| 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 | 32.9 | Very low | 31.1 | Very low | 213 Ų | 213 | 146.1 Ų | 146.1 | 100% | 1.049 | 82% | 0.819 | S | S | * | * | 0 | 100.8 | 0 | -170.5 | 173.3 | -175.3 | 0 | 0 | 107.2 | A3 | M1-A3 PolarHBondContact O-N 3.48Š| |||
| 2 | Y | 29.9 | Very low | 31.7 | Very low | 248 Ų | 248 | 148.5 Ų | 148.5 | 97% | 0.973 | 83% | 0.826 | S | S | * | * | trans | -78.5 | 93.9 | 173.6 | -76.4 | -87.9 | 0 | 0 | 0 | 107.7 | ||||
| 3 | A | 32.6 | Very low | 31.9 | Very low | 67 Ų | 67 | 143 Ų | 143 | 55% | 0.554 | 80% | 0.804 | S | S | * | * | trans | -117 | 97.1 | 176.8 | 0 | 0 | 0 | 0 | 0 | 109.5 | M1 | M1-A3 PolarHBondContact O-N 3.48Š| ||
| 4 | C | 27.8 | Very low | 32.4 | Very low | 118 Ų | 118 | 139.8 Ų | 139.8 | 80% | 0.797 | 79% | 0.792 | S | S | * | * | trans | 50.6 | 87.9 | 140.5 | -55.1 | 0 | 0 | 0 | 0 | 118.6 | ||||
| 5 | F | 29.4 | Very low | 33.2 | Very low | 186 Ų | 186 | 136.6 Ų | 136.6 | 82% | 0.816 | 79% | 0.79 | S | S | * | * | trans | -93.8 | 83.9 | 140.8 | -75.2 | -74.6 | 0 | 0 | 0 | 107.9 | I26 | F5-I26 HydrophobicContact CD1-CG2 4Å; F5-I26 HydrophobicContact CE1-CG2 3.44Å; F5-I26 VanDerWaalsContact CE1-CG2 3.44Å; F5-I26 HydrophobicContact CZ-CG2 3.98Å | ||
| 6 | A | 26.9 | Very low | 34 | Very low | 82 Ų | 82 | 143.1 Ų | 143.1 | 68% | 0.678 | 80% | 0.797 | S | S | * | * | trans | -130.7 | 94 | 171.1 | 0 | 0 | 0 | 0 | 0 | 107.5 | ||||
| 7 | V | 32.2 | Very low | 34.7 | Very low | 137 Ų | 137 | 141.5 Ų | 141.5 | 83% | 0.83 | 78% | 0.78 | S | S | * | * | trans | -140.8 | 94.6 | 163.2 | -174.2 | 0 | 0 | 0 | 0 | 110.4 | ||||
| 8 | V | 32.9 | Very low | 35.1 | Very low | 129 Ų | 129 | 142.7 Ų | 142.7 | 78% | 0.782 | 78% | 0.779 | S | S | * | * | trans | 53.6 | 103.8 | 133.8 | -171.3 | 0 | 0 | 0 | 0 | 119 | ||||
| 9 | D | 31.3 | Very low | 35.6 | Very low | 164 Ų | 164 | 145.4 Ų | 145.4 | 88% | 0.877 | 79% | 0.785 | S | S | * | * | trans | -57.2 | 132.6 | 159.8 | -75.9 | -51.3 | 0 | 0 | 0 | 112.6 | ||||
| 10 | L | 34.3 | Very low | 36.2 | Very low | 170 Ų | 170 | 143.5 Ų | 143.5 | 89% | 0.89 | 78% | 0.779 | S | S | * | * | trans | -114 | 110.9 | 157.7 | -92.3 | 159.7 | 0 | 0 | 0 | 108.7 | I12 | L10-I12 PolarHBondContact O-N 3.3Š| ||
| 11 | A | 32.1 | Very low | 36.5 | Very low | 93 Ų | 93 | 141.7 Ų | 141.7 | 77% | 0.769 | 77% | 0.765 | S | S | * | * | trans | -72.1 | 105.6 | 177.9 | 0 | 0 | 0 | 0 | 0 | 110.7 | ||||
| 12 | I | 37.9 | Very low | 37 | Very low | 175 Ų | 175 | 140.2 Ų | 140.2 | 90% | 0.897 | 75% | 0.754 | S | S | * | * | trans | 179.7 | 88.9 | 143.4 | -80.1 | 140.7 | 0 | 0 | 0 | 105.6 | L10 | L10-I12 PolarHBondContact O-N 3.3Š| ||
| 13 | S | 34 | Very low | 37.7 | Very low | 77 Ų | 77 | 133.8 Ų | 133.8 | 54% | 0.538 | 73% | 0.731 | S | S | . | * | trans | -149.8 | 141 | 166.3 | -166.5 | 0 | 0 | 0 | 0 | 110.1 | ||||
| 14 | P | 38.8 | Very low | 38.2 | Very low | 98 Ų | 98 | 133.6 Ų | 133.6 | 64% | 0.636 | 74% | 0.735 | S | S | * | * | trans | -67.5 | 140.7 | -173.6 | -13.4 | 27.7 | 0 | 0 | 0 | 112.5 | R16 | P14-R16 PolarHBondContact O-N 3.09Š| ||
| 15 | A | 44.9 | Very low | 38.7 | Very low | 92 Ų | 92 | 137.3 Ų | 137.3 | 76% | 0.76 | 74% | 0.738 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -58.3 | 10.9 | -172.4 | 0 | 0 | 0 | 0 | 0 | 118.3 | ||
| 16 | R | 46.4 | Very low | 39.3 | Very low | 240 Ų | 240 | 133.1 Ų | 133.1 | 91% | 0.906 | 72% | 0.724 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -100.7 | -2.4 | 179.5 | -87.4 | -172.1 | -155.1 | -177.1 | 7.8 | 115.4 | P14 | P14-R16 PolarHBondContact O-N 3.09Š|
| 17 | F | 45.2 | Very low | 40.1 | Very low | 117 Ų | 117 | 134.7 Ų | 134.7 | 51% | 0.513 | 72% | 0.72 | S | S | . | * | S | Bend | trans | -108.3 | 9.4 | 176.3 | -69.8 | -74.6 | 0 | 0 | 0 | 114.1 | E19 T20 E21 | F17-E19 PolarHBondContact O-N 3.33Å; F17-T20 PolarHBondContact O-N 2.84Å; F17-E21 HydrophobicContact CB-CG 3.96Å; F17-E21 VanDerWaalsContact CB-OE1 3.23Å; F17-E21 WeakPolarHBondContact CB-OE1 3.5Å; F17-E21 WeakPolarHBondContact O-CG 3.42Å; F17-E21 PolarHBondContact O-N 3.5Å |
| 18 | H | 43.1 | Very low | 40.3 | Very low | 162 Ų | 162 | 136.6 Ų | 136.6 | 75% | 0.75 | 72% | 0.722 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -69.4 | -5.4 | -168.6 | -141.7 | -64.9 | 0 | 0 | 0 | 115.8 | ||
| 19 | E | 44.3 | Very low | 40.6 | Very low | 194 Ų | 194 | 138 Ų | 138 | 91% | 0.907 | 73% | 0.725 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -115.6 | -4.7 | -179.7 | -71.6 | -172.6 | 168.8 | 0 | 0 | 114.4 | F17 | F17-E19 PolarHBondContact O-N 3.33Š|
| 20 | T | 48.1 | Very low | 40.9 | Very low | 108 Ų | 108 | 137.7 Ų | 137.7 | 66% | 0.663 | 73% | 0.729 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -127.2 | -2.9 | -178.2 | 43.7 | 0 | 0 | 0 | 0 | 114.8 | F17 F22 | F17-T20 PolarHBondContact O-N 2.84Å; T20-F22 PolarHBondContact O-N 3.42Å |
| 21 | E | 40.7 | Very low | 40.8 | Very low | 105 Ų | 105 | 132.8 Ų | 132.8 | 49% | 0.491 | 72% | 0.719 | S | S | . | * | T | Hydrogen-bonded Turn | trans | -71.8 | -7.5 | 179.2 | -80.6 | 177.1 | 173.1 | 0 | 0 | 114.9 | F17 F23 | F17-E21 HydrophobicContact CB-CG 3.96Å; F17-E21 VanDerWaalsContact CB-OE1 3.23Å; F17-E21 WeakPolarHBondContact CB-OE1 3.5Å; F17-E21 WeakPolarHBondContact O-CG 3.42Å; F17-E21 PolarHBondContact O-N 3.5Å; E21-F23 PolarHBondContact O-N 3.07Å |
| 22 | F | 43.9 | Very low | 40.7 | Very low | 182 Ų | 182 | 137.3 Ų | 137.3 | 80% | 0.798 | 73% | 0.73 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -74.8 | -19.1 | -177.9 | -108.9 | -84.9 | 0 | 0 | 0 | 115.1 | T20 | T20-F22 PolarHBondContact O-N 3.42Š|
| 23 | F | 45.5 | Very low | 40.3 | Very low | 113 Ų | 113 | 132.8 Ų | 132.8 | 50% | 0.496 | 73% | 0.726 | S | S | . | * | S | Bend | trans | -97.2 | -14.6 | -168.8 | -111.8 | -86.8 | 0 | 0 | 0 | 115.3 | E21 S128 | E21-F23 PolarHBondContact O-N 3.07Å; F23-S128 WeakPolarHBondContact CD1-OG 3.42Å; F23-S128 WeakPolarHBondContact CE1-OG 3.33Å |
| 24 | G | 42 | Very low | 40.1 | Very low | 63 Ų | 63 | 137.8 Ų | 137.8 | 65% | 0.649 | 75% | 0.747 | S | S | * | * | S | Bend | trans | -97.7 | -14.6 | -171.4 | 0 | 0 | 0 | 0 | 0 | 116.5 | ||
| 25 | F | 37.9 | Very low | 39.8 | Very low | 196 Ų | 196 | 136.2 Ų | 136.2 | 86% | 0.86 | 75% | 0.749 | S | S | * | * | S | Bend | trans | -103 | -4 | -164.8 | -119 | -89.7 | 0 | 0 | 0 | 115.7 | ||
| 26 | I | 43.1 | Very low | 39.1 | Very low | 99 Ų | 99 | 140.6 Ų | 140.6 | 51% | 0.508 | 76% | 0.758 | S | S | . | * | S | Bend | trans | -93.8 | -4.6 | -167.6 | -55.4 | 179 | 0 | 0 | 0 | 113.3 | F5 | F5-I26 HydrophobicContact CD1-CG2 4Å; F5-I26 HydrophobicContact CE1-CG2 3.44Å; F5-I26 VanDerWaalsContact CE1-CG2 3.44Å; F5-I26 HydrophobicContact CZ-CG2 3.98Å |
| 27 | L | 43 | Very low | 38.4 | Very low | 114 Ų | 114 | 137.9 Ų | 137.9 | 60% | 0.597 | 76% | 0.756 | S | S | * | * | S | Bend | trans | -114 | 1.2 | -164.2 | -110.1 | 153.7 | 0 | 0 | 0 | 117.3 | I135 | L27-I135 HydrophobicContact CD1-CD1 3.5Å; L27-I135 HydrophobicContact CD1-CG1 4.31Å; L27-I135 HydrophobicContact CD2-CD1 4Å; L27-I135 HydrophobicContact CD2-CG1 3.95Å; L27-I135 HydrophobicContact CG-CD1 3.7Å; L27-I135 HydrophobicContact CG-CG1 4.22Å |
