% | 0.469 | 52% | 0.519 | S | S | . | . | trans | -70.6 | 109.6 | 157 | 52.8 | 0 | 0 | 0 | 0 | 106.6 | K94 | K94-S96 PolarHBondContact O-N 3.22Å; K94-S96 VanDerWaalsContact O-N 3.08Å | ||
| 97 | S | 40.5 | Very low | 52.7 | Low | 64 Ų | 64 | 95.8 Ų | 95.8 | 45% | 0.448 | 52% | 0.524 | S | S | . | . | trans | -52.9 | 138.4 | 168.4 | 45 | 0 | 0 | 0 | 0 | 109.3 | E95 E99 V100 | E95-S97 PolarHBondContact O-N 3Å; S97-E99 PolarHBondContact O-N 3.35Å; S97-V100 PolarHBondContact O-N 3.48Å; S97-V100 VanDerWaalsContact O-N 3.09Å | ||
| 98 | Q | 48.7 | Very low | 54.2 | Low | 136 Ų | 136 | 92.7 Ų | 92.7 | 64% | 0.636 | 51% | 0.505 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -52.2 | -24.4 | 178.4 | -73.6 | -169 | -9.2 | 0 | 0 | 112.8 | V100 L101 D102 | Q98-V100 VanDerWaalsContact C-N 3.34Å; Q98-V100 PolarHBondContact O-N 2.8Å; Q98-L101 WeakPolarHBondContact O-CB 3.37Å; Q98-L101 PolarHBondContact O-N 3.41Å; Q98-D102 PolarHBondContact O-N 3.44Å |
| 99 | E | 47.3 | Very low | 56.1 | Low | 149 Ų | 149 | 91 Ų | 91 | 70% | 0.696 | 49% | 0.493 | S | S | * | . | H | α-helix | trans | -58.4 | -35 | 177.1 | -149.2 | 169.2 | 125.8 | 0 | 0 | 114.4 | S97 L101 D102 D103 | S97-E99 PolarHBondContact O-N 3.35Å; E99-L101 PolarHBondContact O-N 3.16Å; E99-D102 PolarHBondContact O-N 2.89Å; E99-D103 PolarHBondContact O-N 2.89Å |
| 100 | V | 51.3 | Low | 57.9 | Low | 88 Ų | 88 | 91.8 Ų | 91.8 | 53% | 0.533 | 49% | 0.493 | S | S | . | . | H | α-helix | trans | -74.2 | -12.7 | 177.6 | -180 | 0 | 0 | 0 | 0 | 112 | S97 Q98 | S97-V100 PolarHBondContact O-N 3.48Å; S97-V100 VanDerWaalsContact O-N 3.09Å; Q98-V100 VanDerWaalsContact C-N 3.34Å; Q98-V100 PolarHBondContact O-N 2.8Å |
| 101 | L | 53.4 | Low | 59.7 | Low | 44 Ų | 44 | 92.7 Ų | 92.7 | 23% | 0.23 | 50% | 0.501 | C | S | . | . | H | α-helix | trans | -93.6 | -22.2 | 178.8 | -154.7 | 131.6 | 0 | 0 | 0 | 112.6 | Q98 E99 T104 L205 S209 | Q98-L101 WeakPolarHBondContact O-CB 3.37Å; Q98-L101 PolarHBondContact O-N 3.41Å; E99-L101 PolarHBondContact O-N 3.16Å; L101-T104 PolarHBondContact O-OG1 3.23Å; L101-L205 HydrophobicContact CD1-CB 4.37Å; L101-L205 HydrophobicContact CD1-CD2 4.03Å; L101-S209 VanDerWaalsContact CD1-OG 3.28Å; L101-S209 WeakPolarHBondContact CD1-OG 3.36Å; L101-S209 VanDerWaalsContact CD2-CB 3.49Å; L101-S209 WeakPolarHBondContact CD2-OG 3.46Å |
| 102 | D | 52.6 | Low | 61.5 | Low | 132 Ų | 132 | 89.7 Ų | 89.7 | 71% | 0.706 | 48% | 0.484 | S | S | * | . | H | α-helix | trans | -78.1 | -33.1 | 174.1 | -78.1 | -22.1 | 0 | 0 | 0 | 111.8 | Q98 E99 T104 | Q98-D102 PolarHBondContact O-N 3.44Å; E99-D102 PolarHBondContact O-N 2.89Å; D102-T104 PolarHBondContact O-N 3.45Å |
| 103 | D | 55.7 | Low | 63.7 | Low | 115 Ų | 115 | 88.9 Ų | 88.9 | 62% | 0.615 | 48% | 0.479 | S | S | * | . | S | Bend | trans | -75.1 | 74.7 | 168.5 | -69.4 | -21.8 | 0 | 0 | 0 | 110.2 | E99 D105 | E99-D103 PolarHBondContact O-N 2.89Å; D103-D105 VanDerWaalsContact C-N 3.28Å; D103-D105 PolarHBondContact O-N 2.88Å |
| 104 | T | 58.9 | Low | 65.8 | Low | 48 Ų | 48 | 85 Ų | 85 | 29% | 0.294 | 47% | 0.466 | S | S | . | . | trans | -75.7 | 79.9 | -177 | -50.8 | 0 | 0 | 0 | 0 | 111.2 | L101 D102 L106 T157 S161 | L101-T104 PolarHBondContact O-OG1 3.23Å; D102-T104 PolarHBondContact O-N 3.45Å; T104-L106 PolarHBondContact O-N 3.24Å; T104-T157 HydrophobicContact CG2-CG2 3.28Å; T104-S161 VanDerWaalsContact CG2-OG 3.25Å; T104-S161 WeakPolarHBondContact CG2-OG 3.11Å | ||
| 105 | D | 74.6 | Confident | 68.4 | Low | 99 Ų | 99 | 85.1 Ų | 85.1 | 53% | 0.529 | 47% | 0.471 | S | S | . | . | trans | -73.3 | 123.4 | 171.2 | -73.1 | -37.6 | 0 | 0 | 0 | 110.9 | D103 A107 P109 S161 | D103-D105 VanDerWaalsContact C-N 3.28Å; D103-D105 PolarHBondContact O-N 2.88Å; D105-A107 VanDerWaalsContact C-N 3.32Å; D105-P109 WeakPolarHBondContact O-CD 3.43Å; D105-S161 PolarHBondContact O-OG 3.46Å | ||
| 106 | L | 79.8 | Confident | 71 | Confident | 91 Ų | 91 | 76.2 Ų | 76.2 | 48% | 0.476 | 43% | 0.429 | S | S | . | . | S | Bend | trans | -81.1 | -16.8 | 172.2 | -164.3 | 68 | 0 | 0 | 0 | 112 | T104 L110 T157 I160 | T104-L106 PolarHBondContact O-N 3.24Å; L106-L110 WeakPolarHBondContact O-CB 3.41Å; L106-L110 PolarHBondContact O-N 3.36Å; L106-T157 HydrophobicContact CD1-CG2 4.4Å; L106-I160 HydrophobicContact CD1-CB 4.22Å; L106-I160 HydrophobicContact CD1-CG2 3.58Å |
| 107 | A | 83.3 | Confident | 73.2 | Confident | 66 Ų | 66 | 73.9 Ų | 73.9 | 55% | 0.545 | 42% | 0.415 | S | S | . | . | H | α-helix | trans | -66.3 | -44.7 | -176.5 | 0 | 0 | 0 | 0 | 0 | 112.6 | D105 L110 V111 | D105-A107 VanDerWaalsContact C-N 3.32Å; A107-L110 PolarHBondContact O-N 2.83Å; A107-V111 VanDerWaalsContact O-CG2 3.32Å; A107-V111 WeakPolarHBondContact O-CG2 3.42Å; A107-V111 PolarHBondContact O-N 2.91Å |
| 108 | G | 83.2 | Confident | 75.6 | Confident | 16 Ų | 16 | 73.3 Ų | 73.3 | 17% | 0.165 | 41% | 0.411 | C | S | . | . | H | α-helix | trans | -57.7 | -57.3 | 178.9 | 0 | 0 | 0 | 0 | 0 | 113.3 | L110 V111 F112 | G108-L110 VanDerWaalsContact C-N 3.26Å; G108-L110 PolarHBondContact O-N 2.86Å; G108-V111 PolarHBondContact O-N 2.89Å; G108-V111 VanDerWaalsContact O-N 3.09Å; G108-F112 WeakPolarHBondContact O-CD2 3.32Å; G108-F112 PolarHBondContact O-N 2.93Å |
| 109 | P | 87.3 | Confident | 77.6 | Confident | 7 Ų | 7 | 67.3 Ų | 67.3 | 5% | 0.045 | 38% | 0.383 | C | S | . | . | H | α-helix | trans | -50.8 | -41.7 | 174 | -31.2 | 37.2 | 0 | 0 | 0 | 114 | D105 F112 C113 I160 S161 Y165 | D105-P109 WeakPolarHBondContact O-CD 3.43Å; P109-F112 PolarHBondContact O-N 3.43Å; P109-C113 VanDerWaalsContact O-CB 3.28Å; P109-C113 WeakPolarHBondContact O-CB 3.19Å; P109-C113 PolarHBondContact O-N 2.91Å; P109-I160 HydrophobicContact CB-CG2 4.42Å; P109-S161 VanDerWaalsContact CG-CA 3.49Å; P109-Y165 HydrophobicContact CG-CD2 4.37Å; P109-Y165 HydrophobicContact CG-CE2 4.09Å |
| 110 | L | 88.5 | Confident | 79.6 | Confident | 106 Ų | 106 | 60.4 Ų | 60.4 | 56% | 0.555 | 35% | 0.351 | S | S | * | . | H | α-helix | trans | -65.1 | -46.7 | 177.9 | -172.2 | 162.1 | 0 | 0 | 0 | 110.8 | L106 A107 G108 F112 C113 L114 | L106-L110 WeakPolarHBondContact O-CB 3.41Å; L106-L110 PolarHBondContact O-N 3.36Å; A107-L110 PolarHBondContact O-N 2.83Å; G108-L110 VanDerWaalsContact C-N 3.26Å; G108-L110 PolarHBondContact O-N 2.86Å; L110-F112 PolarHBondContact O-N 3.33Å; L110-C113 PolarHBondContact O-N 2.96Å; L110-L114 WeakPolarHBondContact O-CB 3.36Å; L110-L114 PolarHBondContact O-N 3.21Å |
| 111 | V | 89.8 | Confident | 81.4 | Confident | 87 Ų | 87 | 61.5 Ų | 61.5 | 53% | 0.527 | 35% | 0.352 | S | S | . | . | H | α-helix | trans | -61.4 | -43.2 | 177.2 | 171 | 0 | 0 | 0 | 0 | 111.2 | A107 G108 L114 L115 | A107-V111 VanDerWaalsContact O-CG2 3.32Å; A107-V111 WeakPolarHBondContact O-CG2 3.42Å; A107-V111 PolarHBondContact O-N 2.91Å; G108-V111 PolarHBondContact O-N 2.89Å; G108-V111 VanDerWaalsContact O-N 3.09Å; V111-L114 PolarHBondContact O-N 3.38Å; V111-L115 VanDerWaalsContact O-CB 3.31Å; V111-L115 WeakPolarHBondContact O-CB 3.47Å; V111-L115 PolarHBondContact O-N 2.78Å |
| 112 | F | 89 | Confident | 83.1 | Confident | 44 Ų | 44 | 65.3 Ų | 65.3 | 19% | 0.193 | 37% | 0.372 | C | S | . | . | H | α-helix | trans | -66.4 | -38.1 | 176.2 | -63.5 | -50 | 0 | 0 | 0 | 112.6 | G108 P109 L110 L115 F116 Y165 L168 C171 | G108-F112 WeakPolarHBondContact O-CD2 3.32Å; G108-F112 PolarHBondContact O-N 2.93Å; P109-F112 PolarHBondContact O-N 3.43Å; L110-F112 PolarHBondContact O-N 3.33Å; F112-L115 PolarHBondContact O-N 2.86Å; F112-F116 VanDerWaalsContact O-CB 3.25Å; F112-F116 WeakPolarHBondContact O-CB 3.39Å; F112-F116 PolarHBondContact O-N 3.21Å; F112-Y165 HydrophobicContact CD2-CD1 4.27Å; F112-Y165 AromaticContact CE2-CD1 3.64Å; F112-Y165 HydrophobicContact CE2-CD1 3.64Å; F112-Y165 AromaticContact CE2-CE1 3.92Å; F112-Y165 HydrophobicContact CE2-CE1 3.92Å; F112-L168 HydrophobicContact CE1-CD1 3.96Å; F112-L168 HydrophobicContact CE1-CG 4.29Å; F112-L168 HydrophobicContact CZ-CD1 4.03Å; F112-C171 PolarHBondContact O-SG 3.11Å |
| 113 | C | 89.3 | Confident | 84.7 | Confident | 52 Ų | 52 | 60.9 Ų | 60.9 | 35% | 0.351 | 35% | 0.354 | S | S | . | . | H | α-helix | trans | -64.1 | -42 | 174 | -173.8 | 0 | 0 | 0 | 0 | 111.8 | P109 L110 F116 G117 | P109-C113 VanDerWaalsContact O-CB 3.28Å; P109-C113 WeakPolarHBondContact O-CB 3.19Å; P109-C113 PolarHBondContact O-N 2.91Å; L110-C113 PolarHBondContact O-N 2.96Å; C113-F116 PolarHBondContact O-N 3.5Å; C113-G117 PolarHBondContact O-N 2.83Å |
| 114 | L | 90.4 | Very high | 86 | Confident | 106 Ų | 106 | 58.3 Ų | 58.3 | 56% | 0.555 | 35% | 0.354 | S | S | * | . | H | α-helix | trans | -64 | -47.9 | 175.3 | -173 | 159.7 | 0 | 0 | 0 | 110.7 | L110 V111 F116 G117 C118 | L110-L114 WeakPolarHBondContact O-CB 3.36Å; L110-L114 PolarHBondContact O-N 3.21Å; V111-L114 PolarHBondContact O-N 3.38Å; L114-F116 VanDerWaalsContact C-N 3.32Å; L114-F116 PolarHBondContact O-N 2.82Å; L114-G117 PolarHBondContact O-N 3.38Å; L114-G117 VanDerWaalsContact O-N 3.16Å; L114-C118 VanDerWaalsContact CD2-SG 3.54Å; L114-C118 WeakPolarHBondContact O-CB 3.45Å; L114-C118 PolarHBondContact O-N 3.49Å; L114-C118 PolarHBondContact O-SG 3.22Å; L114-C118 VanDerWaalsContact O-SG 3.35Å |
| 115 | L | 91 | Very high | 86.9 | Confident | 83 Ų | 83 | 57.8 Ų | 57.8 | 44% | 0.435 | 35% | 0.348 | S | S | . | . | H | α-helix | trans | -55.7 | -48.6 | 176.5 | -174.2 | 82.2 | 0 | 0 | 0 | 110.7 | V111 F112 G117 C118 T119 C171 | V111-L115 VanDerWaalsContact O-CB 3.31Å; V111-L115 WeakPolarHBondContact O-CB 3.47Å; V111-L115 PolarHBondContact O-N 2.78Å; F112-L115 PolarHBondContact O-N 2.86Å; L115-G117 PolarHBondContact O-N 3.1Å; L115-C118 PolarHBondContact O-N 2.97Å; L115-T119 WeakPolarHBondContact O-CG2 3.49Å; L115-T119 PolarHBondContact O-N 3.46Å; L115-T119 PolarHBondContact O-OG1 3.4Å; L115-C171 HydrophobicContact CD2-CB 3.89Å |
| 116 | F | 92 | Very high | 86.8 | Confident | 1 Ų | 1 | 59.2 Ų | 59.2 | 0% | 0.004 | 35% | 0.354 | C | S | . | . | H | α-helix | trans | -58.5 | -44.4 | 175.7 | -178.8 | -109.7 | 0 | 0 | 0 | 112.5 | F112 C113 L114 T119 L120 I131 M170 F230 V234 | F112-F116 VanDerWaalsContact O-CB 3.25Å; F112-F116 WeakPolarHBondContact O-CB 3.39Å; F112-F116 PolarHBondContact O-N 3.21Å; C113-F116 PolarHBondContact O-N 3.5Å; L114-F116 VanDerWaalsContact C-N 3.32Å; L114-F116 PolarHBondContact O-N 2.82Å; F116-T119 WeakPolarHBondContact CA-OG1 3.32Å; F116-T119 PolarHBondContact O-N 3.31Å; F116-T119 PolarHBondContact O-OG1 3.02Å; F116-L120 HydrophobicContact CD1-CD1 3.88Å; F116-L120 HydrophobicContact CE1-CD1 3.43Å; F116-L120 VanDerWaalsContact CE1-CD1 3.43Å; F116-L120 HydrophobicContact CE1-CG 4.49Å; F116-L120 HydrophobicContact CE2-CD1 4.27Å; F116-L120 HydrophobicContact CG-CD1 4.47Å; F116-L120 HydrophobicContact CZ-CD1 3.66Å; F116-L120 HydrophobicContact CZ-CG 4.41Å; F116-L120 WeakPolarHBondContact O-CB 3.21Å; F116-L120 WeakPolarHBondContact O-CG 3.46Å; F116-L120 PolarHBondContact O-N 3.25Å; F116-I131 HydrophobicContact CD1-CG2 4.38Å; F116-M170 HydrophobicContact CE2-CG 3.92Å; F116-F230 AromaticContact CE1-CD1 3.79Å; F116-F230 HydrophobicContact CE1-CD1 3.79Å; F116-F230 HydrophobicContact CE1-CE1 4.45Å; F116-F230 HydrophobicContact CZ-CB 4.27Å; F116-F230 HydrophobicContact CZ-CD1 4.21Å; F116-V234 HydrophobicContact CE2-CG2 3.35Å; F116-V234 HydrophobicContact CZ-CG2 3.64Å |
| 117 | G | 91.4 | Very high | 86.6 | Confident | 17 Ų | 17 | 58.8 Ų | 58.8 | 18% | 0.175 | 35% | 0.35 | C | S | . | . | H | α-helix | trans | -64 | -40.8 | 175.2 | 0 | 0 | 0 | 0 | 0 | 112.8 | C113 L114 L115 L120 M121 | C113-G117 PolarHBondContact O-N 2.83Å; L114-G117 PolarHBondContact O-N 3.38Å; L114-G117 VanDerWaalsContact O-N 3.16Å; L115-G117 PolarHBondContact O-N 3.1Å; G117-L120 PolarHBondContact O-N 2.94Å; G117-M121 WeakPolarHBondContact O-CB 3.26Å; G117-M121 PolarHBondContact O-N 2.87Å |
| 118 | C | 90.4 | Very high | 86.4 | Confident | 53 Ų | 53 | 63.4 Ų | 63.4 | 36% | 0.358 | 36% | 0.358 | S | S | . | . | H | α-helix | trans | -65.1 | -42.2 | 175.9 | -74.2 | 0 | 0 | 0 | 0 | 112.1 | L114 L115 L120 M121 L122 | L114-C118 VanDerWaalsContact CD2-SG 3.54Å; L114-C118 WeakPolarHBondContact O-CB 3.45Å; L114-C118 PolarHBondContact O-N 3.49Å; L114-C118 PolarHBondContact O-SG 3.22Å; L114-C118 VanDerWaalsContact O-SG 3.35Å; L115-C118 PolarHBondContact O-N 2.97Å; C118-L120 VanDerWaalsContact C-N 3.35Å; C118-M121 PolarHBondContact O-N 3.42Å; C118-L122 WeakPolarHBondContact O-CG 3.44Å; C118-L122 PolarHBondContact O-N 2.94Å |
| 119 | T | 90.7 | Very high | 86.7 | Confident | 10 Ų | 10 | 68.5 Ų | 68.5 | 6% | 0.061 | 38% | 0.381 | C | S | . | . | H | α-helix | trans | -66.8 | -37.1 | 177.4 | 53.6 | 0 | 0 | 0 | 0 | 111.8 | L115 F116 L122 A123 S174 S175 I178 | L115-T119 WeakPolarHBondContact O-CG2 3.49Å; L115-T119 PolarHBondContact O-N 3.46Å; L115-T119 PolarHBondContact O-OG1 3.4Å; F116-T119 WeakPolarHBondContact CA-OG1 3.32Å; F116-T119 PolarHBondContact O-N 3.31Å; F116-T119 PolarHBondContact O-OG1 3.02Å; T119-L122 PolarHBondContact O-N 3.4Å; T119-A123 PolarHBondContact O-N 2.89Å; T119-S174 WeakPolarHBondContact CB-OG 3.3Å; T119-S174 VanDerWaalsContact OG1-CB 3.32Å; T119-S174 WeakPolarHBondContact OG1-CB 3.09Å; T119-S174 PolarHBondContact OG1-OG 3.24Å; T119-S175 WeakPolarHBondContact CG2-OG 3.12Å; T119-I178 HydrophobicContact CG2-CD1 4.49Å |
| 120 | L | 89.9 | Confident | 86.8 | Confident | 4 Ų | 4 | 74.7 Ų | 74.7 | 2% | 0.021 | 40% | 0.404 | C | S | . | . | H | α-helix | trans | -65.6 | -40.7 | 172.1 | -75.3 | 172.8 | 0 | 0 | 0 | 112.4 | F116 G117 C118 L122 A123 G124 K125 I131 L233 V234 | F116-L120 HydrophobicContact CD1-CD1 3.88Å; F116-L120 HydrophobicContact CE1-CD1 3.43Å; F116-L120 VanDerWaalsContact CE1-CD1 3.43Å; F116-L120 HydrophobicContact CE1-CG 4.49Å; F116-L120 HydrophobicContact CE2-CD1 4.27Å; F116-L120 HydrophobicContact CG-CD1 4.47Å; F116-L120 HydrophobicContact CZ-CD1 3.66Å; F116-L120 HydrophobicContact CZ-CG 4.41Å; F116-L120 WeakPolarHBondContact O-CB 3.21Å; F116-L120 WeakPolarHBondContact O-CG 3.46Å; F116-L120 PolarHBondContact O-N 3.25Å; G117-L120 PolarHBondContact O-N 2.94Å; C118-L120 VanDerWaalsContact C-N 3.35Å; L120-L122 VanDerWaalsContact C-N 3.35Å; L120-A123 WeakPolarHBondContact O-CB 3.37Å; L120-A123 PolarHBondContact O-N 3.29Å; L120-G124 PolarHBondContact O-N 2.9Å; L120-K125 HydrophobicContact CD2-CD 4.27Å; L120-K125 PolarHBondContact O-N 3.09Å; L120-I131 HydrophobicContact CD1-CD1 3.58Å; L120-I131 HydrophobicContact CD1-CG1 4.11Å; L120-L233 HydrophobicContact CD1-CB 4.47Å; L120-L233 WeakPolarHBondContact CD2-O 3.43Å; L120-V234 HydrophobicContact CD2-CG2 4Å |
| 121 | M | 89.3 | Confident | 86.9 | Confident | 111 Ų | 111 | 70.2 Ų | 70.2 | 55% | 0.547 | 38% | 0.381 | S | S | . | . | H | α-helix | trans | -62.4 | -42.5 | 176 | -168.6 | -170.7 | 78.8 | 0 | 0 | 111.4 | G117 C118 A123 G124 I126 | G117-M121 WeakPolarHBondContact O-CB 3.26Å; G117-M121 PolarHBondContact O-N 2.87Å; C118-M121 PolarHBondContact O-N 3.42Å; M121-A123 VanDerWaalsContact C-N 3.29Å; M121-A123 PolarHBondContact O-N 2.69Å; M121-G124 PolarHBondContact O-N 2.9Å; M121-I126 HydrophobicContact CG-CG1 4.31Å |
| 122 | L | 88.6 | Confident | 87 | Confident | 123 Ų | 123 | 73.5 Ų | 73.5 | 64% | 0.644 | 39% | 0.385 | S | S | * | . | H | α-helix | trans | -64.7 | -32 | 174.9 | -73.4 | 169.1 | 0 | 0 | 0 | 112.6 | C118 T119 L120 G124 I178 | C118-L122 WeakPolarHBondContact O-CG 3.44Å; C118-L122 PolarHBondContact O-N 2.94Å; T119-L122 PolarHBondContact O-N 3.4Å; L120-L122 VanDerWaalsContact C-N 3.35Å; L122-G124 PolarHBondContact O-N 2.96Å; L122-I178 HydrophobicContact CB-CD1 3.93Å; L122-I178 HydrophobicContact CD1-CD1 4.49Å |
| 123 | A | 85.7 | Confident | 87.2 | Confident | 40 Ų | 40 | 72.9 Ų | 72.9 | 33% | 0.331 | 39% | 0.392 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -72.9 | -2.2 | 171.8 | 0 | 0 | 0 | 0 | 0 | 113.6 | T119 L120 M121 I178 | T119-A123 PolarHBondContact O-N 2.89Å; L120-A123 WeakPolarHBondContact O-CB 3.37Å; L120-A123 PolarHBondContact O-N 3.29Å; M121-A123 VanDerWaalsContact C-N 3.29Å; M121-A123 PolarHBondContact O-N 2.69Å; A123-I178 HydrophobicContact CB-CG1 4.08Å |
| 124 | G | 82.3 | Confident | 87.3 | Confident | 61 Ų | 61 | 72.9 Ų | 72.9 | 63% | 0.629 | 39% | 0.388 | S | S | * | . | T | Hydrogen-bonded Turn | trans | 82.9 | 10.1 | -178 | 0 | 0 | 0 | 0 | 0 | 114.7 | L120 M121 L122 I126 | L120-G124 PolarHBondContact O-N 2.9Å; M121-G124 PolarHBondContact O-N 2.9Å; L122-G124 PolarHBondContact O-N 2.96Å; G124-I126 PolarHBondContact O-N 2.91Å |
| 125 | K | 78.5 | Confident | 87.4 | Confident | 36 Ų | 36 | 68.8 Ų | 68.8 | 16% | 0.157 | 37% | 0.371 | C | S | . | . | trans | -100.8 | 79.2 | -175.5 | -62.7 | -179 | 172.1 | -167.3 | 0 | 111.2 | L120 H127 L233 V234 V235 F236 | L120-K125 HydrophobicContact CD2-CD 4.27Å; L120-K125 PolarHBondContact O-N 3.09Å; K125-H127 VanDerWaalsContact C-N 3.35Å; K125-H127 PolarHBondContact O-N 3.48Å; K125-L233 WeakPolarHBondContact CD-O 3.27Å; K125-L233 PolarHBondContact NZ-O 2.93Å; K125-V234 VanDerWaalsContact NZ-C 3.27Å; K125-V234 PolarHBondContact NZ-O 3.06Å; K125-V235 PolarHBondContact NZ-O 2.94Å; K125-F236 WeakPolarHBondContact CD-OXT 3.05Å; K125-F236 VanDerWaalsContact CE-C 3.44Å; K125-F236 WeakPolarHBondContact CE-O 3.02Å; K125-F236 WeakPolarHBondContact CE-OXT 3.5Å; K125-F236 VanDerWaalsContact NZ-N 3.17Å; K125-F236 PolarHBondContact NZ-O 3.49Å; K125-F236 PolarHBondContact NZ-OXT 3.43Å | ||
| 126 | I | 71.6 | Confident | 87.6 | Confident | 130 Ų | 130 | 68.4 Ų | 68.4 | 67% | 0.667 | 37% | 0.372 | S | S | * | . | trans | -84.8 | 81.6 | -175.9 | -52.4 | 177.9 | 0 | 0 | 0 | 110 | M121 G124 | M121-I126 HydrophobicContact CG-CG1 4.31Å; G124-I126 PolarHBondContact O-N 2.91Å | ||
| 127 | H | 76.7 | Confident | 87.7 | Confident | 81 Ų | 81 | 75.6 Ų | 75.6 | 38% | 0.375 | 40% | 0.404 | S | S | . | . | trans | -120.1 | 46.6 | 178.9 | -72.8 | -42.3 | 0 | 0 | 0 | 110.9 | K125 N129 Y130 I131 | K125-H127 VanDerWaalsContact C-N 3.35Å; K125-H127 PolarHBondContact O-N 3.48Å; H127-N129 VanDerWaalsContact C-N 3.31Å; H127-N129 PolarHBondContact O-N 2.85Å; H127-Y130 HydrophobicContact CB-CD2 3.48Å; H127-Y130 VanDerWaalsContact CB-CD2 3.48Å; H127-Y130 HydrophobicContact CB-CE2 4.3Å; H127-Y130 HydrophobicContact CB-CG 4.12Å; H127-Y130 AromaticContact CG-CD2 3.7Å; H127-Y130 AromaticContact ND1-CD2 3.6Å; H127-Y130 AromaticContact ND1-CE2 3.49Å; H127-Y130 WeakPolarHBondContact ND1-CE2 3.25Å; H127-Y130 WeakPolarHBondContact O-CA 3.41Å; H127-Y130 WeakPolarHBondContact O-CB 3.46Å; H127-Y130 PolarHBondContact O-N 3.45Å; H127-I131 PolarHBondContact O-N 2.92Å; H127-I131 VanDerWaalsContact O-N 3.13Å | ||
| 128 | F | 79.7 | Confident | 87.9 | Confident | 163 Ų | 163 | 75.3 Ų | 75.3 | 72% | 0.715 | 40% | 0.4 | S | S | * | . | H | α-helix | trans | -54.4 | -44.5 | -174.6 | -171 | -95.7 | 0 | 0 | 0 | 112.8 | Y130 I131 Y132 | F128-Y130 VanDerWaalsContact C-N 3.29Å; F128-Y130 PolarHBondContact O-N 3.44Å; F128-I131 PolarHBondContact O-N 2.83Å; F128-Y132 PolarHBondContact O-N 3.34Å; F128-Y132 VanDerWaalsContact O-N 3.08Å |
| 129 | N | 88.4 | Confident | 88.1 | Confident | 123 Ų | 123 | 74.1 Ų | 74.1 | 66% | 0.658 | 39% | 0.392 | S | S | * | . | H | α-helix | trans | -62.5 | -35.9 | 176.5 | -172.9 | 24.5 | 0 | 0 | 0 | 112.4 | H127 Y132 G133 | H127-N129 VanDerWaalsContact C-N 3.31Å; H127-N129 PolarHBondContact O-N 2.85Å; N129-Y132 PolarHBondContact O-N 3.26Å; N129-G133 PolarHBondContact O-N 2.92Å |
| 130 | Y | 90.3 | Very high | 88.4 | Confident | 137 Ų | 137 | 77.6 Ų | 77.6 | 54% | 0.537 | 41% | 0.41 | S | S | . | . | H | α-helix | trans | -66.5 | -43.4 | 177.7 | -67.6 | -88.9 | 0 | 0 | 0 | 111.3 | H127 F128 Y132 G133 L134 | H127-Y130 HydrophobicContact CB-CD2 3.48Å; H127-Y130 VanDerWaalsContact CB-CD2 3.48Å; H127-Y130 HydrophobicContact CB-CE2 4.3Å; H127-Y130 HydrophobicContact CB-CG 4.12Å; H127-Y130 AromaticContact CG-CD2 3.7Å; H127-Y130 AromaticContact ND1-CD2 3.6Å; H127-Y130 AromaticContact ND1-CE2 3.49Å; H127-Y130 WeakPolarHBondContact ND1-CE2 3.25Å; H127-Y130 WeakPolarHBondContact O-CA 3.41Å; H127-Y130 WeakPolarHBondContact O-CB 3.46Å; H127-Y130 PolarHBondContact O-N 3.45Å; F128-Y130 VanDerWaalsContact C-N 3.29Å; F128-Y130 PolarHBondContact O-N 3.44Å; Y130-Y132 PolarHBondContact O-N 3.1Å; Y130-G133 PolarHBondContact O-N 3.24Å; Y130-L134 WeakPolarHBondContact O-CB 3.36Å; Y130-L134 WeakPolarHBondContact O-CD1 3.28Å; Y130-L134 WeakPolarHBondContact O-CG 3.44Å; Y130-L134 PolarHBondContact O-N 3.48Å |
| 131 | I | 90.5 | Very high | 88.6 | Confident | 12 Ų | 12 | 79 Ų | 79 | 6% | 0.062 | 43% | 0.426 | C | S | . | . | H | α-helix | trans | -61.4 | -47.1 | 178.1 | -59.4 | 166.4 | 0 | 0 | 0 | 110 | F116 L120 H127 F128 G135 L233 | F116-I131 HydrophobicContact CD1-CG2 4.38Å; L120-I131 HydrophobicContact CD1-CD1 3.58Å; L120-I131 HydrophobicContact CD1-CG1 4.11Å; H127-I131 PolarHBondContact O-N 2.92Å; H127-I131 VanDerWaalsContact O-N 3.13Å; F128-I131 PolarHBondContact O-N 2.83Å; I131-G135 WeakPolarHBondContact O-CA 3.31Å; I131-G135 PolarHBondContact O-N 2.89Å; I131-L233 HydrophobicContact CG1-CD1 4Å |
| 132 | Y | 90.3 | Very high | 88.9 | Confident | 156 Ų | 156 | 73.9 Ų | 73.9 | 61% | 0.612 | 40% | 0.401 | S | S | * | . | H | α-helix | trans | -63.6 | -49.9 | 178.2 | 178.9 | -106.3 | 0 | 0 | 0 | 112 | F128 N129 Y130 G135 V136 | F128-Y132 PolarHBondContact O-N 3.34Å; F128-Y132 VanDerWaalsContact O-N 3.08Å; N129-Y132 PolarHBondContact O-N 3.26Å; Y130-Y132 PolarHBondContact O-N 3.1Å; Y132-G135 PolarHBondContact O-N 3.08Å; Y132-V136 HydrophobicContact CD2-CG2 4.21Å; Y132-V136 HydrophobicContact CE1-CG2 4.36Å; Y132-V136 HydrophobicContact CE2-CG2 3.83Å; Y132-V136 WeakPolarHBondContact O-CG2 3.47Å; Y132-V136 PolarHBondContact O-N 3.26Å |
| 133 | G | 93.2 | Very high | 89.2 | Confident | 32 Ų | 32 | 71.5 Ų | 71.5 | 33% | 0.33 | 38% | 0.384 | S | S | . | . | H | α-helix | trans | -63.1 | -45.7 | -179.6 | 0 | 0 | 0 | 0 | 0 | 112.9 | N129 Y130 F137 | N129-G133 PolarHBondContact O-N 2.92Å; Y130-G133 PolarHBondContact O-N 3.24Å; G133-F137 WeakPolarHBondContact O-CB 3.37Å; G133-F137 PolarHBondContact O-N 3.43Å |
| 134 | L | 92.8 | Very high | 89.6 | Confident | 52 Ų | 52 | 74.2 Ų | 74.2 | 27% | 0.272 | 39% | 0.392 | S | S | . | . | H | α-helix | trans | -69.4 | -35 | 177.4 | -69.6 | 166.9 | 0 | 0 | 0 | 112.1 | Y130 G138 V229 L233 | Y130-L134 WeakPolarHBondContact O-CB 3.36Å; Y130-L134 WeakPolarHBondContact O-CD1 3.28Å; Y130-L134 WeakPolarHBondContact O-CG 3.44Å; Y130-L134 PolarHBondContact O-N 3.48Å; L134-G138 VanDerWaalsContact O-CA 3.3Å; L134-G138 WeakPolarHBondContact O-CA 3.35Å; L134-G138 PolarHBondContact O-N 3.46Å; L134-V229 HydrophobicContact CD1-CG1 3.55Å; L134-V229 HydrophobicContact CD2-CG1 3.56Å; L134-V229 HydrophobicContact CG-CG1 4.05Å; L134-L233 HydrophobicContact CD1-CD1 3.84Å; L134-L233 HydrophobicContact CD1-CD2 4.34Å; L134-L233 HydrophobicContact CD1-CG 4.25Å |
| 135 | G | 92.9 | Very high | 90.2 | Very high | 20 Ų | 20 | 74.1 Ų | 74.1 | 21% | 0.206 | 38% | 0.377 | C | S | . | . | H | α-helix | trans | -63.5 | -52.1 | 173.4 | 0 | 0 | 0 | 0 | 0 | 112.1 | I131 Y132 C139 | I131-G135 WeakPolarHBondContact O-CA 3.31Å; I131-G135 PolarHBondContact O-N 2.89Å; Y132-G135 PolarHBondContact O-N 3.08Å; G135-C139 VanDerWaalsContact O-CB 3.31Å; G135-C139 WeakPolarHBondContact O-CB 3.13Å; G135-C139 PolarHBondContact O-N 2.99Å; G135-C139 PolarHBondContact O-SG 2.81Å |
| 136 | V | 94 | Very high | 90.8 | Very high | 74 Ų | 74 | 72.4 Ų | 72.4 | 45% | 0.448 | 37% | 0.37 | S | S | . | . | H | α-helix | trans | -64.8 | -49.4 | 178.8 | 174.1 | 0 | 0 | 0 | 0 | 110.9 | Y132 C139 L140 | Y132-V136 HydrophobicContact CD2-CG2 4.21Å; Y132-V136 HydrophobicContact CE1-CG2 4.36Å; Y132-V136 HydrophobicContact CE2-CG2 3.83Å; Y132-V136 WeakPolarHBondContact O-CG2 3.47Å; Y132-V136 PolarHBondContact O-N 3.26Å; V136-C139 PolarHBondContact O-N 3.37Å; V136-L140 WeakPolarHBondContact O-CB 3.31Å; V136-L140 PolarHBondContact O-N 3.12Å |