| 28 | M | 37.7 | Very low | 37.8 | Very low | 177 Ų | 177 | 138.1 Ų | 138.1 | 87% | 0.872 | 77% | 0.772 | S | S | * | * | S | Bend | trans | -109.1 | 4.3 | -167 | -76.8 | -171.7 | 73.8 | 0 | 0 | 118.1 | ||
| 29 | D | 38 | Very low | 37.2 | Very low | 160 Ų | 160 | 137.7 Ų | 137.7 | 86% | 0.856 | 78% | 0.775 | S | S | * | * | trans | -128.7 | 18.7 | -161.6 | -116 | -2.3 | 0 | 0 | 0 | 119.7 | ||||
| 30 | V | 39.1 | Very low | 36.7 | Very low | 157 Ų | 157 | 133.5 Ų | 133.5 | 95% | 0.952 | 77% | 0.774 | S | S | * | * | trans | -130.9 | 76.2 | 177.4 | -167 | 0 | 0 | 0 | 0 | 113.2 | ||||
| 31 | G | 30.3 | Very low | 36.1 | Very low | 67 Ų | 67 | 133.2 Ų | 133.2 | 69% | 0.691 | 78% | 0.783 | S | S | * | * | trans | -112.7 | 146.1 | 160 | 0 | 0 | 0 | 0 | 0 | 111.2 | ||||
| 32 | L | 30.3 | Very low | 35.7 | Very low | 188 Ų | 188 | 140.5 Ų | 140.5 | 98% | 0.984 | 81% | 0.806 | S | S | * | * | trans | 83.4 | 116.6 | 166.3 | -101 | 76.6 | 0 | 0 | 0 | 119.8 | ||||
| 33 | G | 31 | Very low | 35.3 | Very low | 80 Ų | 80 | 138 Ų | 138 | 83% | 0.825 | 81% | 0.81 | S | S | * | * | trans | 175.9 | 72.6 | 160 | 0 | 0 | 0 | 0 | 0 | 115.6 | ||||
| 34 | N | 29.3 | Very low | 35.8 | Very low | 181 Ų | 181 | 141.4 Ų | 141.4 | 97% | 0.968 | 82% | 0.824 | S | S | * | * | trans | -89.8 | 140.6 | 166.3 | -95.1 | -21.2 | 0 | 0 | 0 | 110.8 | ||||
| 35 | G | 32.3 | Very low | 36 | Very low | 66 Ų | 66 | 144.9 Ų | 144.9 | 68% | 0.68 | 84% | 0.835 | S | S | * | * | trans | -173.5 | 97.9 | 167.4 | 0 | 0 | 0 | 0 | 0 | 111 | ||||
| 36 | L | 31.2 | Very low | 36.8 | Very low | 183 Ų | 183 | 141.2 Ų | 141.2 | 96% | 0.958 | 82% | 0.823 | S | S | * | * | 84.1 | 110.7 | 96.5 | -78.7 | 172 | 0 | 0 | 0 | 115.4 | |||||
| 37 | E | 31 | Very low | 37.5 | Very low | 183 Ų | 183 | 147.7 Ų | 147.7 | 86% | 0.855 | 84% | 0.841 | S | S | * | * | trans | -75.6 | 146.6 | 175.9 | -156.8 | 174.4 | -161.7 | 0 | 0 | 111.4 | ||||
| 38 | S | 31.6 | Very low | 37.8 | Very low | 122 Ų | 122 | 148.3 Ų | 148.3 | 85% | 0.853 | 85% | 0.845 | S | S | * | * | trans | -130.2 | 124.3 | 173.6 | -155.6 | 0 | 0 | 0 | 0 | 112.2 | ||||
| 39 | N | 31.7 | Very low | 39.4 | Very low | 153 Ų | 153 | 142.8 Ų | 142.8 | 82% | 0.818 | 83% | 0.833 | S | S | * | * | trans | -83.2 | 125.3 | 178.5 | -79.1 | -58.8 | 0 | 0 | 0 | 111.4 | ||||
| 40 | A | 33.4 | Very low | 40.4 | Very low | 106 Ų | 106 | 142.1 Ų | 142.1 | 88% | 0.876 | 83% | 0.828 | S | S | * | * | trans | -162.6 | 100.9 | 155.8 | 0 | 0 | 0 | 0 | 0 | 112.7 | ||||
| 41 | A | 35.1 | Very low | 41.4 | Very low | 103 Ų | 103 | 139.3 Ų | 139.3 | 85% | 0.851 | 81% | 0.808 | S | S | * | * | trans | -142.8 | 107.2 | 156.8 | 0 | 0 | 0 | 0 | 0 | 110.4 | ||||
| 42 | R | 33.4 | Very low | 42.9 | Very low | 258 Ų | 258 | 140.9 Ų | 140.9 | 97% | 0.974 | 80% | 0.8 | S | S | * | * | P | Polyproline II helix | trans | -73.6 | 119.4 | 172.3 | -77.3 | -178 | 175.1 | -162.3 | -0.8 | 109.6 | ||
| 43 | C | 35.6 | Very low | 44.7 | Very low | 130 Ų | 130 | 140.6 Ų | 140.6 | 88% | 0.878 | 79% | 0.791 | S | S | * | * | P | Polyproline II helix | trans | -97.3 | 124.5 | 174.2 | -117.8 | 0 | 0 | 0 | 0 | 111.2 | ||
| 44 | K | 54.2 | Low | 46.4 | Very low | 183 Ų | 183 | 144.5 Ų | 144.5 | 80% | 0.796 | 79% | 0.785 | S | S | * | * | P | Polyproline II helix | trans | -76.3 | 149.5 | 169.7 | -77.5 | 175.6 | 177.4 | 172.7 | 0 | 110 | I46 | K44-I46 PolarHBondContact O-N 3.41Å; K44-I46 VanDerWaalsContact O-N 3.09Å |
| 45 | P | 46.8 | Very low | 47.9 | Very low | 136 Ų | 136 | 137.6 Ų | 137.6 | 88% | 0.883 | 75% | 0.751 | S | S | * | * | trans | -69.8 | 108.4 | 177.3 | 28.2 | -32.6 | 0 | 0 | 0 | 110.1 | ||||
| 46 | I | 55.2 | Low | 49.5 | Very low | 120 Ų | 120 | 137 Ų | 137 | 62% | 0.615 | 74% | 0.74 | S | S | * | * | trans | -98.9 | 138.5 | 173.6 | -61.2 | 170.9 | 0 | 0 | 0 | 107.8 | K44 L48 L51 | K44-I46 PolarHBondContact O-N 3.41Å; K44-I46 VanDerWaalsContact O-N 3.09Å; I46-L48 PolarHBondContact O-N 3.47Å; I46-L51 HydrophobicContact CG2-CD1 3.47Å; I46-L51 VanDerWaalsContact CG2-CD1 3.47Å | ||
| 47 | R | 56.7 | Low | 51.4 | Low | 235 Ų | 235 | 133.8 Ų | 133.8 | 89% | 0.887 | 73% | 0.727 | S | S | * | * | trans | -58.5 | 95.5 | -179.8 | -67.3 | -176.1 | 176.6 | -174.3 | -1.1 | 111 | G49 | R47-G49 PolarHBondContact O-N 3.15Š| ||
| 48 | L | 50.9 | Low | 52.9 | Low | 127 Ų | 127 | 131.2 Ų | 131.2 | 67% | 0.665 | 72% | 0.719 | S | S | * | * | H | α-helix | trans | -63.5 | -31.8 | -167 | -154.1 | 79.7 | 0 | 0 | 0 | 114.3 | I46 L50 L51 L52 | I46-L48 PolarHBondContact O-N 3.47Å; L48-L50 PolarHBondContact O-N 3.07Å; L48-L51 PolarHBondContact O-N 2.79Å; L48-L52 HydrophobicContact CB-CD1 4.49Å; L48-L52 HydrophobicContact CD2-CD1 3.84Å; L48-L52 HydrophobicContact CG-CD1 3.79Å; L48-L52 HydrophobicContact CG-CG 4.31Å; L48-L52 WeakPolarHBondContact O-CD1 3.34Å; L48-L52 WeakPolarHBondContact O-CG 3.3Å; L48-L52 PolarHBondContact O-N 3.17Å |
| 49 | G | 69.9 | Low | 54.6 | Low | 61 Ų | 61 | 130.7 Ų | 130.7 | 63% | 0.629 | 71% | 0.706 | S | S | * | * | H | α-helix | trans | -67.8 | -34.4 | -167.7 | 0 | 0 | 0 | 0 | 0 | 115.6 | R47 | R47-G49 PolarHBondContact O-N 3.15Å |
| 50 | L | 60.3 | Low | 56.5 | Low | 145 Ų | 145 | 129.7 Ų | 129.7 | 76% | 0.759 | 70% | 0.7 | S | S | * | * | H | α-helix | trans | -86.4 | -27.4 | -179.7 | -149.3 | 83.8 | 0 | 0 | 0 | 112.3 | L48 | L48-L50 PolarHBondContact O-N 3.07Å |
| 51 | L | 58.7 | Low | 58.2 | Low | 99 Ų | 99 | 127.7 Ų | 127.7 | 52% | 0.518 | 68% | 0.678 | S | S | . | * | H | α-helix | trans | -71.9 | -41.1 | 175.5 | -94.2 | 158.9 | 0 | 0 | 0 | 111.5 | I46 L48 K53 K54 S55 | I46-L51 HydrophobicContact CG2-CD1 3.47Å; I46-L51 VanDerWaalsContact CG2-CD1 3.47Å; L48-L51 PolarHBondContact O-N 2.79Å; L51-K53 PolarHBondContact O-N 3.21Å; L51-K54 PolarHBondContact O-N 3.28Å; L51-K54 VanDerWaalsContact O-N 3.17Å; L51-S55 VanDerWaalsContact O-CB 3.3Å; L51-S55 WeakPolarHBondContact O-CB 3.38Å; L51-S55 PolarHBondContact O-N 3.49Å; L51-S55 PolarHBondContact O-OG 3.25Å; L51-S55 VanDerWaalsContact O-OG 3.07Å |
| 52 | L | 62.8 | Low | 59.8 | Low | 100 Ų | 100 | 124.2 Ų | 124.2 | 52% | 0.524 | 65% | 0.652 | S | S | . | * | H | α-helix | trans | -54.7 | -37.7 | 178.2 | -86 | 161.7 | 0 | 0 | 0 | 113.2 | L48 S55 A56 | L48-L52 HydrophobicContact CB-CD1 4.49Å; L48-L52 HydrophobicContact CD2-CD1 3.84Å; L48-L52 HydrophobicContact CG-CD1 3.79Å; L48-L52 HydrophobicContact CG-CG 4.31Å; L48-L52 WeakPolarHBondContact O-CD1 3.34Å; L48-L52 WeakPolarHBondContact O-CG 3.3Å; L48-L52 PolarHBondContact O-N 3.17Å; L52-S55 WeakPolarHBondContact CA-OG 3.42Å; L52-S55 PolarHBondContact O-OG 3.4Å; L52-A56 PolarHBondContact O-N 3.21Å |
| 53 | K | 68.1 | Low | 61.6 | Low | 182 Ų | 182 | 114.5 Ų | 114.5 | 79% | 0.791 | 63% | 0.627 | S | S | * | * | H | α-helix | trans | -75.1 | -30.2 | -177.1 | -144 | 175.9 | -173.6 | -179.9 | 0 | 113.1 | L51 | L51-K53 PolarHBondContact O-N 3.21Å |
| 54 | K | 66.3 | Low | 63.1 | Low | 161 Ų | 161 | 112 Ų | 112 | 70% | 0.7 | 61% | 0.61 | S | S | * | * | H | α-helix | trans | -88.5 | -30.8 | 174.8 | -72.3 | -173.5 | 175.5 | -177.1 | 0 | 112.4 | L51 A56 | L51-K54 PolarHBondContact O-N 3.28Å; L51-K54 VanDerWaalsContact O-N 3.17Å; K54-A56 VanDerWaalsContact C-N 3.32Å |