| 137 | F | 95.4 | Very high | 91.8 | Very high | 153 Ų | 153 | 68.7 Ų | 68.7 | 67% | 0.671 | 36% | 0.355 | S | S | * | . | H | α-helix | trans | -67.4 | -37.3 | -178.8 | -171.8 | -99.9 | 0 | 0 | 0 | 112.4 | G133 L140 G141 | G133-F137 WeakPolarHBondContact O-CB 3.37Å; G133-F137 PolarHBondContact O-N 3.43Å; F137-L140 PolarHBondContact O-N 3.47Å; F137-G141 PolarHBondContact O-N 3.19Å |
| 138 | G | 95.1 | Very high | 92.5 | Very high | 10 Ų | 10 | 71 Ų | 71 | 10% | 0.103 | 38% | 0.375 | C | S | . | . | H | α-helix | trans | -64.7 | -47.7 | 174.3 | 0 | 0 | 0 | 0 | 0 | 112 | L134 G141 I142 | L134-G138 VanDerWaalsContact O-CA 3.3Å; L134-G138 WeakPolarHBondContact O-CA 3.35Å; L134-G138 PolarHBondContact O-N 3.46Å; G138-G141 PolarHBondContact O-N 3.06Å; G138-I142 WeakPolarHBondContact O-CB 3.15Å; G138-I142 WeakPolarHBondContact O-CG1 3.35Å; G138-I142 PolarHBondContact O-N 2.89Å |
| 139 | C | 94.5 | Very high | 93 | Very high | 28 Ų | 28 | 64.9 Ų | 64.9 | 19% | 0.189 | 35% | 0.349 | C | S | . | . | H | α-helix | trans | -62.4 | -43.7 | 174.9 | -67.1 | 0 | 0 | 0 | 0 | 111.5 | G135 V136 I142 Y143 V159 I160 | G135-C139 VanDerWaalsContact O-CB 3.31Å; G135-C139 WeakPolarHBondContact O-CB 3.13Å; G135-C139 PolarHBondContact O-N 2.99Å; G135-C139 PolarHBondContact O-SG 2.81Å; V136-C139 PolarHBondContact O-N 3.37Å; C139-I142 PolarHBondContact O-N 3.28Å; C139-Y143 WeakPolarHBondContact O-CB 3.32Å; C139-Y143 PolarHBondContact O-N 3.49Å; C139-V159 HydrophobicContact CB-CG1 4.45Å; C139-I160 HydrophobicContact CB-CG1 4.22Å |
| 140 | L | 96 | Very high | 92.8 | Very high | 83 Ų | 83 | 59.5 Ų | 59.5 | 44% | 0.435 | 32% | 0.32 | S | S | . | . | H | α-helix | trans | -62.9 | -46.7 | 178.1 | -179.4 | 64.9 | 0 | 0 | 0 | 111.7 | V136 F137 I142 Y143 L144 | V136-L140 WeakPolarHBondContact O-CB 3.31Å; V136-L140 PolarHBondContact O-N 3.12Å; F137-L140 PolarHBondContact O-N 3.47Å; L140-I142 PolarHBondContact O-N 3.48Å; L140-Y143 HydrophobicContact CD1-CD1 4.5Å; L140-Y143 WeakPolarHBondContact O-CB 3.5Å; L140-Y143 PolarHBondContact O-N 3.02Å; L140-L144 HydrophobicContact CD1-CD1 4.43Å; L140-L144 HydrophobicContact CD1-CG 4.33Å; L140-L144 HydrophobicContact CG-CD1 4.28Å; L140-L144 WeakPolarHBondContact O-CG 3.19Å; L140-L144 PolarHBondContact O-N 3.35Å |
| 141 | G | 95 | Very high | 92.4 | Very high | 35 Ų | 35 | 59.4 Ų | 59.4 | 36% | 0.361 | 34% | 0.336 | S | S | . | . | H | α-helix | trans | -61.4 | -44.3 | 178.4 | 0 | 0 | 0 | 0 | 0 | 112.2 | F137 G138 L145 | F137-G141 PolarHBondContact O-N 3.19Å; G138-G141 PolarHBondContact O-N 3.06Å; G141-L145 VanDerWaalsContact O-CB 3.32Å; G141-L145 WeakPolarHBondContact O-CB 3.17Å; G141-L145 PolarHBondContact O-N 3.08Å; G141-L145 VanDerWaalsContact O-N 3.08Å |
| 142 | I | 94.8 | Very high | 92 | Very high | 3 Ų | 3 | 68.8 Ų | 68.8 | 2% | 0.015 | 37% | 0.371 | C | S | . | . | H | α-helix | trans | -63.7 | -46.7 | 174.3 | -65.9 | -73.9 | 0 | 0 | 0 | 110.4 | G138 C139 L140 L144 L145 L146 V159 L163 F206 P222 V226 | G138-I142 WeakPolarHBondContact O-CB 3.15Å; G138-I142 WeakPolarHBondContact O-CG1 3.35Å; G138-I142 PolarHBondContact O-N 2.89Å; C139-I142 PolarHBondContact O-N 3.28Å; L140-I142 PolarHBondContact O-N 3.48Å; I142-L144 PolarHBondContact O-N 3.24Å; I142-L145 PolarHBondContact O-N 3.09Å; I142-L146 HydrophobicContact CG2-CD1 3.83Å; I142-L146 HydrophobicContact CG2-CD2 3.93Å; I142-L146 HydrophobicContact CG2-CG 4.47Å; I142-L146 WeakPolarHBondContact O-CB 3.47Å; I142-L146 VanDerWaalsContact O-CD1 3.32Å; I142-L146 WeakPolarHBondContact O-CD1 3.22Å; I142-L146 PolarHBondContact O-N 2.79Å; I142-V159 HydrophobicContact CB-CG1 3.94Å; I142-V159 HydrophobicContact CG2-CG1 3.56Å; I142-V159 HydrophobicContact CG2-CG2 4.4Å; I142-L163 HydrophobicContact CB-CD1 4.38Å; I142-L163 HydrophobicContact CG1-CD1 4.21Å; I142-L163 HydrophobicContact CG2-CD1 4.46Å; I142-F206 HydrophobicContact CG2-CE2 4.24Å; I142-F206 HydrophobicContact CG2-CZ 4.04Å; I142-P222 HydrophobicContact CD1-CB 3.59Å; I142-P222 HydrophobicContact CD1-CG 3.97Å; I142-V226 HydrophobicContact CD1-CG2 4.28Å; I142-V226 HydrophobicContact CG1-CG2 3.99Å |
| 143 | Y | 95.1 | Very high | 91.7 | Very high | 72 Ų | 72 | 63.3 Ų | 63.3 | 28% | 0.282 | 36% | 0.361 | S | S | . | . | H | α-helix | trans | -56.3 | -48.5 | 178 | 170.4 | -102.1 | 0 | 0 | 0 | 112.5 | C139 L140 L145 L146 S147 V154 P156 V159 | C139-Y143 WeakPolarHBondContact O-CB 3.32Å; C139-Y143 PolarHBondContact O-N 3.49Å; L140-Y143 HydrophobicContact CD1-CD1 4.5Å; L140-Y143 WeakPolarHBondContact O-CB 3.5Å; L140-Y143 PolarHBondContact O-N 3.02Å; Y143-L145 PolarHBondContact O-N 3.39Å; Y143-L146 PolarHBondContact O-N 3.01Å; Y143-S147 WeakPolarHBondContact O-CB 3.04Å; Y143-S147 PolarHBondContact O-N 3.48Å; Y143-V154 HydrophobicContact CD2-CG1 4.42Å; Y143-V154 WeakPolarHBondContact CE2-O 3.44Å; Y143-P156 HydrophobicContact CD2-CB 4.04Å; Y143-P156 HydrophobicContact CE2-CB 4.07Å; Y143-P156 HydrophobicContact CE2-CG 4.44Å; Y143-V159 HydrophobicContact CD2-CG2 4.48Å |
| 144 | L | 94.7 | Very high | 91.5 | Very high | 97 Ų | 97 | 62.4 Ų | 62.4 | 51% | 0.508 | 35% | 0.35 | S | S | . | . | H | α-helix | trans | -62.3 | -44 | 178 | -69.4 | 176.5 | 0 | 0 | 0 | 111.7 | L140 I142 S147 V148 | L140-L144 HydrophobicContact CD1-CD1 4.43Å; L140-L144 HydrophobicContact CD1-CG 4.33Å; L140-L144 HydrophobicContact CG-CD1 4.28Å; L140-L144 WeakPolarHBondContact O-CG 3.19Å; L140-L144 PolarHBondContact O-N 3.35Å; I142-L144 PolarHBondContact O-N 3.24Å; L144-S147 PolarHBondContact O-N 3.19Å; L144-V148 WeakPolarHBondContact O-CG2 3.42Å; L144-V148 PolarHBondContact O-N 3.29Å; L144-V148 VanDerWaalsContact O-N 3.1Å |
| 145 | L | 93.9 | Very high | 91.4 | Very high | 60 Ų | 60 | 63.8 Ų | 63.8 | 31% | 0.314 | 36% | 0.36 | S | S | . | . | H | α-helix | trans | -63.2 | -49.4 | 180 | -161.4 | 174.3 | 0 | 0 | 0 | 110.6 | G141 I142 Y143 S147 V148 M149 P222 | G141-L145 VanDerWaalsContact O-CB 3.32Å; G141-L145 WeakPolarHBondContact O-CB 3.17Å; G141-L145 PolarHBondContact O-N 3.08Å; G141-L145 VanDerWaalsContact O-N 3.08Å; I142-L145 PolarHBondContact O-N 3.09Å; Y143-L145 PolarHBondContact O-N 3.39Å; L145-S147 VanDerWaalsContact C-N 3.34Å; L145-S147 PolarHBondContact O-N 3.39Å; L145-V148 PolarHBondContact O-N 2.9Å; L145-M149 HydrophobicContact CD2-CG 3.8Å; L145-M149 HydrophobicContact CD2-SD 3.12Å; L145-M149 WeakPolarHBondContact CD2-SD 3.32Å; L145-M149 WeakPolarHBondContact O-CB 3.45Å; L145-M149 WeakPolarHBondContact O-CG 3.49Å; L145-M149 PolarHBondContact O-N 3.17Å; L145-P222 HydrophobicContact CD1-CB 3.6Å; L145-P222 HydrophobicContact CD1-CG 3.6Å |
| 146 | L | 92.5 | Very high | 91.3 | Very high | 0 Ų | 0 | 66 Ų | 66 | 0% | 0 | 37% | 0.371 | C | S | . | . | H | α-helix | trans | -63.4 | -39.9 | 177.6 | -90.6 | 57.3 | 0 | 0 | 0 | 111.7 | I142 Y143 V148 M149 T150 V154 V159 F206 L210 V219 | I142-L146 HydrophobicContact CG2-CD1 3.83Å; I142-L146 HydrophobicContact CG2-CD2 3.93Å; I142-L146 HydrophobicContact CG2-CG 4.47Å; I142-L146 WeakPolarHBondContact O-CB 3.47Å; I142-L146 VanDerWaalsContact O-CD1 3.32Å; I142-L146 WeakPolarHBondContact O-CD1 3.22Å; I142-L146 PolarHBondContact O-N 2.79Å; Y143-L146 PolarHBondContact O-N 3.01Å; L146-V148 PolarHBondContact O-N 3.3Å; L146-M149 PolarHBondContact O-N 2.85Å; L146-M149 VanDerWaalsContact O-N 3.09Å; L146-T150 WeakPolarHBondContact O-CG2 3.3Å; L146-T150 PolarHBondContact O-N 2.98Å; L146-V154 HydrophobicContact CB-CB 4.4Å; L146-V154 HydrophobicContact CB-CG1 4.35Å; L146-V154 HydrophobicContact CB-CG2 3.72Å; L146-V154 HydrophobicContact CD2-CG1 4.39Å; L146-V159 HydrophobicContact CD2-CG2 4.05Å; L146-F206 HydrophobicContact CD2-CD1 3.63Å; L146-F206 HydrophobicContact CD2-CE1 3.7Å; L146-F206 HydrophobicContact CD2-CG 4.09Å; L146-F206 HydrophobicContact CD2-CZ 4.19Å; L146-L210 HydrophobicContact CB-CD1 4.32Å; L146-L210 HydrophobicContact CD2-CD1 3.64Å; L146-L210 HydrophobicContact CG-CD1 3.8Å; L146-V219 HydrophobicContact CD1-CG1 4.34Å |
| 147 | S | 92.4 | Very high | 91.2 | Very high | 51 Ų | 51 | 65 Ų | 65 | 36% | 0.357 | 37% | 0.365 | S | S | . | . | H | α-helix | trans | -63.3 | -28.5 | 177 | -173.4 | 0 | 0 | 0 | 0 | 112.9 | Y143 L144 L145 | Y143-S147 WeakPolarHBondContact O-CB 3.04Å; Y143-S147 PolarHBondContact O-N 3.48Å; L144-S147 PolarHBondContact O-N 3.19Å; L145-S147 VanDerWaalsContact C-N 3.34Å; L145-S147 PolarHBondContact O-N 3.39Å |
| 148 | V | 92 | Very high | 90.9 | Very high | 131 Ų | 131 | 58.3 Ų | 58.3 | 79% | 0.794 | 34% | 0.337 | S | S | * | . | H | α-helix | trans | -81.2 | -31.7 | 173.3 | 171.9 | 0 | 0 | 0 | 0 | 111.4 | L144 L145 L146 | L144-V148 WeakPolarHBondContact O-CG2 3.42Å; L144-V148 PolarHBondContact O-N 3.29Å; L144-V148 VanDerWaalsContact O-N 3.1Å; L145-V148 PolarHBondContact O-N 2.9Å; L146-V148 PolarHBondContact O-N 3.3Å |
| 149 | M | 89.6 | Confident | 90.8 | Very high | 34 Ų | 34 | 57.9 Ų | 57.9 | 17% | 0.167 | 33% | 0.333 | C | S | . | . | H | α-helix | trans | -78.3 | -33.2 | -175.7 | -85.4 | -173.6 | 62.7 | 0 | 0 | 114.4 | L145 L146 M212 Q215 L218 V219 | L145-M149 HydrophobicContact CD2-CG 3.8Å; L145-M149 HydrophobicContact CD2-SD 3.12Å; L145-M149 WeakPolarHBondContact CD2-SD 3.32Å; L145-M149 WeakPolarHBondContact O-CB 3.45Å; L145-M149 WeakPolarHBondContact O-CG 3.49Å; L145-M149 PolarHBondContact O-N 3.17Å; L146-M149 PolarHBondContact O-N 2.85Å; L146-M149 VanDerWaalsContact O-N 3.09Å; M149-M212 HydrophobicContact CB-CE 3.91Å; M149-M212 HydrophobicContact CB-SD 4.25Å; M149-M212 HydrophobicContact CE-CE 3.38Å; M149-M212 HydrophobicContact CE-SD 4.08Å; M149-Q215 HydrophobicContact CE-CB 4.15Å; M149-L218 HydrophobicContact CE-CB 4.05Å; M149-L218 HydrophobicContact CE-CD2 3.45Å; M149-L218 VanDerWaalsContact CE-CD2 3.45Å; M149-L218 HydrophobicContact CE-CG 3.77Å; M149-L218 HydrophobicContact CG-CD2 4.43Å; M149-L218 HydrophobicContact SD-CD2 3.72Å; M149-L218 HydrophobicContact SD-CG 3.83Å; M149-V219 HydrophobicContact CE-CG2 3.63Å; M149-V219 HydrophobicContact SD-CG2 4.35Å |
| 150 | T | 85 | Confident | 90.7 | Very high | 9 Ų | 9 | 59.6 Ų | 59.6 | 6% | 0.055 | 34% | 0.339 | C | S | . | . | trans | -107.5 | 128.9 | -177.3 | 179.5 | 0 | 0 | 0 | 0 | 112.9 | L146 R152 G153 V154 L210 | L146-T150 WeakPolarHBondContact O-CG2 3.3Å; L146-T150 PolarHBondContact O-N 2.98Å; T150-R152 PolarHBondContact O-N 3.44Å; T150-R152 PolarHBondContact OG1-N 3.39Å; T150-G153 PolarHBondContact O-N 3.31Å; T150-V154 HydrophobicContact CG2-CG2 3.2Å; T150-L210 HydrophobicContact CG2-CD2 4.12Å | ||
| 151 | P | 81.1 | Confident | 90.4 | Very high | 135 Ų | 135 | 55.9 Ų | 55.9 | 88% | 0.877 | 32% | 0.32 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -69.8 | -16.7 | 174.9 | 28.6 | -34.1 | 0 | 0 | 0 | 112.9 | G153 | P151-G153 VanDerWaalsContact C-N 3.33Š|
| 152 | R | 81.3 | Confident | 90.2 | Very high | 210 Ų | 210 | 54.5 Ų | 54.5 | 79% | 0.792 | 31% | 0.305 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -85.9 | -6.1 | -176.8 | -57.7 | -177.4 | 73.8 | 137 | 0.5 | 113.3 | T150 | T150-R152 PolarHBondContact O-N 3.44Å; T150-R152 PolarHBondContact OG1-N 3.39Å |
| 153 | G | 84 | Confident | 90.1 | Very high | 40 Ų | 40 | 54.8 Ų | 54.8 | 41% | 0.412 | 31% | 0.306 | S | S | . | . | trans | 75.1 | 161 | -171.8 | 0 | 0 | 0 | 0 | 0 | 112.8 | T150 P151 | T150-G153 PolarHBondContact O-N 3.31Å; P151-G153 VanDerWaalsContact C-N 3.33Å | ||
| 154 | V | 89.9 | Confident | 90 | Very high | 14 Ų | 14 | 51.6 Ų | 51.6 | 9% | 0.085 | 30% | 0.296 | C | S | . | . | trans | -125.4 | 138.2 | 178.1 | 176.6 | 0 | 0 | 0 | 0 | 108.6 | Y143 L146 T150 V159 L210 | Y143-V154 HydrophobicContact CD2-CG1 4.42Å; Y143-V154 WeakPolarHBondContact CE2-O 3.44Å; L146-V154 HydrophobicContact CB-CB 4.4Å; L146-V154 HydrophobicContact CB-CG1 4.35Å; L146-V154 HydrophobicContact CB-CG2 3.72Å; L146-V154 HydrophobicContact CD2-CG1 4.39Å; T150-V154 HydrophobicContact CG2-CG2 3.2Å; V154-V159 HydrophobicContact CG1-CG2 3.58Å; V154-L210 HydrophobicContact CB-CD2 4.37Å; V154-L210 HydrophobicContact CG1-CD2 4.5Å; V154-L210 HydrophobicContact CG2-CD1 3.91Å; V154-L210 HydrophobicContact CG2-CD2 3.43Å; V154-L210 VanDerWaalsContact CG2-CD2 3.43Å; V154-L210 HydrophobicContact CG2-CG 4.33Å | ||
| 155 | T | 90.9 | Very high | 89.7 | Confident | 81 Ų | 81 | 51.4 Ų | 51.4 | 50% | 0.497 | 29% | 0.289 | S | S | . | . | trans | -83.4 | 134.3 | 170.7 | 59.4 | 0 | 0 | 0 | 0 | 109.4 | T157 C158 V159 | T155-T157 PolarHBondContact O-N 3.1Å; T155-C158 WeakPolarHBondContact O-CB 3.48Å; T155-C158 PolarHBondContact O-N 2.93Å; T155-C158 VanDerWaalsContact O-N 3.09Å; T155-C158 WeakPolarHBondContact OG1-CB 3.33Å; T155-C158 PolarHBondContact OG1-N 3.31Å; T155-V159 PolarHBondContact O-N 3.3Å | ||
| 156 | P | 91.3 | Very high | 89.5 | Confident | 65 Ų | 65 | 48.9 Ų | 48.9 | 42% | 0.422 | 28% | 0.276 | S | S | . | . | H | α-helix | trans | -60.1 | -32.5 | 177.2 | 24.7 | -33.5 | 0 | 0 | 0 | 111.4 | Y143 C158 V159 I160 | Y143-P156 HydrophobicContact CD2-CB 4.04Å; Y143-P156 HydrophobicContact CE2-CB 4.07Å; Y143-P156 HydrophobicContact CE2-CG 4.44Å; P156-C158 VanDerWaalsContact C-N 3.35Å; P156-C158 PolarHBondContact O-N 3.05Å; P156-V159 PolarHBondContact O-N 2.73Å; P156-I160 WeakPolarHBondContact O-CG1 3.3Å; P156-I160 PolarHBondContact O-N 3.2Å |
| 157 | T | 90.4 | Very high | 89.4 | Confident | 55 Ų | 55 | 49.5 Ų | 49.5 | 34% | 0.337 | 28% | 0.279 | S | S | . | . | H | α-helix | trans | -61.6 | -40.5 | 175.6 | -32.1 | 0 | 0 | 0 | 0 | 111.8 | T104 L106 T155 V159 I160 S161 | T104-T157 HydrophobicContact CG2-CG2 3.28Å; L106-T157 HydrophobicContact CD1-CG2 4.4Å; T155-T157 PolarHBondContact O-N 3.1Å; T157-V159 VanDerWaalsContact C-N 3.31Å; T157-V159 PolarHBondContact O-N 3.24Å; T157-I160 PolarHBondContact O-N 2.98Å; T157-S161 VanDerWaalsContact O-CB 3.31Å; T157-S161 WeakPolarHBondContact O-CB 3.32Å; T157-S161 PolarHBondContact O-N 3.43Å; T157-S161 PolarHBondContact O-OG 2.97Å |
| 158 | C | 89.5 | Confident | 89.2 | Confident | 12 Ų | 12 | 48.9 Ų | 48.9 | 8% | 0.081 | 27% | 0.272 | C | S | . | . | H | α-helix | trans | -60.1 | -41.4 | 174.9 | 175.3 | 0 | 0 | 0 | 0 | 111.7 | T155 P156 T162 | T155-C158 WeakPolarHBondContact O-CB 3.48Å; T155-C158 PolarHBondContact O-N 2.93Å; T155-C158 VanDerWaalsContact O-N 3.09Å; T155-C158 WeakPolarHBondContact OG1-CB 3.33Å; T155-C158 PolarHBondContact OG1-N 3.31Å; P156-C158 VanDerWaalsContact C-N 3.35Å; P156-C158 PolarHBondContact O-N 3.05Å; C158-T162 WeakPolarHBondContact O-CB 3.4Å; C158-T162 PolarHBondContact O-N 3.28Å; C158-T162 PolarHBondContact O-OG1 3.25Å |
| 159 | V | 93 | Very high | 89.1 | Confident | 1 Ų | 1 | 43.6 Ų | 43.6 | 1% | 0.006 | 24% | 0.24 | C | C | . | . | H | α-helix | trans | -64.9 | -50.5 | 177.4 | 177 | 0 | 0 | 0 | 0 | 111.3 | C139 I142 Y143 L146 V154 T155 P156 T157 S161 T162 L163 F206 | C139-V159 HydrophobicContact CB-CG1 4.45Å; I142-V159 HydrophobicContact CB-CG1 3.94Å; I142-V159 HydrophobicContact CG2-CG1 3.56Å; I142-V159 HydrophobicContact CG2-CG2 4.4Å; Y143-V159 HydrophobicContact CD2-CG2 4.48Å; L146-V159 HydrophobicContact CD2-CG2 4.05Å; V154-V159 HydrophobicContact CG1-CG2 3.58Å; T155-V159 PolarHBondContact O-N 3.3Å; P156-V159 PolarHBondContact O-N 2.73Å; T157-V159 VanDerWaalsContact C-N 3.31Å; T157-V159 PolarHBondContact O-N 3.24Å; V159-S161 VanDerWaalsContact C-N 3.32Å; V159-S161 PolarHBondContact O-N 2.85Å; V159-T162 PolarHBondContact O-N 3.46Å; V159-L163 HydrophobicContact CG1-CD1 3.78Å; V159-L163 HydrophobicContact CG1-CG 4.35Å; V159-L163 WeakPolarHBondContact O-CB 3.37Å; V159-L163 VanDerWaalsContact O-CG 3.29Å; V159-L163 WeakPolarHBondContact O-CG 3.28Å; V159-L163 PolarHBondContact O-N 3.18Å; V159-F206 HydrophobicContact CB-CE1 4.48Å; V159-F206 HydrophobicContact CG1-CZ 4.32Å; V159-F206 HydrophobicContact CG2-CE1 4.19Å |
| 160 | I | 92.6 | Very high | 89.2 | Confident | 63 Ų | 63 | 42 Ų | 42 | 32% | 0.323 | 23% | 0.232 | S | C | . | . | H | α-helix | trans | -61.2 | -44.7 | -179.3 | -63.8 | 162.8 | 0 | 0 | 0 | 110.1 | L106 P109 C139 P156 T157 G164 | L106-I160 HydrophobicContact CD1-CB 4.22Å; L106-I160 HydrophobicContact CD1-CG2 3.58Å; P109-I160 HydrophobicContact CB-CG2 4.42Å; C139-I160 HydrophobicContact CB-CG1 4.22Å; P156-I160 WeakPolarHBondContact O-CG1 3.3Å; P156-I160 PolarHBondContact O-N 3.2Å; T157-I160 PolarHBondContact O-N 2.98Å; I160-G164 PolarHBondContact O-N 3.2Å |
| 161 | S | 90.2 | Very high | 89.6 | Confident | 6 Ų | 6 | 41.7 Ų | 41.7 | 4% | 0.042 | 23% | 0.231 | C | C | . | . | H | α-helix | trans | -66.7 | -49.2 | -179.9 | -65.5 | 0 | 0 | 0 | 0 | 112.3 | T104 D105 P109 T157 V159 L163 G164 Y165 | T104-S161 VanDerWaalsContact CG2-OG 3.25Å; T104-S161 WeakPolarHBondContact CG2-OG 3.11Å; D105-S161 PolarHBondContact O-OG 3.46Å; P109-S161 VanDerWaalsContact CG-CA 3.49Å; T157-S161 VanDerWaalsContact O-CB 3.31Å; T157-S161 WeakPolarHBondContact O-CB 3.32Å; T157-S161 PolarHBondContact O-N 3.43Å; T157-S161 PolarHBondContact O-OG 2.97Å; V159-S161 VanDerWaalsContact C-N 3.32Å; V159-S161 PolarHBondContact O-N 2.85Å; S161-L163 VanDerWaalsContact C-N 3.34Å; S161-L163 PolarHBondContact O-N 3.36Å; S161-G164 PolarHBondContact O-N 3.29Å; S161-Y165 WeakPolarHBondContact O-CD2 3.33Å; S161-Y165 PolarHBondContact O-N 3.37Å |
| 162 | T | 90.6 | Very high | 90.1 | Very high | 5 Ų | 5 | 39.3 Ų | 39.3 | 3% | 0.031 | 21% | 0.21 | C | C | . | . | H | α-helix | trans | -59.2 | -45 | 179.3 | -60.6 | 0 | 0 | 0 | 0 | 112.1 | C158 V159 C166 L205 F206 | C158-T162 WeakPolarHBondContact O-CB 3.4Å; C158-T162 PolarHBondContact O-N 3.28Å; C158-T162 PolarHBondContact O-OG1 3.25Å; V159-T162 PolarHBondContact O-N 3.46Å; T162-C166 WeakPolarHBondContact O-CB 3.33Å; T162-C166 PolarHBondContact O-N 3.12Å; T162-C166 PolarHBondContact O-SG 2.92Å; T162-L205 HydrophobicContact CG2-CB 3.59Å; T162-L205 HydrophobicContact CG2-CD1 3.98Å; T162-L205 HydrophobicContact CG2-CG 4.44Å; T162-F206 HydrophobicContact CG2-CD1 3.95Å; T162-F206 HydrophobicContact CG2-CD2 4Å; T162-F206 HydrophobicContact CG2-CE1 3.69Å; T162-F206 HydrophobicContact CG2-CE2 3.76Å; T162-F206 HydrophobicContact CG2-CG 4.09Å; T162-F206 HydrophobicContact CG2-CZ 3.6Å |
| 163 | L | 92.6 | Very high | 90.6 | Very high | 9 Ų | 9 | 29.4 Ų | 29.4 | 5% | 0.047 | 17% | 0.173 | C | C | . | . | H | α-helix | trans | -66.8 | -44.3 | 177.7 | -67.9 | 177.5 | 0 | 0 | 0 | 111.3 | I142 V159 S161 C166 L167 F206 Y227 | I142-L163 HydrophobicContact CB-CD1 4.38Å; I142-L163 HydrophobicContact CG1-CD1 4.21Å; I142-L163 HydrophobicContact CG2-CD1 4.46Å; V159-L163 HydrophobicContact CG1-CD1 3.78Å; V159-L163 HydrophobicContact CG1-CG 4.35Å; V159-L163 WeakPolarHBondContact O-CB 3.37Å; V159-L163 VanDerWaalsContact O-CG 3.29Å; V159-L163 WeakPolarHBondContact O-CG 3.28Å; V159-L163 PolarHBondContact O-N 3.18Å; S161-L163 VanDerWaalsContact C-N 3.34Å; S161-L163 PolarHBondContact O-N 3.36Å; L163-C166 PolarHBondContact O-N 3.23Å; L163-L167 WeakPolarHBondContact O-CG 3.36Å; L163-L167 PolarHBondContact O-N 2.89Å; L163-F206 HydrophobicContact CD2-CE2 3.98Å; L163-F206 HydrophobicContact CD2-CZ 4.22Å; L163-F206 HydrophobicContact CG-CE2 4.4Å; L163-F206 HydrophobicContact CG-CZ 4.13Å; L163-Y227 WeakPolarHBondContact CA-OH 2.86Å; L163-Y227 HydrophobicContact CD2-CE2 4.36Å; L163-Y227 WeakPolarHBondContact CD2-OH 3.36Å; L163-Y227 PolarHBondContact O-OH 3.3Å |
| 164 | G | 91.9 | Very high | 91 | Very high | 6 Ų | 6 | 27.6 Ų | 27.6 | 6% | 0.062 | 15% | 0.154 | C | C | . | . | H | α-helix | trans | -63.9 | -43.7 | -178.6 | 0 | 0 | 0 | 0 | 0 | 114.1 | I160 S161 C166 L167 | I160-G164 PolarHBondContact O-N 3.2Å; S161-G164 PolarHBondContact O-N 3.29Å; G164-C166 VanDerWaalsContact C-N 3.28Å; G164-C166 PolarHBondContact O-N 3.4Å; G164-L167 WeakPolarHBondContact O-CB 2.99Å; G164-L167 PolarHBondContact O-N 3.21Å; G164-L167 VanDerWaalsContact O-N 3.12Å |
| 165 | Y | 88.4 | Confident | 91.1 | Very high | 92 Ų | 92 | 29.2 Ų | 29.2 | 36% | 0.361 | 17% | 0.166 | S | C | . | . | H | α-helix | trans | -63.7 | -36.5 | 176.5 | -75.3 | -63.3 | 0 | 0 | 0 | 112.1 | P109 F112 S161 L167 L168 | P109-Y165 HydrophobicContact CG-CD2 4.37Å; P109-Y165 HydrophobicContact CG-CE2 4.09Å; F112-Y165 HydrophobicContact CD2-CD1 4.27Å; F112-Y165 AromaticContact CE2-CD1 3.64Å; F112-Y165 HydrophobicContact CE2-CD1 3.64Å; F112-Y165 AromaticContact CE2-CE1 3.92Å; F112-Y165 HydrophobicContact CE2-CE1 3.92Å; S161-Y165 WeakPolarHBondContact O-CD2 3.33Å; S161-Y165 PolarHBondContact O-N 3.37Å; Y165-L167 PolarHBondContact O-N 3.42Å; Y165-L168 PolarHBondContact O-N 3.34Å |
| 166 | C | 90.4 | Very high | 91.1 | Very high | 8 Ų | 8 | 30.6 Ų | 30.6 | 5% | 0.054 | 17% | 0.165 | C | C | . | . | T | Hydrogen-bonded Turn | trans | -76.4 | -5.3 | 177.6 | -66.6 | 0 | 0 | 0 | 0 | 113.5 | T162 L163 G164 L168 P169 C198 S202 Y227 | T162-C166 WeakPolarHBondContact O-CB 3.33Å; T162-C166 PolarHBondContact O-N 3.12Å; T162-C166 PolarHBondContact O-SG 2.92Å; L163-C166 PolarHBondContact O-N 3.23Å; G164-C166 VanDerWaalsContact C-N 3.28Å; G164-C166 PolarHBondContact O-N 3.4Å; C166-L168 VanDerWaalsContact C-N 3.3Å; C166-P169 WeakPolarHBondContact O-CD 3.29Å; C166-C198 PolarHBondContact O-SG 3.36Å; C166-S202 WeakPolarHBondContact SG-CA 3.37Å; C166-S202 PolarHBondContact SG-N 3.4Å; C166-S202 VanDerWaalsContact SG-N 3.42Å; C166-Y227 HydrophobicContact CB-CE1 4.3Å; C166-Y227 WeakPolarHBondContact CB-OH 3.23Å |
| 167 | L | 90.1 | Very high | 91 | Very high | 12 Ų | 12 | 28.5 Ų | 28.5 | 6% | 0.063 | 16% | 0.155 | C | C | . | . | T | Hydrogen-bonded Turn | trans | -77.9 | -9.7 | 171.2 | -73.4 | 173.5 | 0 | 0 | 0 | 113.4 | L163 G164 Y165 M170 C171 Y227 F230 | L163-L167 WeakPolarHBondContact O-CG 3.36Å; L163-L167 PolarHBondContact O-N 2.89Å; G164-L167 WeakPolarHBondContact O-CB 2.99Å; G164-L167 PolarHBondContact O-N 3.21Å; G164-L167 VanDerWaalsContact O-N 3.12Å; Y165-L167 PolarHBondContact O-N 3.42Å; L167-M170 HydrophobicContact CD2-CB 4.26Å; L167-M170 HydrophobicContact CD2-CG 4.42Å; L167-M170 CarbonylContact O-C 3.46Å; L167-M170 WeakPolarHBondContact O-CA 3.17Å; L167-M170 WeakPolarHBondContact O-CB 3.34Å; L167-M170 PolarHBondContact O-N 3.48Å; L167-C171 PolarHBondContact O-N 3.2Å; L167-C171 PolarHBondContact O-SG 3.32Å; L167-Y227 HydrophobicContact CD2-CD1 3.92Å; L167-Y227 HydrophobicContact CD2-CE1 3.78Å; L167-Y227 HydrophobicContact CG-CE1 4.24Å; L167-F230 HydrophobicContact CD2-CD2 4.03Å; L167-F230 HydrophobicContact CD2-CE2 4.44Å; L167-F230 HydrophobicContact CD2-CG 4.26Å |
| 168 | L | 88.5 | Confident | 90.9 | Very high | 39 Ų | 39 | 29.3 Ų | 29.3 | 20% | 0.204 | 16% | 0.157 | C | C | . | . | H | α-helix | trans | -57.2 | -49.2 | -177.5 | -175.3 | 168.3 | 0 | 0 | 0 | 113.3 | L90 F112 Y165 C166 M170 C171 L172 | L90-L168 HydrophobicContact CD1-CD2 4.04Å; L90-L168 HydrophobicContact CD2-CD2 3.65Å; L90-L168 HydrophobicContact CG-CD2 4.1Å; F112-L168 HydrophobicContact CE1-CD1 3.96Å; F112-L168 HydrophobicContact CE1-CG 4.29Å; F112-L168 HydrophobicContact CZ-CD1 4.03Å; Y165-L168 PolarHBondContact O-N 3.34Å; C166-L168 VanDerWaalsContact C-N 3.3Å; L168-M170 PolarHBondContact O-N 3.48Å; L168-C171 WeakPolarHBondContact O-CB 3.4Å; L168-C171 PolarHBondContact O-N 3.09Å; L168-C171 VanDerWaalsContact O-N 3.08Å; L168-L172 HydrophobicContact CD2-CD1 4.06Å; L168-L172 HydrophobicContact CD2-CG 4.34Å; L168-L172 PolarHBondContact O-N 3.21Å; L168-L172 VanDerWaalsContact O-N 3.12Å |
| 169 | P | 90.4 | Very high | 90.8 | Very high | 20 Ų | 20 | 35 Ų | 35 | 13% | 0.13 | 19% | 0.185 | C | C | . | . | H | α-helix | trans | -60 | -30.4 | 174.7 | -20.3 | 32.2 | 0 | 0 | 0 | 112.7 | C166 L172 L173 V194 | C166-P169 WeakPolarHBondContact O-CD 3.29Å; P169-L172 PolarHBondContact O-N 3.38Å; P169-L173 PolarHBondContact O-N 2.82Å; P169-V194 HydrophobicContact CB-CG1 4.07Å; P169-V194 WeakPolarHBondContact O-CG1 3.37Å |