| 55 | S | 60.9 | Low | 63.6 | Low | 36 Ų | 36 | 107.5 Ų | 107.5 | 25% | 0.252 | 59% | 0.588 | S | S | . | * | H | α-helix | trans | -70.9 | -27.3 | 177.5 | 66 | 0 | 0 | 0 | 0 | 112.1 | L51 L52 V57 L58 L59 | L51-S55 VanDerWaalsContact O-CB 3.3Å; L51-S55 WeakPolarHBondContact O-CB 3.38Å; L51-S55 PolarHBondContact O-N 3.49Å; L51-S55 PolarHBondContact O-OG 3.25Å; L51-S55 VanDerWaalsContact O-OG 3.07Å; L52-S55 WeakPolarHBondContact CA-OG 3.42Å; L52-S55 PolarHBondContact O-OG 3.4Å; S55-V57 VanDerWaalsContact C-N 3.26Å; S55-V57 PolarHBondContact O-N 2.93Å; S55-L58 CarbonylContact O-C 3.45Å; S55-L58 WeakPolarHBondContact O-CA 3.16Å; S55-L58 PolarHBondContact O-N 3.17Å; S55-L59 WeakPolarHBondContact O-CG 3.49Å; S55-L59 PolarHBondContact O-N 2.77Å |
| 56 | A | 65.3 | Low | 64.7 | Low | 55 Ų | 55 | 105.6 Ų | 105.6 | 46% | 0.455 | 57% | 0.574 | S | S | . | * | H | α-helix | trans | -55.1 | -38.7 | 176.5 | 0 | 0 | 0 | 0 | 0 | 113.5 | L52 K54 L58 L59 | L52-A56 PolarHBondContact O-N 3.21Å; K54-A56 VanDerWaalsContact C-N 3.32Å; A56-L58 VanDerWaalsContact C-N 3.31Å; A56-L58 PolarHBondContact O-N 3.5Å; A56-L59 PolarHBondContact O-N 2.92Å |
| 57 | V | 71 | Confident | 65.4 | Low | 115 Ų | 115 | 102.7 Ų | 102.7 | 70% | 0.697 | 57% | 0.568 | S | S | * | * | H | α-helix | trans | -72.7 | -25 | 176.4 | 178.3 | 0 | 0 | 0 | 0 | 112.1 | S55 P61 | S55-V57 VanDerWaalsContact C-N 3.26Å; S55-V57 PolarHBondContact O-N 2.93Å; V57-P61 WeakPolarHBondContact O-CD 3.42Å |
| 58 | L | 63.2 | Low | 66 | Low | 129 Ų | 129 | 96.2 Ų | 96.2 | 68% | 0.675 | 55% | 0.55 | S | S | * | * | H | α-helix | trans | -87.4 | -22.2 | 174.7 | -69.3 | 167.8 | 0 | 0 | 0 | 113 | S55 A56 L60 P61 G62 | S55-L58 CarbonylContact O-C 3.45Å; S55-L58 WeakPolarHBondContact O-CA 3.16Å; S55-L58 PolarHBondContact O-N 3.17Å; A56-L58 VanDerWaalsContact C-N 3.31Å; A56-L58 PolarHBondContact O-N 3.5Å; L58-L60 VanDerWaalsContact C-N 3.34Å; L58-P61 WeakPolarHBondContact O-CD 3.47Å; L58-G62 PolarHBondContact O-N 2.89Å |
| 59 | L | 67.1 | Low | 67.1 | Low | 111 Ų | 111 | 95 Ų | 95 | 58% | 0.581 | 54% | 0.543 | S | S | * | . | H | α-helix | trans | -68.4 | -32.7 | 177.9 | -79.4 | 172.3 | 0 | 0 | 0 | 111.6 | S55 A56 G62 A63 | S55-L59 WeakPolarHBondContact O-CG 3.49Å; S55-L59 PolarHBondContact O-N 2.77Å; A56-L59 PolarHBondContact O-N 2.92Å; L59-G62 PolarHBondContact O-N 3.4Å; L59-A63 WeakPolarHBondContact O-CB 3.07Å; L59-A63 PolarHBondContact O-N 3.08Å |
| 60 | L | 71.5 | Confident | 67.2 | Low | 132 Ų | 132 | 93.9 Ų | 93.9 | 69% | 0.691 | 53% | 0.532 | S | S | * | . | H | α-helix | trans | -69.3 | -51.5 | 179.9 | -171 | 76 | 0 | 0 | 0 | 112.6 | L58 G62 A63 C64 | L58-L60 VanDerWaalsContact C-N 3.34Å; L60-G62 VanDerWaalsContact C-N 3.28Å; L60-G62 PolarHBondContact O-N 2.94Å; L60-A63 PolarHBondContact O-N 2.78Å; L60-C64 PolarHBondContact O-N 3.46Å |
| 61 | P | 70.1 | Confident | 67.8 | Low | 64 Ų | 64 | 94 Ų | 94 | 42% | 0.416 | 53% | 0.528 | S | S | . | . | H | α-helix | trans | -62.6 | -35.1 | 170.8 | -14.8 | 24.1 | 0 | 0 | 0 | 112.7 | V57 L58 R65 | V57-P61 WeakPolarHBondContact O-CD 3.42Å; L58-P61 WeakPolarHBondContact O-CD 3.47Å; P61-R65 WeakPolarHBondContact O-CB 3.41Å; P61-R65 VanDerWaalsContact O-CG 3.31Å; P61-R65 WeakPolarHBondContact O-CG 3.44Å; P61-R65 PolarHBondContact O-N 3.04Å |
| 62 | G | 68.7 | Low | 68.3 | Low | 30 Ų | 30 | 92.8 Ų | 92.8 | 31% | 0.309 | 52% | 0.519 | S | S | . | . | H | α-helix | trans | -62.4 | -46.8 | 176.1 | 0 | 0 | 0 | 0 | 0 | 112.5 | L58 L59 L60 R65 T66 | L58-G62 PolarHBondContact O-N 2.89Å; L59-G62 PolarHBondContact O-N 3.4Å; L60-G62 VanDerWaalsContact C-N 3.28Å; L60-G62 PolarHBondContact O-N 2.94Å; G62-R65 PolarHBondContact O-N 2.94Å; G62-T66 PolarHBondContact O-N 3.18Å; G62-T66 PolarHBondContact O-OG1 3.47Å |
| 63 | A | 70.2 | Confident | 68.8 | Low | 54 Ų | 54 | 90.5 Ų | 90.5 | 45% | 0.446 | 52% | 0.515 | S | S | . | . | H | α-helix | trans | -65.3 | -43 | 178.1 | 0 | 0 | 0 | 0 | 0 | 111.9 | L59 L60 R65 T66 A67 | L59-A63 WeakPolarHBondContact O-CB 3.07Å; L59-A63 PolarHBondContact O-N 3.08Å; L60-A63 PolarHBondContact O-N 2.78Å; A63-R65 VanDerWaalsContact C-N 3.33Å; A63-R65 PolarHBondContact O-N 3.39Å; A63-T66 VanDerWaalsContact CA-OG1 3.31Å; A63-T66 WeakPolarHBondContact CA-OG1 3.45Å; A63-T66 PolarHBondContact O-N 2.99Å; A63-T66 PolarHBondContact O-OG1 3.29Å; A63-A67 WeakPolarHBondContact O-CB 3.2Å; A63-A67 PolarHBondContact O-N 3.06Å |
| 64 | C | 66.9 | Low | 69.1 | Low | 77 Ų | 77 | 84 Ų | 84 | 52% | 0.52 | 50% | 0.495 | S | S | . | . | H | α-helix | trans | -59.9 | -42.4 | 172.4 | -87.2 | 0 | 0 | 0 | 0 | 111.8 | L60 A67 L68 | L60-C64 PolarHBondContact O-N 3.46Å; C64-A67 PolarHBondContact O-N 3.28Å; C64-L68 WeakPolarHBondContact O-CG 3.31Å; C64-L68 PolarHBondContact O-N 3.47Å |
| 65 | R | 64.1 | Low | 69.4 | Low | 88 Ų | 88 | 81.2 Ų | 81.2 | 33% | 0.332 | 49% | 0.487 | S | S | . | . | H | α-helix | trans | -64.3 | -44.7 | 176 | -77.5 | 179.4 | -175.3 | -168.5 | 1.1 | 112.2 | P61 G62 A63 A67 L68 I69 L162 T163 V165 | P61-R65 WeakPolarHBondContact O-CB 3.41Å; P61-R65 VanDerWaalsContact O-CG 3.31Å; P61-R65 WeakPolarHBondContact O-CG 3.44Å; P61-R65 PolarHBondContact O-N 3.04Å; G62-R65 PolarHBondContact O-N 2.94Å; A63-R65 VanDerWaalsContact C-N 3.33Å; A63-R65 PolarHBondContact O-N 3.39Å; R65-A67 VanDerWaalsContact C-N 3.3Å; R65-A67 PolarHBondContact O-N 2.98Å; R65-L68 PolarHBondContact O-N 3.41Å; R65-I69 WeakPolarHBondContact O-CB 3.32Å; R65-I69 WeakPolarHBondContact O-CD1 3.37Å; R65-I69 WeakPolarHBondContact O-CG1 3.36Å; R65-I69 PolarHBondContact O-N 3.36Å; R65-L162 PolarHBondContact NH1-O 2.85Å; R65-T163 PolarHBondContact NH2-O 3.12Å; R65-V165 HydrophobicContact CG-CG2 4.48Å |
| 66 | T | 69.8 | Low | 69.8 | Low | 97 Ų | 97 | 81.4 Ų | 81.4 | 60% | 0.595 | 48% | 0.483 | S | S | * | . | H | α-helix | trans | -65.7 | -34.1 | 177.5 | 48.2 | 0 | 0 | 0 | 0 | 112.3 | G62 A63 G70 | G62-T66 PolarHBondContact O-N 3.18Å; G62-T66 PolarHBondContact O-OG1 3.47Å; A63-T66 VanDerWaalsContact CA-OG1 3.31Å; A63-T66 WeakPolarHBondContact CA-OG1 3.45Å; A63-T66 PolarHBondContact O-N 2.99Å; A63-T66 PolarHBondContact O-OG1 3.29Å; T66-G70 PolarHBondContact O-N 3.03Å |
| 67 | A | 71.7 | Confident | 70.1 | Confident | 58 Ų | 58 | 83.9 Ų | 83.9 | 48% | 0.479 | 49% | 0.488 | S | S | . | . | H | α-helix | trans | -67.4 | -46.9 | 175.1 | 0 | 0 | 0 | 0 | 0 | 111.6 | A63 C64 R65 G70 E71 | A63-A67 WeakPolarHBondContact O-CB 3.2Å; A63-A67 PolarHBondContact O-N 3.06Å; C64-A67 PolarHBondContact O-N 3.28Å; R65-A67 VanDerWaalsContact C-N 3.3Å; R65-A67 PolarHBondContact O-N 2.98Å; A67-G70 PolarHBondContact O-N 3.46Å; A67-E71 PolarHBondContact O-N 2.9Å |
| 68 | L | 68.8 | Low | 70.4 | Confident | 100 Ų | 100 | 84.7 Ų | 84.7 | 52% | 0.524 | 48% | 0.484 | S | S | . | . | H | α-helix | trans | -64.9 | -42.4 | 177.5 | -71.7 | 172.6 | 0 | 0 | 0 | 112.3 | C64 R65 G70 E71 F72 | C64-L68 WeakPolarHBondContact O-CG 3.31Å; C64-L68 PolarHBondContact O-N 3.47Å; R65-L68 PolarHBondContact O-N 3.41Å; L68-G70 VanDerWaalsContact C-N 3.28Å; L68-G70 PolarHBondContact O-N 3.36Å; L68-E71 PolarHBondContact O-N 2.67Å; L68-F72 VanDerWaalsContact O-CB 3.25Å; L68-F72 WeakPolarHBondContact O-CB 3.31Å; L68-F72 PolarHBondContact O-N 3.26Å |