| 170 | M | 91.9 | Very high | 90.5 | Very high | 0 Ų | 0 | 41.7 Ų | 41.7 | 0% | 0 | 21% | 0.214 | C | C | . | . | H | α-helix | trans | -69.9 | -37.8 | 176.2 | -161.2 | 65.3 | -132.9 | 0 | 0 | 111.8 | F116 L167 L168 L173 S174 V194 A231 V234 | F116-M170 HydrophobicContact CE2-CG 3.92Å; L167-M170 HydrophobicContact CD2-CB 4.26Å; L167-M170 HydrophobicContact CD2-CG 4.42Å; L167-M170 CarbonylContact O-C 3.46Å; L167-M170 WeakPolarHBondContact O-CA 3.17Å; L167-M170 WeakPolarHBondContact O-CB 3.34Å; L167-M170 PolarHBondContact O-N 3.48Å; L168-M170 PolarHBondContact O-N 3.48Å; M170-L173 HydrophobicContact CE-CB 4.41Å; M170-L173 HydrophobicContact CE-CD2 3.59Å; M170-L173 HydrophobicContact CE-CG 4.29Å; M170-L173 WeakPolarHBondContact O-CB 3.36Å; M170-L173 PolarHBondContact O-N 3.26Å; M170-L173 HydrophobicContact SD-CD2 4.18Å; M170-S174 PolarHBondContact O-N 2.84Å; M170-V194 HydrophobicContact SD-CG1 4Å; M170-A231 HydrophobicContact CE-CB 3.7Å; M170-A231 HydrophobicContact SD-CB 3.99Å; M170-V234 HydrophobicContact CE-CB 3.71Å; M170-V234 HydrophobicContact CE-CG1 4.23Å; M170-V234 HydrophobicContact CE-CG2 3.4Å |
| 171 | C | 92.1 | Very high | 90.2 | Very high | 3 Ų | 3 | 42.7 Ų | 42.7 | 2% | 0.02 | 23% | 0.227 | C | C | . | . | H | α-helix | trans | -62.3 | -43.7 | 172.5 | -59.2 | 0 | 0 | 0 | 0 | 111.2 | F112 L115 L167 L168 L173 S174 S175 | F112-C171 PolarHBondContact O-SG 3.11Å; L115-C171 HydrophobicContact CD2-CB 3.89Å; L167-C171 PolarHBondContact O-N 3.2Å; L167-C171 PolarHBondContact O-SG 3.32Å; L168-C171 WeakPolarHBondContact O-CB 3.4Å; L168-C171 PolarHBondContact O-N 3.09Å; L168-C171 VanDerWaalsContact O-N 3.08Å; C171-L173 VanDerWaalsContact C-N 3.35Å; C171-L173 PolarHBondContact O-N 3.25Å; C171-S174 WeakPolarHBondContact O-CB 3.44Å; C171-S174 PolarHBondContact O-N 3.1Å; C171-S175 PolarHBondContact O-N 3.11Å; C171-S175 PolarHBondContact O-OG 2.7Å |
| 172 | L | 92 | Very high | 89.9 | Confident | 84 Ų | 84 | 43 Ų | 43 | 44% | 0.44 | 23% | 0.228 | S | C | . | . | H | α-helix | trans | -59.4 | -46.9 | 175.4 | -66.6 | 177.4 | 0 | 0 | 0 | 111 | L90 L168 P169 S174 S175 F176 | L90-L172 HydrophobicContact CD2-CD1 4.49Å; L168-L172 HydrophobicContact CD2-CD1 4.06Å; L168-L172 HydrophobicContact CD2-CG 4.34Å; L168-L172 PolarHBondContact O-N 3.21Å; L168-L172 VanDerWaalsContact O-N 3.12Å; P169-L172 PolarHBondContact O-N 3.38Å; L172-S174 VanDerWaalsContact C-N 3.29Å; L172-S174 PolarHBondContact O-N 3.46Å; L172-S175 WeakPolarHBondContact O-CB 3.43Å; L172-S175 PolarHBondContact O-N 3.42Å; L172-S175 VanDerWaalsContact O-N 3.11Å; L172-F176 WeakPolarHBondContact O-CD2 3.34Å; L172-F176 PolarHBondContact O-N 3.44Å |
| 173 | L | 92.2 | Very high | 89.8 | Confident | 3 Ų | 3 | 50 Ų | 50 | 2% | 0.016 | 26% | 0.258 | C | S | . | . | H | α-helix | trans | -57.3 | -42.2 | 175.5 | -178.6 | 60.8 | 0 | 0 | 0 | 112.3 | P169 M170 C171 S175 F176 G177 L182 L190 T191 V194 V234 | P169-L173 PolarHBondContact O-N 2.82Å; M170-L173 HydrophobicContact CE-CB 4.41Å; M170-L173 HydrophobicContact CE-CD2 3.59Å; M170-L173 HydrophobicContact CE-CG 4.29Å; M170-L173 WeakPolarHBondContact O-CB 3.36Å; M170-L173 PolarHBondContact O-N 3.26Å; M170-L173 HydrophobicContact SD-CD2 4.18Å; C171-L173 VanDerWaalsContact C-N 3.35Å; C171-L173 PolarHBondContact O-N 3.25Å; L173-S175 PolarHBondContact O-N 3.4Å; L173-F176 PolarHBondContact O-N 2.9Å; L173-G177 PolarHBondContact O-N 3.37Å; L173-L182 HydrophobicContact CD1-CD1 4.37Å; L173-L182 HydrophobicContact CD1-CD2 3.89Å; L173-L182 HydrophobicContact CG-CD1 4.47Å; L173-L190 HydrophobicContact CD1-CB 4.49Å; L173-L190 HydrophobicContact CD1-CD2 3.56Å; L173-L190 HydrophobicContact CD1-CG 3.69Å; L173-T191 HydrophobicContact CD2-CG2 4.01Å; L173-V194 HydrophobicContact CB-CG1 4.13Å; L173-V194 HydrophobicContact CB-CG2 4.19Å; L173-V194 HydrophobicContact CD1-CG2 4.43Å; L173-V194 HydrophobicContact CD2-CB 3.89Å; L173-V194 HydrophobicContact CD2-CG1 3.94Å; L173-V194 HydrophobicContact CD2-CG2 4.13Å; L173-V234 HydrophobicContact CG-CG1 4.25Å |
| 174 | S | 92 | Very high | 89.6 | Confident | 2 Ų | 2 | 52.1 Ų | 52.1 | 1% | 0.014 | 27% | 0.274 | C | S | . | . | H | α-helix | trans | -61.6 | -42.1 | 175.2 | -173.4 | 0 | 0 | 0 | 0 | 112 | T119 M170 C171 L172 G177 I178 | T119-S174 WeakPolarHBondContact CB-OG 3.3Å; T119-S174 VanDerWaalsContact OG1-CB 3.32Å; T119-S174 WeakPolarHBondContact OG1-CB 3.09Å; T119-S174 PolarHBondContact OG1-OG 3.24Å; M170-S174 PolarHBondContact O-N 2.84Å; C171-S174 WeakPolarHBondContact O-CB 3.44Å; C171-S174 PolarHBondContact O-N 3.1Å; L172-S174 VanDerWaalsContact C-N 3.29Å; L172-S174 PolarHBondContact O-N 3.46Å; S174-G177 PolarHBondContact O-N 3.02Å; S174-I178 PolarHBondContact O-N 2.88Å |
| 175 | S | 91.7 | Very high | 89.6 | Confident | 47 Ų | 47 | 58.1 Ų | 58.1 | 33% | 0.329 | 30% | 0.303 | S | S | . | . | H | α-helix | trans | -63.4 | -43 | 175.7 | -61.8 | 0 | 0 | 0 | 0 | 112.2 | T119 C171 L172 L173 G177 I178 | T119-S175 WeakPolarHBondContact CG2-OG 3.12Å; C171-S175 PolarHBondContact O-N 3.11Å; C171-S175 PolarHBondContact O-OG 2.7Å; L172-S175 WeakPolarHBondContact O-CB 3.43Å; L172-S175 PolarHBondContact O-N 3.42Å; L172-S175 VanDerWaalsContact O-N 3.11Å; L173-S175 PolarHBondContact O-N 3.4Å; S175-G177 PolarHBondContact O-N 3.38Å; S175-I178 WeakPolarHBondContact O-CB 3.37Å; S175-I178 PolarHBondContact O-N 3.46Å |
| 176 | F | 91 | Very high | 89.7 | Confident | 111 Ų | 111 | 60.2 Ų | 60.2 | 49% | 0.487 | 32% | 0.32 | S | S | . | . | H | α-helix | trans | -61.2 | -35.8 | 173.7 | -80.9 | -72.5 | 0 | 0 | 0 | 112 | L172 L173 I178 I179 F180 | L172-F176 WeakPolarHBondContact O-CD2 3.34Å; L172-F176 PolarHBondContact O-N 3.44Å; L173-F176 PolarHBondContact O-N 2.9Å; F176-I178 PolarHBondContact O-N 2.89Å; F176-I179 PolarHBondContact O-N 3.43Å; F176-F180 PolarHBondContact O-N 3.44Å |
| 177 | G | 89.3 | Confident | 89.8 | Confident | 21 Ų | 21 | 60.1 Ų | 60.1 | 22% | 0.216 | 32% | 0.32 | C | S | . | . | H | α-helix | trans | -65.8 | -16.7 | 176.4 | 0 | 0 | 0 | 0 | 0 | 115.5 | L173 S174 S175 F180 | L173-G177 PolarHBondContact O-N 3.37Å; S174-G177 PolarHBondContact O-N 3.02Å; S175-G177 PolarHBondContact O-N 3.38Å; G177-F180 CarbonylContact C-O 3.53Å; G177-F180 WeakPolarHBondContact CA-O 3.32Å; G177-F180 VanDerWaalsContact O-O 3.1Å |
| 178 | I | 88.1 | Confident | 89.9 | Confident | 72 Ų | 72 | 63.2 Ų | 63.2 | 37% | 0.369 | 34% | 0.339 | S | S | . | . | H | α-helix | trans | -73.9 | -39.2 | 173.8 | -59.3 | 167 | 0 | 0 | 0 | 110.3 | T119 L122 A123 S174 S175 F176 | T119-I178 HydrophobicContact CG2-CD1 4.49Å; L122-I178 HydrophobicContact CB-CD1 3.93Å; L122-I178 HydrophobicContact CD1-CD1 4.49Å; A123-I178 HydrophobicContact CB-CG1 4.08Å; S174-I178 PolarHBondContact O-N 2.88Å; S175-I178 WeakPolarHBondContact O-CB 3.37Å; S175-I178 PolarHBondContact O-N 3.46Å; F176-I178 PolarHBondContact O-N 2.89Å |
| 179 | I | 88.4 | Confident | 90.2 | Very high | 132 Ų | 132 | 65.3 Ų | 65.3 | 68% | 0.677 | 35% | 0.353 | S | S | * | . | H | α-helix | trans | -88.2 | -39.1 | -176.2 | -55.4 | 172 | 0 | 0 | 0 | 110.7 | F176 | F176-I179 PolarHBondContact O-N 3.43Å |
| 180 | F | 85.9 | Confident | 90.3 | Very high | 141 Ų | 141 | 68 Ų | 68 | 62% | 0.618 | 37% | 0.366 | S | S | * | . | S | Bend | trans | -117.8 | 139.1 | -175.5 | -63.5 | -78 | 0 | 0 | 0 | 111.7 | F176 G177 L182 | F176-F180 PolarHBondContact O-N 3.44Å; G177-F180 CarbonylContact C-O 3.53Å; G177-F180 WeakPolarHBondContact CA-O 3.32Å; G177-F180 VanDerWaalsContact O-O 3.1Å; F180-L182 PolarHBondContact O-N 2.87Å |
| 181 | S | 86.2 | Confident | 90.5 | Very high | 83 Ų | 83 | 68.8 Ų | 68.8 | 58% | 0.58 | 37% | 0.371 | S | S | * | . | trans | -70.1 | 114.2 | 174.9 | -175.6 | 0 | 0 | 0 | 0 | 111.5 | K183 S184 | S181-K183 PolarHBondContact O-N 2.88Å; S181-S184 PolarHBondContact O-OG 2.93Å | ||
| 182 | L | 85 | Confident | 90.6 | Very high | 12 Ų | 12 | 71.1 Ų | 71.1 | 6% | 0.063 | 39% | 0.39 | C | S | . | . | T | Hydrogen-bonded Turn | trans | -75.3 | 0.3 | 176.9 | -68.5 | 171.7 | 0 | 0 | 0 | 114.2 | L173 F180 S184 L190 V234 V235 | L173-L182 HydrophobicContact CD1-CD1 4.37Å; L173-L182 HydrophobicContact CD1-CD2 3.89Å; L173-L182 HydrophobicContact CG-CD1 4.47Å; F180-L182 PolarHBondContact O-N 2.87Å; L182-S184 PolarHBondContact O-N 3.09Å; L182-L190 HydrophobicContact CD2-CD2 4.38Å; L182-V234 HydrophobicContact CD1-CG1 3.46Å; L182-V234 VanDerWaalsContact CD1-CG1 3.46Å; L182-V235 HydrophobicContact CB-CG2 4.41Å |
| 183 | K | 86.7 | Confident | 90.7 | Very high | 152 Ų | 152 | 71 Ų | 71 | 66% | 0.661 | 39% | 0.393 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -74.2 | -13.9 | 177.1 | -66.3 | -175.1 | 168 | 73.3 | 0 | 113.4 | S181 | S181-K183 PolarHBondContact O-N 2.88Š|
| 184 | S | 89.4 | Confident | 90.8 | Very high | 55 Ų | 55 | 71.8 Ų | 71.8 | 39% | 0.385 | 40% | 0.398 | S | S | . | . | S | Bend | trans | -73 | 160.6 | 178.3 | 64.7 | 0 | 0 | 0 | 0 | 111.8 | S181 L182 L186 G187 V188 | S181-S184 PolarHBondContact O-OG 2.93Å; L182-S184 PolarHBondContact O-N 3.09Å; S184-L186 PolarHBondContact O-N 3.38Å; S184-G187 WeakPolarHBondContact O-CA 3.33Å; S184-G187 PolarHBondContact O-N 2.95Å; S184-G187 PolarHBondContact OG-N 3.44Å; S184-G187 VanDerWaalsContact OG-N 3.17Å; S184-V188 PolarHBondContact O-N 3.38Å |
| 185 | I | 91.4 | Very high | 91 | Very high | 132 Ų | 132 | 72.3 Ų | 72.3 | 68% | 0.677 | 40% | 0.401 | S | S | * | . | H | α-helix | trans | -54 | -37.9 | 172.4 | -175 | 60.2 | 0 | 0 | 0 | 111.8 | G187 V188 V189 | I185-G187 VanDerWaalsContact C-N 3.35Å; I185-V188 PolarHBondContact O-N 3.47Å; I185-V189 WeakPolarHBondContact O-CG2 3.44Å; I185-V189 PolarHBondContact O-N 3.16Å |
| 186 | L | 91 | Very high | 91.2 | Very high | 136 Ų | 136 | 73 Ų | 73 | 71% | 0.712 | 41% | 0.406 | S | S | * | . | H | α-helix | trans | -62.6 | -41.7 | 174.9 | -67.6 | 174.9 | 0 | 0 | 0 | 111.5 | S184 V189 L190 | S184-L186 PolarHBondContact O-N 3.38Å; L186-V189 PolarHBondContact O-N 2.85Å; L186-L190 VanDerWaalsContact O-CB 3.3Å; L186-L190 WeakPolarHBondContact O-CB 3.2Å; L186-L190 PolarHBondContact O-N 3.25Å |
| 187 | G | 92.1 | Very high | 91.3 | Very high | 5 Ų | 5 | 72 Ų | 72 | 5% | 0.052 | 40% | 0.399 | C | S | . | . | H | α-helix | trans | -62.3 | -41 | 175 | 0 | 0 | 0 | 0 | 0 | 112.8 | S184 I185 T191 | S184-G187 WeakPolarHBondContact O-CA 3.33Å; S184-G187 PolarHBondContact O-N 2.95Å; S184-G187 PolarHBondContact OG-N 3.44Å; S184-G187 VanDerWaalsContact OG-N 3.17Å; I185-G187 VanDerWaalsContact C-N 3.35Å; G187-T191 VanDerWaalsContact O-CB 3.27Å; G187-T191 WeakPolarHBondContact O-CB 3.37Å; G187-T191 PolarHBondContact O-N 3.29Å; G187-T191 PolarHBondContact O-OG1 2.74Å |
| 188 | V | 92.6 | Very high | 91.5 | Very high | 78 Ų | 78 | 71 Ų | 71 | 47% | 0.473 | 39% | 0.389 | S | S | . | . | H | α-helix | trans | -65.3 | -45.4 | 175.8 | 178.2 | 0 | 0 | 0 | 0 | 111.4 | S184 I185 T191 A192 | S184-V188 PolarHBondContact O-N 3.38Å; I185-V188 PolarHBondContact O-N 3.47Å; V188-T191 PolarHBondContact O-N 3.09Å; V188-A192 WeakPolarHBondContact O-CB 3.41Å; V188-A192 PolarHBondContact O-N 3.18Å |
| 189 | V | 94.6 | Very high | 91.8 | Very high | 82 Ų | 82 | 68.2 Ų | 68.2 | 50% | 0.497 | 38% | 0.375 | S | S | . | . | H | α-helix | trans | -61.9 | -47.8 | 177.4 | 171.9 | 0 | 0 | 0 | 0 | 110.7 | I185 L186 T191 A192 T193 | I185-V189 WeakPolarHBondContact O-CG2 3.44Å; I185-V189 PolarHBondContact O-N 3.16Å; L186-V189 PolarHBondContact O-N 2.85Å; V189-T191 VanDerWaalsContact C-N 3.3Å; V189-T191 PolarHBondContact O-N 3.4Å; V189-A192 PolarHBondContact O-N 2.9Å; V189-T193 PolarHBondContact O-N 3.29Å; V189-T193 PolarHBondContact O-OG1 2.99Å; V189-T193 VanDerWaalsContact O-OG1 3.1Å |
| 190 | L | 93.2 | Very high | 92 | Very high | 78 Ų | 78 | 65.8 Ų | 65.8 | 41% | 0.408 | 36% | 0.363 | S | S | . | . | H | α-helix | trans | -58.5 | -44.2 | 177 | -176.5 | 67.2 | 0 | 0 | 0 | 111.2 | L173 L182 L186 T193 V194 | L173-L190 HydrophobicContact CD1-CB 4.49Å; L173-L190 HydrophobicContact CD1-CD2 3.56Å; L173-L190 HydrophobicContact CD1-CG 3.69Å; L182-L190 HydrophobicContact CD2-CD2 4.38Å; L186-L190 VanDerWaalsContact O-CB 3.3Å; L186-L190 WeakPolarHBondContact O-CB 3.2Å; L186-L190 PolarHBondContact O-N 3.25Å; L190-T193 PolarHBondContact O-N 3.33Å; L190-V194 WeakPolarHBondContact O-CG2 3.19Å; L190-V194 PolarHBondContact O-N 3.09Å |
| 191 | T | 94.9 | Very high | 92.2 | Very high | 15 Ų | 15 | 60.6 Ų | 60.6 | 9% | 0.092 | 35% | 0.346 | C | S | . | . | H | α-helix | trans | -60.1 | -46.5 | 176.3 | -58.7 | 0 | 0 | 0 | 0 | 111.6 | L173 G187 V188 V189 T193 V194 V195 A231 V235 | L173-T191 HydrophobicContact CD2-CG2 4.01Å; G187-T191 VanDerWaalsContact O-CB 3.27Å; G187-T191 WeakPolarHBondContact O-CB 3.37Å; G187-T191 PolarHBondContact O-N 3.29Å; G187-T191 PolarHBondContact O-OG1 2.74Å; V188-T191 PolarHBondContact O-N 3.09Å; V189-T191 VanDerWaalsContact C-N 3.3Å; V189-T191 PolarHBondContact O-N 3.4Å; T191-T193 VanDerWaalsContact C-N 3.35Å; T191-T193 PolarHBondContact O-N 3.38Å; T191-V194 PolarHBondContact O-N 2.97Å; T191-V195 HydrophobicContact CG2-CG2 4.39Å; T191-V195 WeakPolarHBondContact O-CB 3.44Å; T191-V195 VanDerWaalsContact O-CG2 3.3Å; T191-V195 WeakPolarHBondContact O-CG2 3.32Å; T191-V195 PolarHBondContact O-N 3.41Å; T191-A231 HydrophobicContact CG2-CB 3.64Å; T191-V235 HydrophobicContact CG2-CG2 4.05Å |
| 192 | A | 95.3 | Very high | 92.4 | Very high | 52 Ų | 52 | 56.7 Ų | 56.7 | 43% | 0.43 | 32% | 0.319 | S | S | . | . | H | α-helix | trans | -62.8 | -39.4 | 177.7 | 0 | 0 | 0 | 0 | 0 | 112.5 | V188 V189 S196 | V188-A192 WeakPolarHBondContact O-CB 3.41Å; V188-A192 PolarHBondContact O-N 3.18Å; V189-A192 PolarHBondContact O-N 2.9Å; A192-S196 VanDerWaalsContact O-CB 3.28Å; A192-S196 WeakPolarHBondContact O-CB 3.28Å; A192-S196 PolarHBondContact O-N 3.11Å; A192-S196 PolarHBondContact O-OG 3.42Å |
| 193 | T | 94.3 | Very high | 92.7 | Very high | 81 Ų | 81 | 56.2 Ų | 56.2 | 50% | 0.497 | 32% | 0.316 | S | S | . | . | H | α-helix | trans | -63.6 | -45.2 | 175.5 | -57.8 | 0 | 0 | 0 | 0 | 111.4 | V189 L190 T191 S196 W197 | V189-T193 PolarHBondContact O-N 3.29Å; V189-T193 PolarHBondContact O-OG1 2.99Å; V189-T193 VanDerWaalsContact O-OG1 3.1Å; L190-T193 PolarHBondContact O-N 3.33Å; T191-T193 VanDerWaalsContact C-N 3.35Å; T191-T193 PolarHBondContact O-N 3.38Å; T193-S196 PolarHBondContact O-N 3.47Å; T193-W197 WeakPolarHBondContact O-CB 3.01Å; T193-W197 PolarHBondContact O-N 3.04Å |
| 194 | V | 94.7 | Very high | 92.8 | Very high | 20 Ų | 20 | 53.1 Ų | 53.1 | 12% | 0.121 | 30% | 0.303 | C | S | . | . | H | α-helix | trans | -64.9 | -47.1 | 178.5 | 170.1 | 0 | 0 | 0 | 0 | 111.2 | P169 M170 L173 L190 T191 S196 W197 C198 | P169-V194 HydrophobicContact CB-CG1 4.07Å; P169-V194 WeakPolarHBondContact O-CG1 3.37Å; M170-V194 HydrophobicContact SD-CG1 4Å; L173-V194 HydrophobicContact CB-CG1 4.13Å; L173-V194 HydrophobicContact CB-CG2 4.19Å; L173-V194 HydrophobicContact CD1-CG2 4.43Å; L173-V194 HydrophobicContact CD2-CB 3.89Å; L173-V194 HydrophobicContact CD2-CG1 3.94Å; L173-V194 HydrophobicContact CD2-CG2 4.13Å; L190-V194 WeakPolarHBondContact O-CG2 3.19Å; L190-V194 PolarHBondContact O-N 3.09Å; T191-V194 PolarHBondContact O-N 2.97Å; V194-S196 VanDerWaalsContact C-N 3.3Å; V194-S196 PolarHBondContact O-N 2.91Å; V194-W197 WeakPolarHBondContact O-CA 3.2Å; V194-W197 WeakPolarHBondContact O-CB 3.27Å; V194-W197 PolarHBondContact O-N 2.89Å; V194-W197 VanDerWaalsContact O-N 3.09Å; V194-C198 PolarHBondContact O-N 3.11Å; V194-C198 PolarHBondContact O-SG 3.36Å |
| 195 | V | 95.9 | Very high | 92.7 | Very high | 13 Ų | 13 | 52.3 Ų | 52.3 | 8% | 0.079 | 29% | 0.294 | C | S | . | . | H | α-helix | trans | -59 | -44 | 176.2 | 169.5 | 0 | 0 | 0 | 0 | 111 | T191 W197 C198 T199 A231 | T191-V195 HydrophobicContact CG2-CG2 4.39Å; T191-V195 WeakPolarHBondContact O-CB 3.44Å; T191-V195 VanDerWaalsContact O-CG2 3.3Å; T191-V195 WeakPolarHBondContact O-CG2 3.32Å; T191-V195 PolarHBondContact O-N 3.41Å; V195-W197 VanDerWaalsContact C-N 3.3Å; V195-W197 PolarHBondContact O-N 3.22Å; V195-C198 PolarHBondContact O-N 3.17Å; V195-T199 VanDerWaalsContact O-CB 3.28Å; V195-T199 WeakPolarHBondContact O-CB 3.38Å; V195-T199 PolarHBondContact O-N 3.47Å; V195-T199 PolarHBondContact O-OG1 3.4Å; V195-A231 HydrophobicContact CG2-CB 3.44Å; V195-A231 VanDerWaalsContact CG2-CB 3.44Å |
| 196 | S | 94.6 | Very high | 92.6 | Very high | 63 Ų | 63 | 46.1 Ų | 46.1 | 44% | 0.441 | 26% | 0.262 | S | S | . | . | H | α-helix | trans | -61 | -41.7 | 176.1 | -60.2 | 0 | 0 | 0 | 0 | 111.2 | A192 T193 V194 T199 I200 | A192-S196 VanDerWaalsContact O-CB 3.28Å; A192-S196 WeakPolarHBondContact O-CB 3.28Å; A192-S196 PolarHBondContact O-N 3.11Å; A192-S196 PolarHBondContact O-OG 3.42Å; T193-S196 PolarHBondContact O-N 3.47Å; V194-S196 VanDerWaalsContact C-N 3.3Å; V194-S196 PolarHBondContact O-N 2.91Å; S196-T199 PolarHBondContact O-N 3.31Å; S196-I200 WeakPolarHBondContact O-CB 3.41Å; S196-I200 WeakPolarHBondContact O-CD1 3.12Å; S196-I200 WeakPolarHBondContact O-CG1 3.5Å; S196-I200 PolarHBondContact O-N 3.24Å |
| 197 | W | 93.8 | Very high | 92.5 | Very high | 89 Ų | 89 | 39.7 Ų | 39.7 | 34% | 0.337 | 23% | 0.229 | S | C | . | . | H | α-helix | trans | -62.1 | -52.2 | 176.7 | -168.2 | -86.1 | 0 | 0 | 0 | 112.4 | L90 P92 T193 V194 V195 T199 I200 A201 | L90-W197 VanDerWaalsContact O-CZ2 3.3Å; L90-W197 WeakPolarHBondContact O-CZ2 3.42Å; P92-W197 HydrophobicContact CB-CH2 3.94Å; P92-W197 HydrophobicContact CB-CZ2 4.22Å; P92-W197 VanDerWaalsContact CD-CH2 3.46Å; P92-W197 HydrophobicContact CG-CH2 3.42Å; P92-W197 VanDerWaalsContact CG-CH2 3.42Å; P92-W197 HydrophobicContact CG-CZ2 4.13Å; P92-W197 HydrophobicContact CG-CZ3 4.04Å; T193-W197 WeakPolarHBondContact O-CB 3.01Å; T193-W197 PolarHBondContact O-N 3.04Å; V194-W197 WeakPolarHBondContact O-CA 3.2Å; V194-W197 WeakPolarHBondContact O-CB 3.27Å; V194-W197 PolarHBondContact O-N 2.89Å; V194-W197 VanDerWaalsContact O-N 3.09Å; V195-W197 VanDerWaalsContact C-N 3.3Å; V195-W197 PolarHBondContact O-N 3.22Å; W197-T199 VanDerWaalsContact C-N 3.28Å; W197-T199 PolarHBondContact O-N 3Å; W197-I200 PolarHBondContact O-N 3.12Å; W197-A201 WeakPolarHBondContact O-CB 3.4Å; W197-A201 PolarHBondContact O-N 3.35Å |
| 198 | C | 93.7 | Very high | 92.2 | Very high | 0 Ų | 0 | 47.3 Ų | 47.3 | 0% | 0 | 26% | 0.256 | C | S | . | . | H | α-helix | trans | -57.2 | -42.9 | 176.9 | -65 | 0 | 0 | 0 | 0 | 111.3 | C166 V194 V195 A201 S202 Y227 | C166-C198 PolarHBondContact O-SG 3.36Å; V194-C198 PolarHBondContact O-N 3.11Å; V194-C198 PolarHBondContact O-SG 3.36Å; V195-C198 PolarHBondContact O-N 3.17Å; C198-A201 PolarHBondContact O-N 3.25Å; C198-S202 WeakPolarHBondContact O-CB 3.18Å; C198-S202 PolarHBondContact O-N 2.77Å; C198-Y227 HydrophobicContact CB-CD1 3.81Å; C198-Y227 HydrophobicContact CB-CD2 3.85Å; C198-Y227 HydrophobicContact CB-CE1 4.03Å; C198-Y227 HydrophobicContact CB-CE2 4.09Å; C198-Y227 HydrophobicContact CB-CG 3.74Å |
| 199 | T | 94.7 | Very high | 91.8 | Very high | 14 Ų | 14 | 45.6 Ų | 45.6 | 9% | 0.086 | 25% | 0.247 | C | C | . | . | H | α-helix | trans | -64.3 | -46.3 | 177.9 | -58.4 | 0 | 0 | 0 | 0 | 111.8 | V195 S196 W197 S203 A220 A224 | V195-T199 VanDerWaalsContact O-CB 3.28Å; V195-T199 WeakPolarHBondContact O-CB 3.38Å; V195-T199 PolarHBondContact O-N 3.47Å; V195-T199 PolarHBondContact O-OG1 3.4Å; S196-T199 PolarHBondContact O-N 3.31Å; W197-T199 VanDerWaalsContact C-N 3.28Å; W197-T199 PolarHBondContact O-N 3Å; T199-S203 WeakPolarHBondContact O-CB 3.47Å; T199-S203 PolarHBondContact O-N 2.84Å; T199-S203 PolarHBondContact O-OG 3.2Å; T199-A220 HydrophobicContact CG2-CB 4.23Å; T199-A220 WeakPolarHBondContact CG2-O 2.9Å; T199-A224 HydrophobicContact CG2-CB 3.76Å; T199-A224 WeakPolarHBondContact OG1-CA 3.42Å |
| 200 | I | 91.6 | Very high | 91.4 | Very high | 81 Ų | 81 | 42.5 Ų | 42.5 | 42% | 0.415 | 23% | 0.228 | S | C | . | . | H | α-helix | trans | -64.8 | -42.2 | 179 | -72.1 | 165.7 | 0 | 0 | 0 | 110.5 | S196 W197 S203 K204 | S196-I200 WeakPolarHBondContact O-CB 3.41Å; S196-I200 WeakPolarHBondContact O-CD1 3.12Å; S196-I200 WeakPolarHBondContact O-CG1 3.5Å; S196-I200 PolarHBondContact O-N 3.24Å; W197-I200 PolarHBondContact O-N 3.12Å; I200-S203 PolarHBondContact O-OG 3.29Å; I200-S203 VanDerWaalsContact O-OG 3.11Å; I200-K204 HydrophobicContact CG2-CD 4.21Å; I200-K204 WeakPolarHBondContact O-CB 3.25Å; I200-K204 WeakPolarHBondContact O-CG 3.11Å; I200-K204 PolarHBondContact O-N 3.2Å; I200-K204 VanDerWaalsContact O-N 3.17Å |
| 201 | A | 89.6 | Confident | 91 | Very high | 32 Ų | 32 | 44.4 Ų | 44.4 | 26% | 0.264 | 24% | 0.238 | S | C | . | . | H | α-helix | trans | -63.9 | -53.1 | 177.3 | 0 | 0 | 0 | 0 | 0 | 111.4 | W197 C198 S203 K204 L205 | W197-A201 WeakPolarHBondContact O-CB 3.4Å; W197-A201 PolarHBondContact O-N 3.35Å; C198-A201 PolarHBondContact O-N 3.25Å; A201-S203 PolarHBondContact O-N 2.79Å; A201-K204 WeakPolarHBondContact O-CB 3.31Å; A201-K204 PolarHBondContact O-N 3.43Å; A201-L205 WeakPolarHBondContact O-CG 3.29Å; A201-L205 PolarHBondContact O-N 2.86Å |
| 202 | S | 91.4 | Very high | 90.2 | Very high | 0 Ų | 0 | 44.6 Ų | 44.6 | 0% | 0 | 24% | 0.238 | C | C | . | . | H | α-helix | trans | -64.2 | -42.8 | -177.6 | -177.1 | 0 | 0 | 0 | 0 | 112.6 | C166 C198 K204 L205 F206 Y227 | C166-S202 WeakPolarHBondContact SG-CA 3.37Å; C166-S202 PolarHBondContact SG-N 3.4Å; C166-S202 VanDerWaalsContact SG-N 3.42Å; C198-S202 WeakPolarHBondContact O-CB 3.18Å; C198-S202 PolarHBondContact O-N 2.77Å; S202-K204 VanDerWaalsContact C-N 3.33Å; S202-K204 PolarHBondContact O-N 2.89Å; S202-L205 PolarHBondContact O-N 3.5Å; S202-F206 VanDerWaalsContact O-CD2 3.29Å; S202-F206 WeakPolarHBondContact O-CD2 3.3Å; S202-F206 PolarHBondContact O-N 3.37Å; S202-F206 WeakPolarHBondContact OG-CE2 3.14Å; S202-Y227 WeakPolarHBondContact CB-OH 3.39Å; S202-Y227 PolarHBondContact OG-OH 3.08Å |
| 203 | S | 91.8 | Very high | 89.3 | Confident | 2 Ų | 2 | 47.2 Ų | 47.2 | 1% | 0.014 | 24% | 0.242 | C | C | . | . | H | α-helix | trans | -63.8 | -36.1 | 175.9 | 61.1 | 0 | 0 | 0 | 0 | 112.8 | T199 I200 A201 V207 | T199-S203 WeakPolarHBondContact O-CB 3.47Å; T199-S203 PolarHBondContact O-N 2.84Å; T199-S203 PolarHBondContact O-OG 3.2Å; I200-S203 PolarHBondContact O-OG 3.29Å; I200-S203 VanDerWaalsContact O-OG 3.11Å; A201-S203 PolarHBondContact O-N 2.79Å; S203-V207 VanDerWaalsContact O-CB 3.3Å; S203-V207 WeakPolarHBondContact O-CB 3.39Å; S203-V207 WeakPolarHBondContact O-CG2 3.49Å; S203-V207 PolarHBondContact O-N 3.3Å; S203-V207 VanDerWaalsContact O-N 3.11Å |
| 204 | K | 88.2 | Confident | 88.6 | Confident | 88 Ų | 88 | 52.2 Ų | 52.2 | 38% | 0.383 | 26% | 0.259 | S | S | . | . | H | α-helix | trans | -65.4 | -44 | 174.3 | -78.5 | 174.3 | 176.8 | -178.7 | 0 | 111.1 | I200 A201 S202 V207 R208 | I200-K204 HydrophobicContact CG2-CD 4.21Å; I200-K204 WeakPolarHBondContact O-CB 3.25Å; I200-K204 WeakPolarHBondContact O-CG 3.11Å; I200-K204 PolarHBondContact O-N 3.2Å; I200-K204 VanDerWaalsContact O-N 3.17Å; A201-K204 WeakPolarHBondContact O-CB 3.31Å; A201-K204 PolarHBondContact O-N 3.43Å; S202-K204 VanDerWaalsContact C-N 3.33Å; S202-K204 PolarHBondContact O-N 2.89Å; K204-V207 PolarHBondContact O-N 3.48Å; K204-R208 WeakPolarHBondContact O-CG 3.3Å; K204-R208 PolarHBondContact O-N 2.92Å; K204-R208 VanDerWaalsContact O-N 3.1Å |
| 205 | L | 87.9 | Confident | 88 | Confident | 38 Ų | 38 | 55.2 Ų | 55.2 | 20% | 0.199 | 27% | 0.272 | C | S | . | . | H | α-helix | trans | -61.2 | -53.2 | 178 | -69.3 | 178 | 0 | 0 | 0 | 110.7 | L101 T162 A201 S202 V207 R208 S209 | L101-L205 HydrophobicContact CD1-CB 4.37Å; L101-L205 HydrophobicContact CD1-CD2 4.03Å; T162-L205 HydrophobicContact CG2-CB 3.59Å; T162-L205 HydrophobicContact CG2-CD1 3.98Å; T162-L205 HydrophobicContact CG2-CG 4.44Å; A201-L205 WeakPolarHBondContact O-CG 3.29Å; A201-L205 PolarHBondContact O-N 2.86Å; S202-L205 PolarHBondContact O-N 3.5Å; L205-V207 VanDerWaalsContact C-N 3.31Å; L205-V207 PolarHBondContact O-N 3.44Å; L205-R208 WeakPolarHBondContact O-CA 3.14Å; L205-R208 WeakPolarHBondContact O-CB 3.49Å; L205-R208 PolarHBondContact O-N 3.03Å; L205-S209 PolarHBondContact O-N 3.34Å; L205-S209 PolarHBondContact O-OG 3Å |