| 69 | I | 73.2 | Confident | 70.8 | Confident | 101 Ų | 101 | 81.8 Ų | 81.8 | 52% | 0.518 | 47% | 0.471 | S | S | . | . | H | α-helix | trans | -63.8 | -38 | 174.2 | -67 | 165.2 | 0 | 0 | 0 | 110 | R65 A73 | R65-I69 WeakPolarHBondContact O-CB 3.32Å; R65-I69 WeakPolarHBondContact O-CD1 3.37Å; R65-I69 WeakPolarHBondContact O-CG1 3.36Å; R65-I69 PolarHBondContact O-N 3.36Å; I69-A73 WeakPolarHBondContact O-CB 3.39Å; I69-A73 PolarHBondContact O-N 2.89Å |
| 70 | G | 73.4 | Confident | 71 | Confident | 38 Ų | 38 | 78.6 Ų | 78.6 | 39% | 0.392 | 46% | 0.455 | S | S | . | . | H | α-helix | trans | -63.4 | -47.3 | 176.9 | 0 | 0 | 0 | 0 | 0 | 113.1 | T66 A67 L68 A74 | T66-G70 PolarHBondContact O-N 3.03Å; A67-G70 PolarHBondContact O-N 3.46Å; L68-G70 VanDerWaalsContact C-N 3.28Å; L68-G70 PolarHBondContact O-N 3.36Å; G70-A74 VanDerWaalsContact O-CB 3.28Å; G70-A74 WeakPolarHBondContact O-CB 3.49Å; G70-A74 PolarHBondContact O-N 3.16Å |
| 71 | E | 72.8 | Confident | 71.3 | Confident | 146 Ų | 146 | 75 Ų | 75 | 68% | 0.682 | 44% | 0.44 | S | S | * | . | H | α-helix | trans | -67.4 | -40.7 | 177.3 | -72 | -168.6 | 169.7 | 0 | 0 | 112.2 | A67 L68 A74 L75 | A67-E71 PolarHBondContact O-N 2.9Å; L68-E71 PolarHBondContact O-N 2.67Å; E71-A74 PolarHBondContact O-N 2.95Å; E71-L75 PolarHBondContact O-N 2.97Å |
| 72 | F | 68.7 | Low | 71.7 | Confident | 74 Ų | 74 | 74.5 Ų | 74.5 | 33% | 0.325 | 44% | 0.441 | S | S | . | . | H | α-helix | trans | -65.4 | -47.9 | 176.8 | -166.6 | -107.6 | 0 | 0 | 0 | 110.8 | L68 A74 L75 W76 M172 | L68-F72 VanDerWaalsContact O-CB 3.25Å; L68-F72 WeakPolarHBondContact O-CB 3.31Å; L68-F72 PolarHBondContact O-N 3.26Å; F72-A74 VanDerWaalsContact C-N 3.27Å; F72-A74 PolarHBondContact O-N 2.78Å; F72-L75 PolarHBondContact O-N 2.99Å; F72-L75 VanDerWaalsContact O-N 3.16Å; F72-W76 AromaticContact CD1-CD1 3.39Å; F72-W76 AromaticContact CD1-NE1 3.52Å; F72-W76 AromaticContact CD2-NE1 3.97Å; F72-W76 AromaticContact CE1-CD1 3.36Å; F72-W76 AromaticContact CE1-NE1 2.96Å; F72-W76 AromaticContact CE2-NE1 3.46Å; F72-W76 AromaticContact CG-CD1 3.8Å; F72-W76 AromaticContact CZ-CD1 3.73Å; F72-W76 AromaticContact CZ-CE2 3.96Å; F72-W76 HydrophobicContact CZ-CZ2 4.4Å; F72-W76 AromaticContact CZ-NE1 2.94Å; F72-W76 WeakPolarHBondContact O-CB 3.49Å; F72-W76 PolarHBondContact O-N 2.9Å; F72-M172 HydrophobicContact CE1-CE 3.57Å; F72-M172 HydrophobicContact CE1-SD 3.62Å; F72-M172 HydrophobicContact CZ-CE 4.28Å; F72-M172 HydrophobicContact CZ-SD 4.31Å |
| 73 | A | 72.7 | Confident | 72.2 | Confident | 52 Ų | 52 | 76.7 Ų | 76.7 | 43% | 0.43 | 44% | 0.442 | S | S | . | . | H | α-helix | trans | -58.7 | -39.1 | 174.3 | 0 | 0 | 0 | 0 | 0 | 111.6 | I69 W76 L77 | I69-A73 WeakPolarHBondContact O-CB 3.39Å; I69-A73 PolarHBondContact O-N 2.89Å; A73-W76 PolarHBondContact O-N 3.39Å; A73-L77 WeakPolarHBondContact O-CB 3.33Å; A73-L77 PolarHBondContact O-N 3.15Å |
| 74 | A | 73.8 | Confident | 72.6 | Confident | 46 Ų | 46 | 76.3 Ų | 76.3 | 38% | 0.38 | 44% | 0.436 | S | S | . | . | H | α-helix | trans | -65 | -42.9 | 175.6 | 0 | 0 | 0 | 0 | 0 | 112.2 | G70 E71 F72 L77 Q78 | G70-A74 VanDerWaalsContact O-CB 3.28Å; G70-A74 WeakPolarHBondContact O-CB 3.49Å; G70-A74 PolarHBondContact O-N 3.16Å; E71-A74 PolarHBondContact O-N 2.95Å; F72-A74 VanDerWaalsContact C-N 3.27Å; F72-A74 PolarHBondContact O-N 2.78Å; A74-L77 PolarHBondContact O-N 2.89Å; A74-Q78 WeakPolarHBondContact O-CB 3.48Å; A74-Q78 VanDerWaalsContact O-CG 3.28Å; A74-Q78 WeakPolarHBondContact O-CG 3.44Å; A74-Q78 PolarHBondContact O-N 2.88Å |
| 75 | L | 72.7 | Confident | 73.3 | Confident | 102 Ų | 102 | 78 Ų | 78 | 53% | 0.534 | 44% | 0.439 | S | S | . | . | H | α-helix | trans | -63.9 | -43.7 | 176.1 | -171.2 | 73.7 | 0 | 0 | 0 | 111.3 | E71 F72 Q78 V79 | E71-L75 PolarHBondContact O-N 2.97Å; F72-L75 PolarHBondContact O-N 2.99Å; F72-L75 VanDerWaalsContact O-N 3.16Å; L75-Q78 WeakPolarHBondContact O-CB 3.24Å; L75-Q78 PolarHBondContact O-N 3.44Å; L75-V79 WeakPolarHBondContact O-CG2 3.25Å; L75-V79 PolarHBondContact O-N 3.39Å |
| 76 | W | 70.5 | Confident | 74.3 | Confident | 40 Ų | 40 | 77.3 Ų | 77.3 | 15% | 0.152 | 44% | 0.444 | C | S | . | . | H | α-helix | trans | -63.9 | -45.2 | 176.1 | -85.8 | 99.4 | 0 | 0 | 0 | 112.4 | F72 A73 Q78 V79 L80 M172 L176 | F72-W76 AromaticContact CD1-CD1 3.39Å; F72-W76 AromaticContact CD1-NE1 3.52Å; F72-W76 AromaticContact CD2-NE1 3.97Å; F72-W76 AromaticContact CE1-CD1 3.36Å; F72-W76 AromaticContact CE1-NE1 2.96Å; F72-W76 AromaticContact CE2-NE1 3.46Å; F72-W76 AromaticContact CG-CD1 3.8Å; F72-W76 AromaticContact CZ-CD1 3.73Å; F72-W76 AromaticContact CZ-CE2 3.96Å; F72-W76 HydrophobicContact CZ-CZ2 4.4Å; F72-W76 AromaticContact CZ-NE1 2.94Å; F72-W76 WeakPolarHBondContact O-CB 3.49Å; F72-W76 PolarHBondContact O-N 2.9Å; A73-W76 PolarHBondContact O-N 3.39Å; W76-Q78 PolarHBondContact O-N 2.87Å; W76-V79 PolarHBondContact O-N 3.47Å; W76-V79 VanDerWaalsContact O-N 3.13Å; W76-L80 WeakPolarHBondContact O-CB 3.36Å; W76-L80 WeakPolarHBondContact O-CD1 3.46Å; W76-L80 WeakPolarHBondContact O-CG 3.28Å; W76-L80 PolarHBondContact O-N 3.06Å; W76-M172 HydrophobicContact CD2-CE 4.38Å; W76-M172 HydrophobicContact CH2-CE 4.35Å; W76-M172 HydrophobicContact CZ2-CB 4.43Å; W76-M172 HydrophobicContact CZ2-CE 3.71Å; W76-L176 HydrophobicContact CH2-CD1 3.51Å; W76-L176 HydrophobicContact CH2-CD2 3.49Å; W76-L176 VanDerWaalsContact CH2-CD2 3.49Å; W76-L176 HydrophobicContact CH2-CG 3.36Å; W76-L176 HydrophobicContact CZ2-CD1 3.38Å; W76-L176 HydrophobicContact CZ2-CD2 4.23Å; W76-L176 HydrophobicContact CZ2-CG 3.8Å; W76-L176 HydrophobicContact CZ3-CD2 3.91Å; W76-L176 HydrophobicContact CZ3-CG 4.27Å |
| 77 | L | 71.1 | Confident | 75 | Confident | 108 Ų | 108 | 72.7 Ų | 72.7 | 57% | 0.565 | 42% | 0.416 | S | S | * | . | H | α-helix | trans | -61.1 | -36.3 | 175.4 | -162.1 | 74.1 | 0 | 0 | 0 | 110.3 | A73 A74 C81 | A73-L77 WeakPolarHBondContact O-CB 3.33Å; A73-L77 PolarHBondContact O-N 3.15Å; A74-L77 PolarHBondContact O-N 2.89Å; L77-C81 WeakPolarHBondContact O-CB 3.18Å; L77-C81 PolarHBondContact O-N 3.34Å; L77-C81 PolarHBondContact O-SG 2.9Å |
| 78 | Q | 76.6 | Confident | 75.5 | Confident | 132 Ų | 132 | 72.9 Ų | 72.9 | 62% | 0.617 | 41% | 0.411 | S | S | * | . | H | α-helix | trans | -64.6 | -42.6 | 173.5 | -76.1 | 177.9 | 12.5 | 0 | 0 | 112.7 | A74 L75 W76 A82 | A74-Q78 WeakPolarHBondContact O-CB 3.48Å; A74-Q78 VanDerWaalsContact O-CG 3.28Å; A74-Q78 WeakPolarHBondContact O-CG 3.44Å; A74-Q78 PolarHBondContact O-N 2.88Å; L75-Q78 WeakPolarHBondContact O-CB 3.24Å; L75-Q78 PolarHBondContact O-N 3.44Å; W76-Q78 PolarHBondContact O-N 2.87Å; Q78-A82 WeakPolarHBondContact O-CB 3.09Å; Q78-A82 PolarHBondContact O-N 3.3Å |
| 79 | V | 72.4 | Confident | 76.4 | Confident | 68 Ų | 68 | 70.6 Ų | 70.6 | 41% | 0.412 | 41% | 0.407 | S | S | . | . | H | α-helix | trans | -69.3 | -41.1 | 178.1 | 176.1 | 0 | 0 | 0 | 0 | 111.4 | L75 W76 A82 K83 | L75-V79 WeakPolarHBondContact O-CG2 3.25Å; L75-V79 PolarHBondContact O-N 3.39Å; W76-V79 PolarHBondContact O-N 3.47Å; W76-V79 VanDerWaalsContact O-N 3.13Å; V79-A82 PolarHBondContact O-N 3.25Å; V79-K83 PolarHBondContact O-N 2.96Å |