| 206 | F | 89.8 | Confident | 87.5 | Confident | 1 Ų | 1 | 58.9 Ų | 58.9 | 0% | 0.004 | 28% | 0.284 | C | S | . | . | H | α-helix | trans | -58 | -41.1 | 178.9 | -75 | -50.7 | 0 | 0 | 0 | 113.9 | I142 L146 V159 T162 L163 S202 R208 S209 L210 V219 | I142-F206 HydrophobicContact CG2-CE2 4.24Å; I142-F206 HydrophobicContact CG2-CZ 4.04Å; L146-F206 HydrophobicContact CD2-CD1 3.63Å; L146-F206 HydrophobicContact CD2-CE1 3.7Å; L146-F206 HydrophobicContact CD2-CG 4.09Å; L146-F206 HydrophobicContact CD2-CZ 4.19Å; V159-F206 HydrophobicContact CB-CE1 4.48Å; V159-F206 HydrophobicContact CG1-CZ 4.32Å; V159-F206 HydrophobicContact CG2-CE1 4.19Å; T162-F206 HydrophobicContact CG2-CD1 3.95Å; T162-F206 HydrophobicContact CG2-CD2 4Å; T162-F206 HydrophobicContact CG2-CE1 3.69Å; T162-F206 HydrophobicContact CG2-CE2 3.76Å; T162-F206 HydrophobicContact CG2-CG 4.09Å; T162-F206 HydrophobicContact CG2-CZ 3.6Å; L163-F206 HydrophobicContact CD2-CE2 3.98Å; L163-F206 HydrophobicContact CD2-CZ 4.22Å; L163-F206 HydrophobicContact CG-CE2 4.4Å; L163-F206 HydrophobicContact CG-CZ 4.13Å; S202-F206 VanDerWaalsContact O-CD2 3.29Å; S202-F206 WeakPolarHBondContact O-CD2 3.3Å; S202-F206 PolarHBondContact O-N 3.37Å; S202-F206 WeakPolarHBondContact OG-CE2 3.14Å; F206-R208 VanDerWaalsContact C-N 3.26Å; F206-R208 PolarHBondContact O-N 2.86Å; F206-S209 PolarHBondContact O-N 2.89Å; F206-L210 VanDerWaalsContact O-CB 3.3Å; F206-L210 WeakPolarHBondContact O-CB 3.21Å; F206-L210 WeakPolarHBondContact O-CG 3.42Å; F206-L210 PolarHBondContact O-N 3.26Å; F206-V219 HydrophobicContact CB-CG1 3.8Å; F206-V219 HydrophobicContact CD2-CG1 3.86Å; F206-V219 HydrophobicContact CG-CG1 4.14Å |
| 207 | V | 88.6 | Confident | 87.3 | Confident | 2 Ų | 2 | 63 Ų | 63 | 1% | 0.012 | 30% | 0.3 | C | S | . | . | H | α-helix | trans | -65.1 | -31.8 | 178.1 | 164.9 | 0 | 0 | 0 | 0 | 112 | S203 K204 L205 D211 M212 Q213 R216 | S203-V207 VanDerWaalsContact O-CB 3.3Å; S203-V207 WeakPolarHBondContact O-CB 3.39Å; S203-V207 WeakPolarHBondContact O-CG2 3.49Å; S203-V207 PolarHBondContact O-N 3.3Å; S203-V207 VanDerWaalsContact O-N 3.11Å; K204-V207 PolarHBondContact O-N 3.48Å; L205-V207 VanDerWaalsContact C-N 3.31Å; L205-V207 PolarHBondContact O-N 3.44Å; V207-D211 WeakPolarHBondContact O-CA 3.21Å; V207-D211 PolarHBondContact O-N 3.21Å; V207-M212 PolarHBondContact O-N 3.25Å; V207-M212 VanDerWaalsContact O-N 3.11Å; V207-Q213 VanDerWaalsContact CG1-CD 3.47Å; V207-Q213 HydrophobicContact CG1-CG 4.4Å; V207-Q213 VanDerWaalsContact CG1-NE2 3.32Å; V207-Q213 PolarHBondContact O-NE2 3.48Å; V207-Q213 VanDerWaalsContact O-NE2 3.17Å; V207-R216 HydrophobicContact CG2-CB 3.67Å; V207-R216 HydrophobicContact CG2-CG 3.84Å |
| 208 | R | 85.2 | Confident | 87.2 | Confident | 165 Ų | 165 | 63.4 Ų | 63.4 | 62% | 0.623 | 31% | 0.308 | S | S | * | . | H | α-helix | trans | -75.7 | -42.1 | 174.4 | -67.9 | -73.9 | -177.4 | 155.2 | 4.2 | 111.9 | K204 L205 F206 | K204-R208 WeakPolarHBondContact O-CG 3.3Å; K204-R208 PolarHBondContact O-N 2.92Å; K204-R208 VanDerWaalsContact O-N 3.1Å; L205-R208 WeakPolarHBondContact O-CA 3.14Å; L205-R208 WeakPolarHBondContact O-CB 3.49Å; L205-R208 PolarHBondContact O-N 3.03Å; F206-R208 VanDerWaalsContact C-N 3.26Å; F206-R208 PolarHBondContact O-N 2.86Å |
| 209 | S | 85.1 | Confident | 87.1 | Confident | 41 Ų | 41 | 63.4 Ų | 63.4 | 29% | 0.287 | 31% | 0.308 | S | S | . | . | H | α-helix | trans | -69.3 | -35.3 | -179.4 | -43.6 | 0 | 0 | 0 | 0 | 113.2 | L101 L205 F206 | L101-S209 VanDerWaalsContact CD1-OG 3.28Å; L101-S209 WeakPolarHBondContact CD1-OG 3.36Å; L101-S209 VanDerWaalsContact CD2-CB 3.49Å; L101-S209 WeakPolarHBondContact CD2-OG 3.46Å; L205-S209 PolarHBondContact O-N 3.34Å; L205-S209 PolarHBondContact O-OG 3Å; F206-S209 PolarHBondContact O-N 2.89Å |
| 210 | L | 85.6 | Confident | 87 | Confident | 18 Ų | 18 | 63.8 Ų | 63.8 | 9% | 0.094 | 31% | 0.312 | C | S | . | . | T | Hydrogen-bonded Turn | trans | -106.5 | 3.5 | -172.2 | -59.3 | 172.7 | 0 | 0 | 0 | 113.5 | L146 T150 V154 F206 M212 | L146-L210 HydrophobicContact CB-CD1 4.32Å; L146-L210 HydrophobicContact CD2-CD1 3.64Å; L146-L210 HydrophobicContact CG-CD1 3.8Å; T150-L210 HydrophobicContact CG2-CD2 4.12Å; V154-L210 HydrophobicContact CB-CD2 4.37Å; V154-L210 HydrophobicContact CG1-CD2 4.5Å; V154-L210 HydrophobicContact CG2-CD1 3.91Å; V154-L210 HydrophobicContact CG2-CD2 3.43Å; V154-L210 VanDerWaalsContact CG2-CD2 3.43Å; V154-L210 HydrophobicContact CG2-CG 4.33Å; F206-L210 VanDerWaalsContact O-CB 3.3Å; F206-L210 WeakPolarHBondContact O-CB 3.21Å; F206-L210 WeakPolarHBondContact O-CG 3.42Å; F206-L210 PolarHBondContact O-N 3.26Å; L210-M212 VanDerWaalsContact C-N 3.27Å; L210-M212 HydrophobicContact CB-CG 3.67Å; L210-M212 HydrophobicContact CB-SD 4.04Å; L210-M212 HydrophobicContact CD1-SD 4.38Å; L210-M212 VanDerWaalsContact O-CG 3.25Å; L210-M212 WeakPolarHBondContact O-CG 3.28Å; L210-M212 PolarHBondContact O-N 2.78Å |
| 211 | D | 84 | Confident | 87.1 | Confident | 117 Ų | 117 | 68.1 Ų | 68.1 | 63% | 0.626 | 33% | 0.325 | S | S | * | . | T | Hydrogen-bonded Turn | trans | 54.7 | 38.2 | -177.2 | -163.9 | 29.2 | 0 | 0 | 0 | 113.9 | V207 Q213 | V207-D211 WeakPolarHBondContact O-CA 3.21Å; V207-D211 PolarHBondContact O-N 3.21Å; D211-Q213 PolarHBondContact O-N 3.31Å |
| 212 | M | 79.7 | Confident | 87.4 | Confident | 19 Ų | 19 | 67.3 Ų | 67.3 | 9% | 0.094 | 32% | 0.317 | C | S | . | . | trans | -102.2 | 45.4 | -172.9 | -58.6 | -162.9 | 70.4 | 0 | 0 | 113.1 | M149 V207 L210 H214 Q215 | M149-M212 HydrophobicContact CB-CE 3.91Å; M149-M212 HydrophobicContact CB-SD 4.25Å; M149-M212 HydrophobicContact CE-CE 3.38Å; M149-M212 HydrophobicContact CE-SD 4.08Å; V207-M212 PolarHBondContact O-N 3.25Å; V207-M212 VanDerWaalsContact O-N 3.11Å; L210-M212 VanDerWaalsContact C-N 3.27Å; L210-M212 HydrophobicContact CB-CG 3.67Å; L210-M212 HydrophobicContact CB-SD 4.04Å; L210-M212 HydrophobicContact CD1-SD 4.38Å; L210-M212 VanDerWaalsContact O-CG 3.25Å; L210-M212 WeakPolarHBondContact O-CG 3.28Å; L210-M212 PolarHBondContact O-N 2.78Å; M212-H214 VanDerWaalsContact C-N 3.25Å; M212-H214 PolarHBondContact O-N 3.11Å; M212-H214 VanDerWaalsContact O-N 3.15Å; M212-Q215 HydrophobicContact CE-CB 4.18Å; M212-Q215 PolarHBondContact O-N 3.26Å; M212-Q215 VanDerWaalsContact O-N 3.07Å | ||
| 213 | Q | 76.3 | Confident | 87.5 | Confident | 107 Ų | 107 | 67.3 Ų | 67.3 | 50% | 0.5 | 32% | 0.317 | S | S | . | . | G | 310 helix | trans | -55.3 | -38.4 | -171.3 | -61.1 | -57.9 | -41.7 | 0 | 0 | 113.4 | V207 D211 | V207-Q213 VanDerWaalsContact CG1-CD 3.47Å; V207-Q213 HydrophobicContact CG1-CG 4.4Å; V207-Q213 VanDerWaalsContact CG1-NE2 3.32Å; V207-Q213 PolarHBondContact O-NE2 3.48Å; V207-Q213 VanDerWaalsContact O-NE2 3.17Å; D211-Q213 PolarHBondContact O-N 3.31Å |
| 214 | H | 78.7 | Confident | 87.7 | Confident | 187 Ų | 187 | 68.5 Ų | 68.5 | 87% | 0.866 | 33% | 0.327 | S | S | * | . | G | 310 helix | trans | -75.1 | -24 | -177.6 | -167.8 | 60 | 0 | 0 | 0 | 113.8 | M212 | M212-H214 VanDerWaalsContact C-N 3.25Å; M212-H214 PolarHBondContact O-N 3.11Å; M212-H214 VanDerWaalsContact O-N 3.15Å |
| 215 | Q | 81.8 | Confident | 88 | Confident | 82 Ų | 82 | 68.7 Ų | 68.7 | 38% | 0.383 | 33% | 0.332 | S | S | . | . | G | 310 helix | trans | -108.4 | 22.5 | -170.9 | -63.9 | -176.4 | -5.9 | 0 | 0 | 113.2 | M149 M212 I217 L218 V219 | M149-Q215 HydrophobicContact CE-CB 4.15Å; M212-Q215 HydrophobicContact CE-CB 4.18Å; M212-Q215 PolarHBondContact O-N 3.26Å; M212-Q215 VanDerWaalsContact O-N 3.07Å; Q215-I217 VanDerWaalsContact C-N 3.29Å; Q215-I217 PolarHBondContact O-N 3.38Å; Q215-L218 HydrophobicContact CB-CB 4.37Å; Q215-L218 VanDerWaalsContact O-CB 3.28Å; Q215-L218 WeakPolarHBondContact O-CB 3.46Å; Q215-L218 PolarHBondContact O-N 3.1Å; Q215-V219 PolarHBondContact O-N 3.48Å |
| 216 | R | 86.5 | Confident | 88.4 | Confident | 90 Ų | 90 | 67.9 Ų | 67.9 | 34% | 0.34 | 33% | 0.328 | S | S | . | . | H | α-helix | trans | -54.5 | -40.8 | -176.7 | 178.2 | 164.9 | 174.8 | -132.7 | -9.2 | 114.1 | V207 L218 V219 A220 | V207-R216 HydrophobicContact CG2-CB 3.67Å; V207-R216 HydrophobicContact CG2-CG 3.84Å; R216-L218 VanDerWaalsContact C-N 3.25Å; R216-L218 PolarHBondContact O-N 3.17Å; R216-V219 PolarHBondContact O-N 3.15Å; R216-A220 WeakPolarHBondContact O-CB 3.44Å; R216-A220 PolarHBondContact O-N 2.8Å |
| 217 | I | 89.8 | Confident | 88.6 | Confident | 151 Ų | 151 | 67.8 Ų | 67.8 | 77% | 0.774 | 33% | 0.328 | S | S | * | . | H | α-helix | trans | -64.1 | -35.7 | -179.6 | -63.2 | 169.7 | 0 | 0 | 0 | 110.6 | Q215 V219 A220 Y221 | Q215-I217 VanDerWaalsContact C-N 3.29Å; Q215-I217 PolarHBondContact O-N 3.38Å; I217-V219 VanDerWaalsContact C-N 3.34Å; I217-V219 PolarHBondContact O-N 3.46Å; I217-A220 PolarHBondContact O-N 2.93Å; I217-Y221 PolarHBondContact O-N 3.27Å |
| 218 | L | 91.3 | Very high | 89 | Confident | 96 Ų | 96 | 70.5 Ų | 70.5 | 50% | 0.503 | 35% | 0.346 | S | S | . | . | H | α-helix | trans | -65.6 | -37.6 | 179.8 | -171.6 | 60.7 | 0 | 0 | 0 | 111.7 | M149 Q215 R216 P222 | M149-L218 HydrophobicContact CE-CB 4.05Å; M149-L218 HydrophobicContact CE-CD2 3.45Å; M149-L218 VanDerWaalsContact CE-CD2 3.45Å; M149-L218 HydrophobicContact CE-CG 3.77Å; M149-L218 HydrophobicContact CG-CD2 4.43Å; M149-L218 HydrophobicContact SD-CD2 3.72Å; M149-L218 HydrophobicContact SD-CG 3.83Å; Q215-L218 HydrophobicContact CB-CB 4.37Å; Q215-L218 VanDerWaalsContact O-CB 3.28Å; Q215-L218 WeakPolarHBondContact O-CB 3.46Å; Q215-L218 PolarHBondContact O-N 3.1Å; R216-L218 VanDerWaalsContact C-N 3.25Å; R216-L218 PolarHBondContact O-N 3.17Å; L218-P222 WeakPolarHBondContact O-CD 3.28Å |
| 219 | V | 92.2 | Very high | 89.4 | Confident | 1 Ų | 1 | 64.6 Ų | 64.6 | 1% | 0.006 | 33% | 0.328 | C | S | . | . | H | α-helix | trans | -78.2 | -32.6 | 175.2 | -176.6 | 0 | 0 | 0 | 0 | 112.1 | L146 M149 F206 Q215 R216 I217 Y221 P222 C223 | L146-V219 HydrophobicContact CD1-CG1 4.34Å; M149-V219 HydrophobicContact CE-CG2 3.63Å; M149-V219 HydrophobicContact SD-CG2 4.35Å; F206-V219 HydrophobicContact CB-CG1 3.8Å; F206-V219 HydrophobicContact CD2-CG1 3.86Å; F206-V219 HydrophobicContact CG-CG1 4.14Å; Q215-V219 PolarHBondContact O-N 3.48Å; R216-V219 PolarHBondContact O-N 3.15Å; I217-V219 VanDerWaalsContact C-N 3.34Å; I217-V219 PolarHBondContact O-N 3.46Å; V219-Y221 VanDerWaalsContact C-N 3.34Å; V219-Y221 PolarHBondContact O-N 3.07Å; V219-P222 WeakPolarHBondContact O-CD 3.47Å; V219-P222 VanDerWaalsContact O-CG 3.27Å; V219-P222 WeakPolarHBondContact O-CG 3.4Å; V219-C223 PolarHBondContact O-N 3.12Å; V219-C223 PolarHBondContact O-SG 3.35Å |
| 220 | A | 92.8 | Very high | 89.8 | Confident | 21 Ų | 21 | 63.3 Ų | 63.3 | 17% | 0.174 | 32% | 0.317 | C | S | . | . | H | α-helix | trans | -64.8 | -36.7 | -179.7 | 0 | 0 | 0 | 0 | 0 | 112.8 | T199 R216 I217 C223 A224 | T199-A220 HydrophobicContact CG2-CB 4.23Å; T199-A220 WeakPolarHBondContact CG2-O 2.9Å; R216-A220 WeakPolarHBondContact O-CB 3.44Å; R216-A220 PolarHBondContact O-N 2.8Å; I217-A220 PolarHBondContact O-N 2.93Å; A220-C223 PolarHBondContact O-N 2.87Å; A220-A224 WeakPolarHBondContact O-CB 3.49Å; A220-A224 PolarHBondContact O-N 3.09Å |
| 221 | Y | 94.1 | Very high | 90.2 | Very high | 173 Ų | 173 | 62.7 Ų | 62.7 | 68% | 0.678 | 31% | 0.314 | S | S | * | . | H | α-helix | trans | -57.3 | -57.2 | 179.1 | 177.4 | -99.4 | 0 | 0 | 0 | 114.2 | I217 V219 C223 A224 L225 | I217-Y221 PolarHBondContact O-N 3.27Å; V219-Y221 VanDerWaalsContact C-N 3.34Å; V219-Y221 PolarHBondContact O-N 3.07Å; Y221-C223 VanDerWaalsContact C-N 3.3Å; Y221-C223 PolarHBondContact O-N 3.2Å; Y221-A224 WeakPolarHBondContact O-CB 3.1Å; Y221-A224 PolarHBondContact O-N 3.28Å; Y221-L225 PolarHBondContact O-N 3.34Å |