| 80 | L | 72 | Confident | 77.1 | Confident | 44 Ų | 44 | 67.6 Ų | 67.6 | 23% | 0.23 | 39% | 0.391 | C | S | . | . | H | α-helix | trans | -60.9 | -50.6 | 173.6 | -79 | 149.4 | 0 | 0 | 0 | 111.5 | W76 A82 K83 S84 R144 | W76-L80 WeakPolarHBondContact O-CB 3.36Å; W76-L80 WeakPolarHBondContact O-CD1 3.46Å; W76-L80 WeakPolarHBondContact O-CG 3.28Å; W76-L80 PolarHBondContact O-N 3.06Å; L80-A82 VanDerWaalsContact C-N 3.3Å; L80-A82 PolarHBondContact O-N 3.47Å; L80-K83 PolarHBondContact O-N 2.95Å; L80-S84 WeakPolarHBondContact O-CB 3.33Å; L80-S84 PolarHBondContact O-N 3.38Å; L80-S84 VanDerWaalsContact O-N 3.13Å; L80-R144 VanDerWaalsContact CA-NH2 3.27Å |
| 81 | C | 76.2 | Confident | 77.8 | Confident | 56 Ų | 56 | 68.1 Ų | 68.1 | 38% | 0.378 | 39% | 0.387 | S | S | . | . | H | α-helix | trans | -61.2 | -38.7 | 176.4 | -74 | 0 | 0 | 0 | 0 | 111.4 | L77 K83 S84 I85 | L77-C81 WeakPolarHBondContact O-CB 3.18Å; L77-C81 PolarHBondContact O-N 3.34Å; L77-C81 PolarHBondContact O-SG 2.9Å; C81-K83 PolarHBondContact O-N 2.89Å; C81-S84 PolarHBondContact O-N 3.45Å; C81-I85 HydrophobicContact CB-CD1 4.13Å; C81-I85 WeakPolarHBondContact O-CB 3.36Å; C81-I85 VanDerWaalsContact O-CD1 3.24Å; C81-I85 WeakPolarHBondContact O-CD1 3.31Å; C81-I85 WeakPolarHBondContact O-CG1 3.29Å; C81-I85 PolarHBondContact O-N 2.89Å |
| 82 | A | 80.4 | Confident | 78.6 | Confident | 53 Ų | 53 | 65.7 Ų | 65.7 | 44% | 0.438 | 38% | 0.378 | S | S | . | . | H | α-helix | trans | -60.5 | -48.3 | -177.6 | 0 | 0 | 0 | 0 | 0 | 112.6 | Q78 V79 L80 I85 V86 | Q78-A82 WeakPolarHBondContact O-CB 3.09Å; Q78-A82 PolarHBondContact O-N 3.3Å; V79-A82 PolarHBondContact O-N 3.25Å; L80-A82 VanDerWaalsContact C-N 3.3Å; L80-A82 PolarHBondContact O-N 3.47Å; A82-I85 PolarHBondContact O-N 2.96Å; A82-V86 VanDerWaalsContact O-CG2 3.31Å; A82-V86 WeakPolarHBondContact O-CG2 3.42Å; A82-V86 PolarHBondContact O-N 3.25Å |
| 83 | K | 78.5 | Confident | 79.5 | Confident | 76 Ų | 76 | 65.1 Ų | 65.1 | 33% | 0.33 | 39% | 0.387 | S | S | . | . | H | α-helix | trans | -67.9 | -43 | 178 | -74.2 | -177 | 175.9 | -174.9 | 0 | 112.2 | V79 L80 C81 I85 V86 G87 E141 | V79-K83 PolarHBondContact O-N 2.96Å; L80-K83 PolarHBondContact O-N 2.95Å; C81-K83 PolarHBondContact O-N 2.89Å; K83-I85 VanDerWaalsContact C-N 3.35Å; K83-I85 PolarHBondContact O-N 3.36Å; K83-V86 WeakPolarHBondContact O-CB 3.38Å; K83-V86 PolarHBondContact O-N 3.48Å; K83-V86 VanDerWaalsContact O-N 3.17Å; K83-G87 PolarHBondContact O-N 3.47Å; K83-E141 HydrophobicContact CB-CG 4.48Å; K83-E141 WeakPolarHBondContact CB-OE1 3.31Å; K83-E141 WeakPolarHBondContact CD-OE1 3.5Å |
| 84 | S | 78.6 | Confident | 80.2 | Confident | 47 Ų | 47 | 63.8 Ų | 63.8 | 33% | 0.329 | 37% | 0.373 | S | S | . | . | H | α-helix | trans | -61.1 | -42.8 | 175.7 | -179.7 | 0 | 0 | 0 | 0 | 111.9 | L80 C81 V86 G87 V88 | L80-S84 WeakPolarHBondContact O-CB 3.33Å; L80-S84 PolarHBondContact O-N 3.38Å; L80-S84 VanDerWaalsContact O-N 3.13Å; C81-S84 PolarHBondContact O-N 3.45Å; S84-V86 VanDerWaalsContact C-N 3.3Å; S84-V86 PolarHBondContact O-N 3.23Å; S84-G87 PolarHBondContact O-N 3.01Å; S84-V88 WeakPolarHBondContact O-CB 3.28Å; S84-V88 VanDerWaalsContact O-CG2 3.32Å; S84-V88 WeakPolarHBondContact O-CG2 3.22Å; S84-V88 PolarHBondContact O-N 3.29Å |
| 85 | I | 82.5 | Confident | 81 | Confident | 113 Ų | 113 | 66.2 Ų | 66.2 | 58% | 0.579 | 38% | 0.376 | S | S | * | . | H | α-helix | trans | -60.5 | -41.1 | 175 | -71.3 | 162.5 | 0 | 0 | 0 | 110.5 | C81 A82 K83 A89 | C81-I85 HydrophobicContact CB-CD1 4.13Å; C81-I85 WeakPolarHBondContact O-CB 3.36Å; C81-I85 VanDerWaalsContact O-CD1 3.24Å; C81-I85 WeakPolarHBondContact O-CD1 3.31Å; C81-I85 WeakPolarHBondContact O-CG1 3.29Å; C81-I85 PolarHBondContact O-N 2.89Å; A82-I85 PolarHBondContact O-N 2.96Å; K83-I85 VanDerWaalsContact C-N 3.35Å; K83-I85 PolarHBondContact O-N 3.36Å; I85-A89 WeakPolarHBondContact O-CB 3.49Å; I85-A89 PolarHBondContact O-N 2.97Å |
| 86 | V | 84.2 | Confident | 81.7 | Confident | 72 Ų | 72 | 66.2 Ų | 66.2 | 44% | 0.436 | 38% | 0.381 | S | S | . | . | H | α-helix | trans | -64.1 | -46 | 175.1 | 171.9 | 0 | 0 | 0 | 0 | 110.9 | A82 K83 S84 V88 A89 I90 | A82-V86 VanDerWaalsContact O-CG2 3.31Å; A82-V86 WeakPolarHBondContact O-CG2 3.42Å; A82-V86 PolarHBondContact O-N 3.25Å; K83-V86 WeakPolarHBondContact O-CB 3.38Å; K83-V86 PolarHBondContact O-N 3.48Å; K83-V86 VanDerWaalsContact O-N 3.17Å; S84-V86 VanDerWaalsContact C-N 3.3Å; S84-V86 PolarHBondContact O-N 3.23Å; V86-V88 PolarHBondContact O-N 2.8Å; V86-A89 PolarHBondContact O-N 3.5Å; V86-I90 HydrophobicContact CG1-CD1 3.83Å; V86-I90 HydrophobicContact CG1-CG1 4.44Å; V86-I90 VanDerWaalsContact O-CG1 3.3Å; V86-I90 WeakPolarHBondContact O-CG1 3.18Å; V86-I90 PolarHBondContact O-N 2.89Å |
| 87 | G | 83.9 | Confident | 82.4 | Confident | 1 Ų | 1 | 69 Ų | 69 | 1% | 0.01 | 39% | 0.394 | C | S | . | . | H | α-helix | trans | -59.9 | -45.7 | 176.5 | 0 | 0 | 0 | 0 | 0 | 112.8 | K83 S84 A89 I90 T91 | K83-G87 PolarHBondContact O-N 3.47Å; S84-G87 PolarHBondContact O-N 3.01Å; G87-A89 PolarHBondContact O-N 2.93Å; G87-I90 PolarHBondContact O-N 3.47Å; G87-T91 PolarHBondContact O-N 3.19Å; G87-T91 PolarHBondContact O-OG1 2.86Å |
| 88 | V | 83.4 | Confident | 83.1 | Confident | 62 Ų | 62 | 66.6 Ų | 66.6 | 38% | 0.376 | 38% | 0.381 | S | S | . | . | H | α-helix | trans | -63 | -42 | 174.7 | 172.7 | 0 | 0 | 0 | 0 | 111 | S84 V86 I90 T91 L92 F138 | S84-V88 WeakPolarHBondContact O-CB 3.28Å; S84-V88 VanDerWaalsContact O-CG2 3.32Å; S84-V88 WeakPolarHBondContact O-CG2 3.22Å; S84-V88 PolarHBondContact O-N 3.29Å; V86-V88 PolarHBondContact O-N 2.8Å; V88-I90 PolarHBondContact O-N 2.97Å; V88-T91 WeakPolarHBondContact O-CB 3.48Å; V88-T91 PolarHBondContact O-N 3.25Å; V88-L92 HydrophobicContact CG1-CD1 3.94Å; V88-L92 HydrophobicContact CG1-CG 4.3Å; V88-L92 WeakPolarHBondContact O-CB 3.28Å; V88-L92 VanDerWaalsContact O-CG 3.32Å; V88-L92 WeakPolarHBondContact O-CG 3.3Å; V88-L92 PolarHBondContact O-N 3.45Å; V88-F138 HydrophobicContact CG2-CZ 4.11Å |
| 89 | A | 86.8 | Confident | 83.6 | Confident | 52 Ų | 52 | 66 Ų | 66 | 43% | 0.43 | 38% | 0.378 | S | S | . | . | H | α-helix | trans | -63.7 | -40.9 | 177.7 | 0 | 0 | 0 | 0 | 0 | 112.2 | I85 V86 G87 A93 | I85-A89 WeakPolarHBondContact O-CB 3.49Å; I85-A89 PolarHBondContact O-N 2.97Å; V86-A89 PolarHBondContact O-N 3.5Å; G87-A89 PolarHBondContact O-N 2.93Å; A89-A93 VanDerWaalsContact O-CB 3.29Å; A89-A93 WeakPolarHBondContact O-CB 3.38Å; A89-A93 PolarHBondContact O-N 3.49Å |
| 90 | I | 88.2 | Confident | 84.2 | Confident | 37 Ų | 37 | 64.2 Ų | 64.2 | 19% | 0.19 | 37% | 0.374 | C | S | . | . | H | α-helix | trans | -64.5 | -44.5 | 174.1 | -65.5 | 164.9 | 0 | 0 | 0 | 110.1 | V86 G87 V88 L92 A93 L94 F130 L133 T134 L137 | V86-I90 HydrophobicContact CG1-CD1 3.83Å; V86-I90 HydrophobicContact CG1-CG1 4.44Å; V86-I90 VanDerWaalsContact O-CG1 3.3Å; V86-I90 WeakPolarHBondContact O-CG1 3.18Å; V86-I90 PolarHBondContact O-N 2.89Å; G87-I90 PolarHBondContact O-N 3.47Å; V88-I90 PolarHBondContact O-N 2.97Å; I90-L92 PolarHBondContact O-N 3.29Å; I90-A93 PolarHBondContact O-N 3.35Å; I90-L94 HydrophobicContact CG2-CD1 4.03Å; I90-L94 HydrophobicContact CG2-CG 4.4Å; I90-L94 WeakPolarHBondContact O-CB 3.09Å; I90-L94 WeakPolarHBondContact O-CG 3.2Å; I90-L94 PolarHBondContact O-N 3.11Å; I90-F130 HydrophobicContact CG2-CD1 4.45Å; I90-L133 HydrophobicContact CD1-CD2 4.3Å; I90-T134 VanDerWaalsContact CG2-OG1 3.27Å; I90-T134 WeakPolarHBondContact CG2-OG1 3.42Å; I90-L137 HydrophobicContact CD1-CD1 3.64Å |
| 91 | T | 87.5 | Confident | 84.4 | Confident | 50 Ų | 50 | 68.7 Ų | 68.7 | 31% | 0.307 | 40% | 0.398 | S | S | . | . | H | α-helix | trans | -58.8 | -47.1 | 177.5 | -49.9 | 0 | 0 | 0 | 0 | 111.4 | G87 V88 L94 Q95 T134 | G87-T91 PolarHBondContact O-N 3.19Å; G87-T91 PolarHBondContact O-OG1 2.86Å; V88-T91 WeakPolarHBondContact O-CB 3.48Å; V88-T91 PolarHBondContact O-N 3.25Å; T91-L94 PolarHBondContact O-N 3.24Å; T91-Q95 WeakPolarHBondContact O-CB 3.33Å; T91-Q95 PolarHBondContact O-N 2.85Å; T91-T134 WeakPolarHBondContact OG1-CG2 3.4Å |
| 92 | L | 90.3 | Very high | 84.6 | Confident | 94 Ų | 94 | 73 Ų | 73 | 49% | 0.492 | 41% | 0.413 | S | S | . | . | H | α-helix | trans | -65.4 | -40.8 | 177.6 | -71.9 | 173.7 | 0 | 0 | 0 | 111.5 | V88 I90 L94 Q95 V96 | V88-L92 HydrophobicContact CG1-CD1 3.94Å; V88-L92 HydrophobicContact CG1-CG 4.3Å; V88-L92 WeakPolarHBondContact O-CB 3.28Å; V88-L92 VanDerWaalsContact O-CG 3.32Å; V88-L92 WeakPolarHBondContact O-CG 3.3Å; V88-L92 PolarHBondContact O-N 3.45Å; I90-L92 PolarHBondContact O-N 3.29Å; L92-L94 VanDerWaalsContact C-N 3.34Å; L92-Q95 PolarHBondContact O-N 2.92Å; L92-V96 WeakPolarHBondContact O-CB 3.5Å; L92-V96 VanDerWaalsContact O-CG2 3.31Å; L92-V96 WeakPolarHBondContact O-CG2 3.41Å; L92-V96 PolarHBondContact O-N 2.92Å |
| 93 | A | 88.3 | Confident | 84.4 | Confident | 63 Ų | 63 | 70.8 Ų | 70.8 | 52% | 0.521 | 39% | 0.394 | S | S | . | . | H | α-helix | trans | -62.6 | -41.7 | 175.5 | 0 | 0 | 0 | 0 | 0 | 111.6 | A89 I90 V96 F97 | A89-A93 VanDerWaalsContact O-CB 3.29Å; A89-A93 WeakPolarHBondContact O-CB 3.38Å; A89-A93 PolarHBondContact O-N 3.49Å; I90-A93 PolarHBondContact O-N 3.35Å; A93-V96 PolarHBondContact O-N 2.94Å; A93-F97 VanDerWaalsContact O-CB 3.28Å; A93-F97 WeakPolarHBondContact O-CB 3.33Å; A93-F97 PolarHBondContact O-N 3.01Å |
| 94 | L | 87.3 | Confident | 84.5 | Confident | 23 Ų | 23 | 71.8 Ų | 71.8 | 12% | 0.12 | 40% | 0.4 | C | S | . | . | H | α-helix | trans | -64.3 | -42.4 | 174 | -75.3 | 167.8 | 0 | 0 | 0 | 111.9 | I90 T91 L92 F97 L98 F130 | I90-L94 HydrophobicContact CG2-CD1 4.03Å; I90-L94 HydrophobicContact CG2-CG 4.4Å; I90-L94 WeakPolarHBondContact O-CB 3.09Å; I90-L94 WeakPolarHBondContact O-CG 3.2Å; I90-L94 PolarHBondContact O-N 3.11Å; T91-L94 PolarHBondContact O-N 3.24Å; L92-L94 VanDerWaalsContact C-N 3.34Å; L94-F97 PolarHBondContact O-N 3.44Å; L94-L98 VanDerWaalsContact O-CB 3.31Å; L94-L98 WeakPolarHBondContact O-CB 3.28Å; L94-L98 VanDerWaalsContact O-CG 3.25Å; L94-L98 WeakPolarHBondContact O-CG 3.24Å; L94-L98 PolarHBondContact O-N 3.32Å; L94-F130 HydrophobicContact CD1-CB 3.71Å; L94-F130 HydrophobicContact CD2-CB 3.29Å; L94-F130 HydrophobicContact CD2-CD2 4.28Å; L94-F130 HydrophobicContact CD2-CG 4Å; L94-F130 HydrophobicContact CG-CB 3.88Å |
| 95 | Q | 89.6 | Confident | 84.8 | Confident | 97 Ų | 97 | 76.2 Ų | 76.2 | 45% | 0.453 | 42% | 0.415 | S | S | . | . | H | α-helix | trans | -62.8 | -46.3 | 177.8 | -174.6 | 175.5 | 6.1 | 0 | 0 | 111.2 | T91 L92 F97 L98 Q99 | T91-Q95 WeakPolarHBondContact O-CB 3.33Å; T91-Q95 PolarHBondContact O-N 2.85Å; L92-Q95 PolarHBondContact O-N 2.92Å; Q95-F97 VanDerWaalsContact C-N 3.3Å; Q95-F97 PolarHBondContact O-N 3.2Å; Q95-L98 PolarHBondContact O-N 3.26Å; Q95-Q99 WeakPolarHBondContact O-CB 3.37Å; Q95-Q99 VanDerWaalsContact O-CG 3.27Å; Q95-Q99 WeakPolarHBondContact O-CG 3.36Å; Q95-Q99 PolarHBondContact O-N 3Å |
| 96 | V | 88.5 | Confident | 84.8 | Confident | 103 Ų | 103 | 71.8 Ų | 71.8 | 62% | 0.624 | 39% | 0.391 | S | S | * | . | H | α-helix | trans | -62.5 | -39.7 | 175.6 | 171.2 | 0 | 0 | 0 | 0 | 110.9 | L92 A93 Q99 | L92-V96 WeakPolarHBondContact O-CB 3.5Å; L92-V96 VanDerWaalsContact O-CG2 3.31Å; L92-V96 WeakPolarHBondContact O-CG2 3.41Å; L92-V96 PolarHBondContact O-N 2.92Å; A93-V96 PolarHBondContact O-N 2.94Å; V96-Q99 PolarHBondContact O-N 2.8Å |
| 97 | F | 85.3 | Confident | 84.5 | Confident | 97 Ų | 97 | 72.1 Ų | 72.1 | 43% | 0.425 | 39% | 0.39 | S | S | . | . | H | α-helix | trans | -63.1 | -48.1 | 175.7 | -175.9 | -97.4 | 0 | 0 | 0 | 111.5 | A93 L94 Q95 Q99 G100 V103 V127 | A93-F97 VanDerWaalsContact O-CB 3.28Å; A93-F97 WeakPolarHBondContact O-CB 3.33Å; A93-F97 PolarHBondContact O-N 3.01Å; L94-F97 PolarHBondContact O-N 3.44Å; Q95-F97 VanDerWaalsContact C-N 3.3Å; Q95-F97 PolarHBondContact O-N 3.2Å; F97-Q99 VanDerWaalsContact C-N 3.29Å; F97-Q99 PolarHBondContact O-N 3.11Å; F97-G100 PolarHBondContact O-N 3.34Å; F97-V103 HydrophobicContact CD1-CG2 4.29Å; F97-V103 HydrophobicContact CE1-CG2 4.02Å; F97-V103 HydrophobicContact CZ-CG2 4.3Å; F97-V103 VanDerWaalsContact O-CG2 3.31Å; F97-V103 WeakPolarHBondContact O-CG2 3.34Å; F97-V127 HydrophobicContact CD1-CG2 4.02Å; F97-V127 HydrophobicContact CE1-CG2 3.6Å |
| 98 | L | 84.4 | Confident | 84.5 | Confident | 59 Ų | 59 | 80.5 Ų | 80.5 | 31% | 0.309 | 43% | 0.426 | S | S | . | . | H | α-helix | trans | -67.8 | -25.1 | 179.1 | -74.4 | 171.5 | 0 | 0 | 0 | 113.7 | L94 Q95 G100 V103 Q104 L107 V127 | L94-L98 VanDerWaalsContact O-CB 3.31Å; L94-L98 WeakPolarHBondContact O-CB 3.28Å; L94-L98 VanDerWaalsContact O-CG 3.25Å; L94-L98 WeakPolarHBondContact O-CG 3.24Å; L94-L98 PolarHBondContact O-N 3.32Å; Q95-L98 PolarHBondContact O-N 3.26Å; L98-G100 VanDerWaalsContact C-N 3.25Å; L98-V103 HydrophobicContact CD2-CG1 3.94Å; L98-Q104 WeakPolarHBondContact O-CG 3.24Å; L98-L107 HydrophobicContact CD2-CD1 4.16Å; L98-V127 HydrophobicContact CD2-CG1 3.97Å |
| 99 | Q | 86.4 | Confident | 84.7 | Confident | 118 Ų | 118 | 81.4 Ų | 81.4 | 55% | 0.551 | 43% | 0.427 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -76.6 | -9.6 | 174.7 | -79.9 | -179.6 | -16.6 | 0 | 0 | 113.4 | Q95 V96 F97 D101 | Q95-Q99 WeakPolarHBondContact O-CB 3.37Å; Q95-Q99 VanDerWaalsContact O-CG 3.27Å; Q95-Q99 WeakPolarHBondContact O-CG 3.36Å; Q95-Q99 PolarHBondContact O-N 3Å; V96-Q99 PolarHBondContact O-N 2.8Å; F97-Q99 VanDerWaalsContact C-N 3.29Å; F97-Q99 PolarHBondContact O-N 3.11Å; Q99-D101 PolarHBondContact O-N 3.45Å |
| 100 | G | 85.2 | Confident | 84.5 | Confident | 31 Ų | 31 | 85.3 Ų | 85.3 | 32% | 0.32 | 44% | 0.436 | S | S | . | . | S | Bend | trans | -63.7 | 127.4 | 172.3 | 0 | 0 | 0 | 0 | 0 | 110.6 | F97 L98 E102 V103 Q104 | F97-G100 PolarHBondContact O-N 3.34Å; L98-G100 VanDerWaalsContact C-N 3.25Å; G100-E102 PolarHBondContact O-N 2.81Å; G100-E102 VanDerWaalsContact O-N 3.12Å; G100-V103 PolarHBondContact O-N 3.45Å; G100-Q104 PolarHBondContact O-N 3.16Å |
| 101 | D | 76.5 | Confident | 84.1 | Confident | 139 Ų | 139 | 88.6 Ų | 88.6 | 74% | 0.743 | 46% | 0.46 | S | S | * | . | H | α-helix | trans | -50.5 | -40.3 | -177.4 | -64.8 | -33.1 | 0 | 0 | 0 | 111.9 | Q99 V103 Q104 E105 | Q99-D101 PolarHBondContact O-N 3.45Å; D101-V103 VanDerWaalsContact C-N 3.29Å; D101-V103 PolarHBondContact O-N 2.88Å; D101-Q104 PolarHBondContact O-N 2.9Å; D101-E105 WeakPolarHBondContact O-CB 3.04Å; D101-E105 PolarHBondContact O-N 3.33Å |
| 102 | E | 80.6 | Confident | 84 | Confident | 147 Ų | 147 | 89.7 Ų | 89.7 | 69% | 0.687 | 48% | 0.481 | S | S | * | . | H | α-helix | trans | -66.2 | -23.7 | 178.4 | -62.3 | -177.6 | 176.8 | 0 | 0 | 114.5 | G100 Y106 R123 | G100-E102 PolarHBondContact O-N 2.81Å; G100-E102 VanDerWaalsContact O-N 3.12Å; E102-Y106 WeakPolarHBondContact O-CB 3.09Å; E102-Y106 PolarHBondContact O-N 3.32Å; E102-R123 PolarHBondContact O-NH1 2.66Å |