| 222 | P | 94 | Very high | 90.6 | Very high | 14 Ų | 14 | 61.7 Ų | 61.7 | 9% | 0.091 | 31% | 0.309 | C | S | . | . | H | α-helix | trans | -67.2 | -32.1 | 179.7 | 31.8 | -40.7 | 0 | 0 | 0 | 111.8 | I142 L145 L218 V219 L225 V226 | I142-P222 HydrophobicContact CD1-CB 3.59Å; I142-P222 HydrophobicContact CD1-CG 3.97Å; L145-P222 HydrophobicContact CD1-CB 3.6Å; L145-P222 HydrophobicContact CD1-CG 3.6Å; L218-P222 WeakPolarHBondContact O-CD 3.28Å; V219-P222 WeakPolarHBondContact O-CD 3.47Å; V219-P222 VanDerWaalsContact O-CG 3.27Å; V219-P222 WeakPolarHBondContact O-CG 3.4Å; P222-L225 WeakPolarHBondContact O-CB 3.28Å; P222-L225 PolarHBondContact O-N 3.46Å; P222-V226 WeakPolarHBondContact O-CG2 3.47Å; P222-V226 PolarHBondContact O-N 3.08Å; P222-V226 VanDerWaalsContact O-N 3.09Å |
| 223 | C | 94.3 | Very high | 91.1 | Very high | 0 Ų | 0 | 61.9 Ų | 61.9 | 0% | 0 | 31% | 0.31 | C | S | . | . | H | α-helix | trans | -61 | -45.9 | 171.8 | -66 | 0 | 0 | 0 | 0 | 111.3 | V219 A220 Y221 L225 V226 Y227 | V219-C223 PolarHBondContact O-N 3.12Å; V219-C223 PolarHBondContact O-SG 3.35Å; A220-C223 PolarHBondContact O-N 2.87Å; Y221-C223 VanDerWaalsContact C-N 3.3Å; Y221-C223 PolarHBondContact O-N 3.2Å; C223-L225 VanDerWaalsContact C-N 3.29Å; C223-L225 PolarHBondContact O-N 3.23Å; C223-V226 PolarHBondContact O-N 3.37Å; C223-Y227 HydrophobicContact CB-CE2 4.24Å; C223-Y227 WeakPolarHBondContact O-CD2 3.44Å; C223-Y227 PolarHBondContact O-N 2.77Å |
| 224 | A | 95.4 | Very high | 91.8 | Very high | 27 Ų | 27 | 57.2 Ų | 57.2 | 22% | 0.223 | 29% | 0.289 | C | S | . | . | H | α-helix | trans | -58.6 | -42.6 | 176.6 | 0 | 0 | 0 | 0 | 0 | 111.3 | T199 A220 Y221 V226 Y227 C228 | T199-A224 HydrophobicContact CG2-CB 3.76Å; T199-A224 WeakPolarHBondContact OG1-CA 3.42Å; A220-A224 WeakPolarHBondContact O-CB 3.49Å; A220-A224 PolarHBondContact O-N 3.09Å; Y221-A224 WeakPolarHBondContact O-CB 3.1Å; Y221-A224 PolarHBondContact O-N 3.28Å; A224-V226 PolarHBondContact O-N 2.75Å; A224-Y227 PolarHBondContact O-N 2.54Å; A224-C228 WeakPolarHBondContact O-CB 3.25Å; A224-C228 PolarHBondContact O-N 3.41Å; A224-C228 PolarHBondContact O-SG 2.94Å |
| 225 | L | 95.1 | Very high | 92.4 | Very high | 93 Ų | 93 | 49 Ų | 49 | 49% | 0.487 | 25% | 0.252 | S | S | . | . | H | α-helix | trans | -57.2 | -50.9 | 176.5 | -160.6 | -179.2 | 0 | 0 | 0 | 110.8 | Y221 P222 C223 Y227 C228 V229 | Y221-L225 PolarHBondContact O-N 3.34Å; P222-L225 WeakPolarHBondContact O-CB 3.28Å; P222-L225 PolarHBondContact O-N 3.46Å; C223-L225 VanDerWaalsContact C-N 3.29Å; C223-L225 PolarHBondContact O-N 3.23Å; L225-Y227 PolarHBondContact O-N 2.79Å; L225-C228 WeakPolarHBondContact O-CB 3.3Å; L225-C228 PolarHBondContact O-N 2.97Å; L225-V229 HydrophobicContact CD2-CG2 3.79Å; L225-V229 WeakPolarHBondContact O-CG2 3.26Å; L225-V229 PolarHBondContact O-N 3.31Å |
| 226 | V | 95.3 | Very high | 92.5 | Very high | 20 Ų | 20 | 52.4 Ų | 52.4 | 12% | 0.121 | 27% | 0.266 | C | S | . | . | H | α-helix | trans | -58.8 | -49.1 | 179.3 | 173.4 | 0 | 0 | 0 | 0 | 111.2 | I142 P222 C223 A224 V229 F230 | I142-V226 HydrophobicContact CD1-CG2 4.28Å; I142-V226 HydrophobicContact CG1-CG2 3.99Å; P222-V226 WeakPolarHBondContact O-CG2 3.47Å; P222-V226 PolarHBondContact O-N 3.08Å; P222-V226 VanDerWaalsContact O-N 3.09Å; C223-V226 PolarHBondContact O-N 3.37Å; A224-V226 PolarHBondContact O-N 2.75Å; V226-V229 PolarHBondContact O-N 2.81Å; V226-F230 HydrophobicContact CG1-CD2 3.83Å; V226-F230 HydrophobicContact CG1-CE2 3.55Å; V226-F230 WeakPolarHBondContact O-CD2 3.23Å; V226-F230 PolarHBondContact O-N 3.12Å; V226-F230 VanDerWaalsContact O-N 3.1Å |
| 227 | Y | 95.5 | Very high | 92.8 | Very high | 0 Ų | 0 | 50.6 Ų | 50.6 | 0% | 0 | 26% | 0.262 | C | S | . | . | H | α-helix | trans | -68.3 | -35.2 | 179.1 | -66.4 | -60 | 0 | 0 | 0 | 113.4 | L163 C166 L167 C198 S202 C223 A224 L225 V229 F230 A231 | L163-Y227 WeakPolarHBondContact CA-OH 2.86Å; L163-Y227 HydrophobicContact CD2-CE2 4.36Å; L163-Y227 WeakPolarHBondContact CD2-OH 3.36Å; L163-Y227 PolarHBondContact O-OH 3.3Å; C166-Y227 HydrophobicContact CB-CE1 4.3Å; C166-Y227 WeakPolarHBondContact CB-OH 3.23Å; L167-Y227 HydrophobicContact CD2-CD1 3.92Å; L167-Y227 HydrophobicContact CD2-CE1 3.78Å; L167-Y227 HydrophobicContact CG-CE1 4.24Å; C198-Y227 HydrophobicContact CB-CD1 3.81Å; C198-Y227 HydrophobicContact CB-CD2 3.85Å; C198-Y227 HydrophobicContact CB-CE1 4.03Å; C198-Y227 HydrophobicContact CB-CE2 4.09Å; C198-Y227 HydrophobicContact CB-CG 3.74Å; S202-Y227 WeakPolarHBondContact CB-OH 3.39Å; S202-Y227 PolarHBondContact OG-OH 3.08Å; C223-Y227 HydrophobicContact CB-CE2 4.24Å; C223-Y227 WeakPolarHBondContact O-CD2 3.44Å; C223-Y227 PolarHBondContact O-N 2.77Å; A224-Y227 PolarHBondContact O-N 2.54Å; L225-Y227 PolarHBondContact O-N 2.79Å; Y227-V229 VanDerWaalsContact C-N 3.27Å; Y227-V229 PolarHBondContact O-N 2.9Å; Y227-F230 PolarHBondContact O-N 2.82Å; Y227-A231 VanDerWaalsContact O-CB 3.26Å; Y227-A231 WeakPolarHBondContact O-CB 3.2Å; Y227-A231 PolarHBondContact O-N 3.28Å |
| 228 | C | 95.4 | Very high | 93 | Very high | 58 Ų | 58 | 45.3 Ų | 45.3 | 39% | 0.392 | 24% | 0.235 | S | C | . | . | H | α-helix | trans | -57.8 | -42.7 | 171.8 | -79.8 | 0 | 0 | 0 | 0 | 110.8 | A224 L225 A231 L232 | A224-C228 WeakPolarHBondContact O-CB 3.25Å; A224-C228 PolarHBondContact O-N 3.41Å; A224-C228 PolarHBondContact O-SG 2.94Å; L225-C228 WeakPolarHBondContact O-CB 3.3Å; L225-C228 PolarHBondContact O-N 2.97Å; C228-A231 WeakPolarHBondContact O-CB 3.41Å; C228-A231 PolarHBondContact O-N 2.75Å; C228-L232 WeakPolarHBondContact O-CG 3.49Å; C228-L232 PolarHBondContact O-N 3.41Å |
| 229 | V | 94.4 | Very high | 93 | Very high | 41 Ų | 41 | 42.4 Ų | 42.4 | 25% | 0.248 | 22% | 0.22 | C | C | . | . | H | α-helix | trans | -68.4 | -42.4 | -179.9 | 172.9 | 0 | 0 | 0 | 0 | 111.6 | L134 L225 V226 Y227 A231 L232 L233 | L134-V229 HydrophobicContact CD1-CG1 3.55Å; L134-V229 HydrophobicContact CD2-CG1 3.56Å; L134-V229 HydrophobicContact CG-CG1 4.05Å; L225-V229 HydrophobicContact CD2-CG2 3.79Å; L225-V229 WeakPolarHBondContact O-CG2 3.26Å; L225-V229 PolarHBondContact O-N 3.31Å; V226-V229 PolarHBondContact O-N 2.81Å; Y227-V229 VanDerWaalsContact C-N 3.27Å; Y227-V229 PolarHBondContact O-N 2.9Å; V229-A231 VanDerWaalsContact C-N 3.26Å; V229-A231 PolarHBondContact O-N 3.49Å; V229-L232 PolarHBondContact O-N 2.96Å; V229-L233 PolarHBondContact O-N 3.45Å |
| 230 | F | 93.7 | Very high | 93.1 | Very high | 15 Ų | 15 | 44.9 Ų | 44.9 | 7% | 0.066 | 23% | 0.233 | C | C | . | . | H | α-helix | trans | -61.3 | -36.4 | 170.6 | -75.7 | -64.7 | 0 | 0 | 0 | 112.5 | F116 L167 V226 Y227 L233 V234 | F116-F230 AromaticContact CE1-CD1 3.79Å; F116-F230 HydrophobicContact CE1-CD1 3.79Å; F116-F230 HydrophobicContact CE1-CE1 4.45Å; F116-F230 HydrophobicContact CZ-CB 4.27Å; F116-F230 HydrophobicContact CZ-CD1 4.21Å; L167-F230 HydrophobicContact CD2-CD2 4.03Å; L167-F230 HydrophobicContact CD2-CE2 4.44Å; L167-F230 HydrophobicContact CD2-CG 4.26Å; V226-F230 HydrophobicContact CG1-CD2 3.83Å; V226-F230 HydrophobicContact CG1-CE2 3.55Å; V226-F230 WeakPolarHBondContact O-CD2 3.23Å; V226-F230 PolarHBondContact O-N 3.12Å; V226-F230 VanDerWaalsContact O-N 3.1Å; Y227-F230 PolarHBondContact O-N 2.82Å; F230-L233 HydrophobicContact CD1-CD1 4.35Å; F230-L233 WeakPolarHBondContact O-CB 3.5Å; F230-L233 PolarHBondContact O-N 3.03Å; F230-V234 PolarHBondContact O-N 3.41Å |
| 231 | A | 93.4 | Very high | 93.1 | Very high | 4 Ų | 4 | 46.4 Ų | 46.4 | 3% | 0.033 | 24% | 0.237 | C | C | . | . | H | α-helix | trans | -66.6 | -37 | 175.3 | 0 | 0 | 0 | 0 | 0 | 113.9 | M170 T191 V195 Y227 C228 V229 L233 V234 V235 | M170-A231 HydrophobicContact CE-CB 3.7Å; M170-A231 HydrophobicContact SD-CB 3.99Å; T191-A231 HydrophobicContact CG2-CB 3.64Å; V195-A231 HydrophobicContact CG2-CB 3.44Å; V195-A231 VanDerWaalsContact CG2-CB 3.44Å; Y227-A231 VanDerWaalsContact O-CB 3.26Å; Y227-A231 WeakPolarHBondContact O-CB 3.2Å; Y227-A231 PolarHBondContact O-N 3.28Å; C228-A231 WeakPolarHBondContact O-CB 3.41Å; C228-A231 PolarHBondContact O-N 2.75Å; V229-A231 VanDerWaalsContact C-N 3.26Å; V229-A231 PolarHBondContact O-N 3.49Å; A231-L233 VanDerWaalsContact C-N 3.29Å; A231-L233 PolarHBondContact O-N 3.14Å; A231-V234 PolarHBondContact O-N 3.37Å; A231-V235 WeakPolarHBondContact O-CG2 3.29Å; A231-V235 PolarHBondContact O-N 3.49Å |
| 232 | L | 92.5 | Very high | 93.1 | Very high | 97 Ų | 97 | 37.9 Ų | 37.9 | 51% | 0.508 | 21% | 0.207 | S | C | . | . | H | α-helix | trans | -61.3 | -37.7 | 173 | -71 | 173.3 | 0 | 0 | 0 | 111.7 | C228 V229 V234 V235 F236 | C228-L232 WeakPolarHBondContact O-CG 3.49Å; C228-L232 PolarHBondContact O-N 3.41Å; V229-L232 PolarHBondContact O-N 2.96Å; L232-V234 VanDerWaalsContact C-N 3.26Å; L232-V234 PolarHBondContact O-N 3.48Å; L232-V235 PolarHBondContact O-N 2.98Å; L232-F236 HydrophobicContact CD2-CD2 3.9Å; L232-F236 HydrophobicContact CD2-CE2 3.75Å; L232-F236 WeakPolarHBondContact O-CB 3.36Å; L232-F236 PolarHBondContact O-N 3.07Å |
| 233 | L | 91.3 | Very high | 93 | Very high | 23 Ų | 23 | 39.6 Ų | 39.6 | 12% | 0.12 | 22% | 0.215 | C | C | . | . | H | α-helix | trans | -63.6 | -30.9 | 173.2 | -65.2 | 178.5 | 0 | 0 | 0 | 113.1 | L120 K125 I131 L134 V229 F230 A231 | L120-L233 HydrophobicContact CD1-CB 4.47Å; L120-L233 WeakPolarHBondContact CD2-O 3.43Å; K125-L233 WeakPolarHBondContact CD-O 3.27Å; K125-L233 PolarHBondContact NZ-O 2.93Å; I131-L233 HydrophobicContact CG1-CD1 4Å; L134-L233 HydrophobicContact CD1-CD1 3.84Å; L134-L233 HydrophobicContact CD1-CD2 4.34Å; L134-L233 HydrophobicContact CD1-CG 4.25Å; V229-L233 PolarHBondContact O-N 3.45Å; F230-L233 HydrophobicContact CD1-CD1 4.35Å; F230-L233 WeakPolarHBondContact O-CB 3.5Å; F230-L233 PolarHBondContact O-N 3.03Å; A231-L233 VanDerWaalsContact C-N 3.29Å; A231-L233 PolarHBondContact O-N 3.14Å |
| 234 | V | 91.3 | Very high | 92.9 | Very high | 8 Ų | 8 | 42.7 Ų | 42.7 | 5% | 0.048 | 23% | 0.232 | C | C | . | . | H | α-helix | trans | -75.9 | -35.7 | 176.7 | 172.5 | 0 | 0 | 0 | 0 | 111.5 | F116 L120 K125 M170 L173 L182 F230 A231 L232 | F116-V234 HydrophobicContact CE2-CG2 3.35Å; F116-V234 HydrophobicContact CZ-CG2 3.64Å; L120-V234 HydrophobicContact CD2-CG2 4Å; K125-V234 VanDerWaalsContact NZ-C 3.27Å; K125-V234 PolarHBondContact NZ-O 3.06Å; M170-V234 HydrophobicContact CE-CB 3.71Å; M170-V234 HydrophobicContact CE-CG1 4.23Å; M170-V234 HydrophobicContact CE-CG2 3.4Å; L173-V234 HydrophobicContact CG-CG1 4.25Å; L182-V234 HydrophobicContact CD1-CG1 3.46Å; L182-V234 VanDerWaalsContact CD1-CG1 3.46Å; F230-V234 PolarHBondContact O-N 3.41Å; A231-V234 PolarHBondContact O-N 3.37Å; L232-V234 VanDerWaalsContact C-N 3.26Å; L232-V234 PolarHBondContact O-N 3.48Å |
| 235 | V | 89.4 | Confident | 92.7 | Very high | 16 Ų | 16 | 44 Ų | 44 | 10% | 0.097 | 23% | 0.233 | C | C | . | . | H | α-helix | trans | -81.8 | -47.1 | -178.4 | 176.5 | 0 | 0 | 0 | 0 | 112.4 | K125 L182 T191 A231 L232 | K125-V235 PolarHBondContact NZ-O 2.94Å; L182-V235 HydrophobicContact CB-CG2 4.41Å; T191-V235 HydrophobicContact CG2-CG2 4.05Å; A231-V235 WeakPolarHBondContact O-CG2 3.29Å; A231-V235 PolarHBondContact O-N 3.49Å; L232-V235 PolarHBondContact O-N 2.98Å |
| 236 | F | 84.8 | Confident | 92.4 | Very high | 153 Ų | 153 | 39.5 Ų | 39.5 | 67% | 0.671 | 21% | 0.21 | S | C | * | . | trans | -98.7 | 0 | -178.5 | -63.3 | -74.1 | 0 | 0 | 0 | 111.9 | K125 L232 | K125-F236 WeakPolarHBondContact CD-OXT 3.05Å; K125-F236 VanDerWaalsContact CE-C 3.44Å; K125-F236 WeakPolarHBondContact CE-O 3.02Å; K125-F236 WeakPolarHBondContact CE-OXT 3.5Å; K125-F236 VanDerWaalsContact NZ-N 3.17Å; K125-F236 PolarHBondContact NZ-O 3.49Å; K125-F236 PolarHBondContact NZ-OXT 3.43Å; L232-F236 HydrophobicContact CD2-CD2 3.9Å; L232-F236 HydrophobicContact CD2-CE2 3.75Å; L232-F236 WeakPolarHBondContact O-CB 3.36Å; L232-F236 PolarHBondContact O-N 3.07Å |
Retrieved 236 of 236 residues in 64.5 ms
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