| 103 | V | 77.2 | Confident | 83.7 | Confident | 6 Ų | 6 | 93.3 Ų | 93.3 | 4% | 0.036 | 49% | 0.489 | C | S | . | . | H | α-helix | trans | -81.9 | -41.7 | 177.5 | -178 | 0 | 0 | 0 | 0 | 110 | F97 L98 G100 D101 Y106 L107 R123 | F97-V103 HydrophobicContact CD1-CG2 4.29Å; F97-V103 HydrophobicContact CE1-CG2 4.02Å; F97-V103 HydrophobicContact CZ-CG2 4.3Å; F97-V103 VanDerWaalsContact O-CG2 3.31Å; F97-V103 WeakPolarHBondContact O-CG2 3.34Å; L98-V103 HydrophobicContact CD2-CG1 3.94Å; G100-V103 PolarHBondContact O-N 3.45Å; D101-V103 VanDerWaalsContact C-N 3.29Å; D101-V103 PolarHBondContact O-N 2.88Å; V103-Y106 PolarHBondContact O-N 2.91Å; V103-L107 HydrophobicContact CG1-CD1 3.87Å; V103-L107 WeakPolarHBondContact O-CB 3.32Å; V103-L107 WeakPolarHBondContact O-CD1 3.49Å; V103-L107 WeakPolarHBondContact O-CG 3.32Å; V103-L107 PolarHBondContact O-N 3.01Å; V103-R123 VanDerWaalsContact CG2-CZ 3.41Å |
| 104 | Q | 80.4 | Confident | 83.3 | Confident | 97 Ų | 97 | 92.2 Ų | 92.2 | 45% | 0.453 | 47% | 0.472 | S | S | . | . | H | α-helix | trans | -66.3 | -46.6 | 177.9 | -68.1 | -156.4 | -18.1 | 0 | 0 | 111.1 | L98 G100 D101 Y106 L107 F108 | L98-Q104 WeakPolarHBondContact O-CG 3.24Å; G100-Q104 PolarHBondContact O-N 3.16Å; D101-Q104 PolarHBondContact O-N 2.9Å; Q104-Y106 VanDerWaalsContact C-N 3.27Å; Q104-Y106 PolarHBondContact O-N 2.89Å; Q104-L107 PolarHBondContact O-N 3.43Å; Q104-L107 VanDerWaalsContact O-N 3.13Å; Q104-F108 HydrophobicContact CB-CE2 4.5Å; Q104-F108 WeakPolarHBondContact O-CD2 3.46Å; Q104-F108 PolarHBondContact O-N 3.22Å; Q104-F108 VanDerWaalsContact O-N 3.1Å |
| 105 | E | 84.1 | Confident | 83 | Confident | 140 Ų | 140 | 98.8 Ų | 98.8 | 65% | 0.654 | 50% | 0.502 | S | S | * | . | H | α-helix | trans | -58 | -44.1 | 176.7 | -169.2 | 168.8 | -160.8 | 0 | 0 | 110.8 | D101 L107 F108 E109 | D101-E105 WeakPolarHBondContact O-CB 3.04Å; D101-E105 PolarHBondContact O-N 3.33Å; E105-L107 PolarHBondContact O-N 2.87Å; E105-F108 PolarHBondContact O-N 3.2Å; E105-E109 WeakPolarHBondContact O-CB 3.45Å; E105-E109 PolarHBondContact O-N 3.38Å |
| 106 | Y | 82.1 | Confident | 82.6 | Confident | 20 Ų | 20 | 101.7 Ų | 101.7 | 8% | 0.078 | 52% | 0.52 | C | S | . | . | H | α-helix | trans | -60.7 | -40.7 | 175.2 | -178.5 | -92.9 | 0 | 0 | 0 | 113.9 | E102 V103 Q104 F108 E109 R114 S120 R123 E124 | E102-Y106 WeakPolarHBondContact O-CB 3.09Å; E102-Y106 PolarHBondContact O-N 3.32Å; V103-Y106 PolarHBondContact O-N 2.91Å; Q104-Y106 VanDerWaalsContact C-N 3.27Å; Q104-Y106 PolarHBondContact O-N 2.89Å; Y106-F108 VanDerWaalsContact C-N 3.3Å; Y106-F108 PolarHBondContact O-N 3.35Å; Y106-E109 PolarHBondContact O-N 3.07Å; Y106-R114 HydrophobicContact CE2-CB 4.11Å; Y106-R114 HydrophobicContact CE2-CG 3.94Å; Y106-R114 PolarHBondContact O-NH2 3.5Å; Y106-R114 WeakPolarHBondContact OH-CD 3.4Å; Y106-S120 WeakPolarHBondContact CE2-OG 3.18Å; Y106-S120 VanDerWaalsContact CZ-O 3.29Å; Y106-S120 PolarHBondContact OH-O 2.8Å; Y106-S120 PolarHBondContact OH-OG 2.91Å; Y106-R123 HydrophobicContact CE1-CB 4.12Å; Y106-E124 HydrophobicContact CE1-CG 4.34Å |
| 107 | L | 79.5 | Confident | 82.2 | Confident | 78 Ų | 78 | 98.4 Ų | 98.4 | 41% | 0.408 | 51% | 0.507 | S | S | . | . | H | α-helix | trans | -65.8 | -33.3 | 178.7 | -85.9 | 157.1 | 0 | 0 | 0 | 112.2 | L98 V103 Q104 E105 E124 | L98-L107 HydrophobicContact CD2-CD1 4.16Å; V103-L107 HydrophobicContact CG1-CD1 3.87Å; V103-L107 WeakPolarHBondContact O-CB 3.32Å; V103-L107 WeakPolarHBondContact O-CD1 3.49Å; V103-L107 WeakPolarHBondContact O-CG 3.32Å; V103-L107 PolarHBondContact O-N 3.01Å; Q104-L107 PolarHBondContact O-N 3.43Å; Q104-L107 VanDerWaalsContact O-N 3.13Å; E105-L107 PolarHBondContact O-N 2.87Å; L107-E124 HydrophobicContact CD2-CG 4.33Å |
| 108 | F | 83.6 | Confident | 81.7 | Confident | 177 Ų | 177 | 98.5 Ų | 98.5 | 78% | 0.776 | 51% | 0.512 | S | S | * | . | H | α-helix | trans | -92.1 | -10.5 | 179.5 | -66 | -63.9 | 0 | 0 | 0 | 114 | Q104 E105 Y106 | Q104-F108 HydrophobicContact CB-CE2 4.5Å; Q104-F108 WeakPolarHBondContact O-CD2 3.46Å; Q104-F108 PolarHBondContact O-N 3.22Å; Q104-F108 VanDerWaalsContact O-N 3.1Å; E105-F108 PolarHBondContact O-N 3.2Å; Y106-F108 VanDerWaalsContact C-N 3.3Å; Y106-F108 PolarHBondContact O-N 3.35Å |
| 109 | E | 86.3 | Confident | 81.2 | Confident | 81 Ų | 81 | 104 Ų | 104 | 38% | 0.379 | 53% | 0.534 | S | S | . | . | S | Bend | trans | -76 | 131.4 | 177.9 | -169.1 | 164.8 | -147.4 | 0 | 0 | 111.7 | E105 Y106 R114 | E105-E109 WeakPolarHBondContact O-CB 3.45Å; E105-E109 PolarHBondContact O-N 3.38Å; Y106-E109 PolarHBondContact O-N 3.07Å; E109-R114 PolarHBondContact O-NE 2.86Å; E109-R114 PolarHBondContact O-NH2 3.46Å |
| 110 | E | 84.3 | Confident | 80.6 | Confident | 135 Ų | 135 | 99.3 Ų | 99.3 | 63% | 0.631 | 51% | 0.514 | S | S | * | . | trans | -58.7 | 140.5 | 179 | -76.3 | -177.3 | -179.5 | 0 | 0 | 110.9 | G112 Y113 | E110-G112 PolarHBondContact O-N 3.39Å; E110-Y113 HydrophobicContact CB-CD2 4.08Å; E110-Y113 PolarHBondContact O-N 2.96Å | ||
| 111 | P | 79.2 | Confident | 80.1 | Confident | 105 Ų | 105 | 102.4 Ų | 102.4 | 68% | 0.682 | 52% | 0.522 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -53.5 | -26 | -175.2 | -27.3 | 33.3 | 0 | 0 | 0 | 115.1 | Y113 | P111-Y113 VanDerWaalsContact C-N 3.31Å; P111-Y113 PolarHBondContact O-N 3.31Å |
| 112 | G | 85.2 | Confident | 80.4 | Confident | 73 Ų | 73 | 97.1 Ų | 97.1 | 75% | 0.753 | 49% | 0.494 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -71.3 | -19 | -179.9 | 0 | 0 | 0 | 0 | 0 | 115.1 | E110 | E110-G112 PolarHBondContact O-N 3.39Š|
| 113 | Y | 83.2 | Confident | 80.3 | Confident | 170 Ų | 170 | 92.7 Ų | 92.7 | 67% | 0.667 | 47% | 0.471 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -103.4 | -10.6 | -178.4 | -65.3 | -79.6 | 0 | 0 | 0 | 113.6 | E110 P111 | E110-Y113 HydrophobicContact CB-CD2 4.08Å; E110-Y113 PolarHBondContact O-N 2.96Å; P111-Y113 VanDerWaalsContact C-N 3.31Å; P111-Y113 PolarHBondContact O-N 3.31Å |
| 114 | R | 81.1 | Confident | 80.4 | Confident | 41 Ų | 41 | 96.3 Ų | 96.3 | 16% | 0.155 | 49% | 0.488 | C | S | . | . | S | Bend | trans | -65.5 | 139.7 | -178.3 | -62.4 | 178.9 | -179.2 | -166.7 | -4.4 | 111 | Y106 E109 N116 E124 | Y106-R114 HydrophobicContact CE2-CB 4.11Å; Y106-R114 HydrophobicContact CE2-CG 3.94Å; Y106-R114 PolarHBondContact O-NH2 3.5Å; Y106-R114 WeakPolarHBondContact OH-CD 3.4Å; E109-R114 PolarHBondContact O-NE 2.86Å; E109-R114 PolarHBondContact O-NH2 3.46Å; R114-N116 PolarHBondContact O-N 3.39Å; R114-E124 IonicContact CZ-OE1 3.27Å; R114-E124 VanDerWaalsContact CZ-OE1 3.27Å; R114-E124 IonicContact NH1-OE1 2.7Å; R114-E124 PolarHBondContact NH1-OE1 3.4Å; R114-E124 IonicContact NH1-OE2 3.96Å; R114-E124 IonicContact NH2-OE1 2.97Å; R114-E124 PolarHBondContact NH2-OE1 3.13Å |
| 115 | E | 81.2 | Confident | 80.5 | Confident | 161 Ų | 161 | 91.9 Ų | 91.9 | 75% | 0.752 | 47% | 0.467 | S | S | * | . | trans | -59.8 | 133.6 | 176.7 | -64.4 | -171.7 | 163.2 | 0 | 0 | 111 | G117 S120 | E115-G117 PolarHBondContact O-N 2.86Å; E115-S120 WeakPolarHBondContact O-CB 3.32Å; E115-S120 PolarHBondContact O-OG 3.36Å | ||
| 116 | N | 79.9 | Confident | 80.4 | Confident | 157 Ų | 157 | 88.6 Ų | 88.6 | 84% | 0.84 | 45% | 0.454 | S | S | * | . | trans | -70.2 | 22.5 | -178.4 | -69.2 | -41.4 | 0 | 0 | 0 | 114.5 | R114 | R114-N116 PolarHBondContact O-N 3.39Š| ||
| 117 | G | 81.3 | Confident | 80.4 | Confident | 34 Ų | 34 | 89 Ų | 89 | 35% | 0.351 | 46% | 0.459 | S | S | . | . | trans | -76.5 | 139.4 | 175.7 | 0 | 0 | 0 | 0 | 0 | 111.5 | E115 F119 S120 L121 | E115-G117 PolarHBondContact O-N 2.86Å; G117-F119 PolarHBondContact O-N 3.28Å; G117-S120 WeakPolarHBondContact O-CB 3.24Å; G117-S120 PolarHBondContact O-N 3.28Å; G117-L121 PolarHBondContact O-N 2.94Å | ||
| 118 | L | 74.9 | Confident | 80.7 | Confident | 99 Ų | 99 | 86.6 Ų | 86.6 | 52% | 0.518 | 45% | 0.448 | S | S | . | . | H | α-helix | trans | -52.9 | -37.6 | 174.3 | -71.9 | 170 | 0 | 0 | 0 | 112.5 | N122 P207 | L118-N122 VanDerWaalsContact O-CB 3.25Å; L118-N122 WeakPolarHBondContact O-CB 3.32Å; L118-N122 PolarHBondContact O-N 3.39Å; L118-N122 VanDerWaalsContact O-N 3.15Å; L118-N122 PolarHBondContact O-ND2 2.83Å; L118-N122 VanDerWaalsContact O-ND2 3.14Å; L118-P207 HydrophobicContact CD2-CG 3.61Å |
| 119 | F | 72.6 | Confident | 80.8 | Confident | 176 Ų | 176 | 79.9 Ų | 79.9 | 77% | 0.772 | 42% | 0.421 | S | S | * | . | H | α-helix | trans | -73.3 | -34.4 | 178.6 | -75.8 | -76.5 | 0 | 0 | 0 | 113.4 | G117 R123 | G117-F119 PolarHBondContact O-N 3.28Å; F119-R123 PolarHBondContact O-N 3.21Å; F119-R123 VanDerWaalsContact O-N 3.12Å |
| 120 | S | 74.5 | Confident | 80.8 | Confident | 19 Ų | 19 | 80.5 Ų | 80.5 | 13% | 0.133 | 42% | 0.423 | C | S | . | . | H | α-helix | trans | -62.4 | -59.4 | 173.7 | 158.3 | 0 | 0 | 0 | 0 | 108.3 | Y106 E115 G117 N122 R123 | Y106-S120 WeakPolarHBondContact CE2-OG 3.18Å; Y106-S120 VanDerWaalsContact CZ-O 3.29Å; Y106-S120 PolarHBondContact OH-O 2.8Å; Y106-S120 PolarHBondContact OH-OG 2.91Å; E115-S120 WeakPolarHBondContact O-CB 3.32Å; E115-S120 PolarHBondContact O-OG 3.36Å; G117-S120 WeakPolarHBondContact O-CB 3.24Å; G117-S120 PolarHBondContact O-N 3.28Å; S120-N122 PolarHBondContact O-N 3.06Å; S120-R123 VanDerWaalsContact O-CB 3.31Å; S120-R123 WeakPolarHBondContact O-CB 3.01Å; S120-R123 PolarHBondContact O-N 3.45Å |
| 121 | L | 74.9 | Confident | 80.9 | Confident | 95 Ų | 95 | 74.9 Ų | 74.9 | 50% | 0.497 | 40% | 0.401 | S | S | . | . | H | α-helix | trans | -54.6 | -31.8 | -179.3 | -77.2 | 152.6 | 0 | 0 | 0 | 113.9 | G117 | G117-L121 PolarHBondContact O-N 2.94Å |
| 122 | N | 81.9 | Confident | 81.2 | Confident | 28 Ų | 28 | 71.6 Ų | 71.6 | 15% | 0.15 | 38% | 0.38 | C | S | . | . | T | Hydrogen-bonded Turn | trans | -98.6 | 2 | -176.6 | -63.2 | -18.8 | 0 | 0 | 0 | 114.1 | L118 S120 E124 G125 I126 N204 | L118-N122 VanDerWaalsContact O-CB 3.25Å; L118-N122 WeakPolarHBondContact O-CB 3.32Å; L118-N122 PolarHBondContact O-N 3.39Å; L118-N122 VanDerWaalsContact O-N 3.15Å; L118-N122 PolarHBondContact O-ND2 2.83Å; L118-N122 VanDerWaalsContact O-ND2 3.14Å; S120-N122 PolarHBondContact O-N 3.06Å; N122-E124 PolarHBondContact O-N 3.14Å; N122-G125 PolarHBondContact O-N 3.41Å; N122-G125 VanDerWaalsContact O-N 3.13Å; N122-I126 WeakPolarHBondContact O-CG1 3.48Å; N122-I126 PolarHBondContact O-N 3.36Å; N122-N204 PolarHBondContact ND2-O 3.47Å; N122-N204 VanDerWaalsContact OD1-CB 3.24Å; N122-N204 WeakPolarHBondContact OD1-CB 3.26Å; N122-N204 PolarHBondContact OD1-O 3.35Å |
| 123 | R | 78.5 | Confident | 81.2 | Confident | 55 Ų | 55 | 70.9 Ų | 70.9 | 21% | 0.208 | 36% | 0.359 | C | S | . | . | H | α-helix | trans | -61.5 | -46 | -175.2 | -163 | -179.5 | -166.4 | 178.8 | 9.1 | 111.8 | E102 V103 Y106 F119 S120 G125 I126 V127 | E102-R123 PolarHBondContact O-NH1 2.66Å; V103-R123 VanDerWaalsContact CG2-CZ 3.41Å; Y106-R123 HydrophobicContact CE1-CB 4.12Å; F119-R123 PolarHBondContact O-N 3.21Å; F119-R123 VanDerWaalsContact O-N 3.12Å; S120-R123 VanDerWaalsContact O-CB 3.31Å; S120-R123 WeakPolarHBondContact O-CB 3.01Å; S120-R123 PolarHBondContact O-N 3.45Å; R123-G125 VanDerWaalsContact C-N 3.26Å; R123-G125 PolarHBondContact O-N 3.49Å; R123-I126 PolarHBondContact O-N 2.81Å; R123-V127 WeakPolarHBondContact O-CG2 3.32Å; R123-V127 PolarHBondContact O-N 2.62Å |
| 124 | E | 79 | Confident | 81.3 | Confident | 82 Ų | 82 | 63.4 Ų | 63.4 | 38% | 0.383 | 33% | 0.331 | S | S | . | . | H | α-helix | trans | -59.6 | -40.2 | 175.4 | -68.7 | 176.7 | -173.9 | 0 | 0 | 111.3 | Y106 L107 R114 N122 V127 S128 | Y106-E124 HydrophobicContact CE1-CG 4.34Å; L107-E124 HydrophobicContact CD2-CG 4.33Å; R114-E124 IonicContact CZ-OE1 3.27Å; R114-E124 VanDerWaalsContact CZ-OE1 3.27Å; R114-E124 IonicContact NH1-OE1 2.7Å; R114-E124 PolarHBondContact NH1-OE1 3.4Å; R114-E124 IonicContact NH1-OE2 3.96Å; R114-E124 IonicContact NH2-OE1 2.97Å; R114-E124 PolarHBondContact NH2-OE1 3.13Å; N122-E124 PolarHBondContact O-N 3.14Å; E124-V127 PolarHBondContact O-N 2.84Å; E124-S128 VanDerWaalsContact O-CB 3.29Å; E124-S128 WeakPolarHBondContact O-CB 3.31Å; E124-S128 PolarHBondContact O-N 3.19Å |
| 125 | G | 83.5 | Confident | 81.5 | Confident | 3 Ų | 3 | 65 Ų | 65 | 3% | 0.031 | 34% | 0.342 | C | S | . | . | H | α-helix | trans | -64.4 | -43.3 | 178.4 | 0 | 0 | 0 | 0 | 0 | 113.8 | N122 R123 S128 V129 F200 | N122-G125 PolarHBondContact O-N 3.41Å; N122-G125 VanDerWaalsContact O-N 3.13Å; R123-G125 VanDerWaalsContact C-N 3.26Å; R123-G125 PolarHBondContact O-N 3.49Å; G125-S128 WeakPolarHBondContact O-CB 3.32Å; G125-S128 PolarHBondContact O-N 3.36Å; G125-V129 WeakPolarHBondContact O-CG2 3.36Å; G125-V129 PolarHBondContact O-N 3.35Å; G125-F200 VanDerWaalsContact CA-CE1 3.45Å |
| 126 | I | 81.4 | Confident | 81.7 | Confident | 72 Ų | 72 | 58.9 Ų | 58.9 | 37% | 0.369 | 31% | 0.313 | S | S | . | . | H | α-helix | trans | -64 | -45.8 | 176.8 | -66.3 | 165.9 | 0 | 0 | 0 | 110.3 | N122 R123 S128 V129 F130 | N122-I126 WeakPolarHBondContact O-CG1 3.48Å; N122-I126 PolarHBondContact O-N 3.36Å; R123-I126 PolarHBondContact O-N 2.81Å; I126-S128 VanDerWaalsContact C-N 3.3Å; I126-S128 PolarHBondContact O-N 3.4Å; I126-V129 PolarHBondContact O-N 3.22Å; I126-F130 HydrophobicContact CG2-CD2 4.02Å; I126-F130 HydrophobicContact CG2-CE2 3.69Å; I126-F130 WeakPolarHBondContact O-CD2 3.43Å; I126-F130 PolarHBondContact O-N 3.5Å |
| 127 | V | 83.4 | Confident | 81.8 | Confident | 29 Ų | 29 | 53 Ų | 53 | 18% | 0.176 | 28% | 0.281 | C | S | . | . | H | α-helix | trans | -60.6 | -41.8 | 177.1 | 172.9 | 0 | 0 | 0 | 0 | 111 | F97 L98 R123 E124 V129 F130 G131 | F97-V127 HydrophobicContact CD1-CG2 4.02Å; F97-V127 HydrophobicContact CE1-CG2 3.6Å; L98-V127 HydrophobicContact CD2-CG1 3.97Å; R123-V127 WeakPolarHBondContact O-CG2 3.32Å; R123-V127 PolarHBondContact O-N 2.62Å; E124-V127 PolarHBondContact O-N 2.84Å; V127-V129 PolarHBondContact O-N 2.77Å; V127-F130 PolarHBondContact O-N 2.88Å; V127-G131 PolarHBondContact O-N 3.17Å |
| 128 | S | 85 | Confident | 81.8 | Confident | 26 Ų | 26 | 54.9 Ų | 54.9 | 18% | 0.182 | 28% | 0.28 | C | S | . | . | H | α-helix | trans | -60.1 | -44.1 | 176.8 | 180 | 0 | 0 | 0 | 0 | 112.3 | F23 E124 G125 I126 F130 G131 C132 | F23-S128 WeakPolarHBondContact CD1-OG 3.42Å; F23-S128 WeakPolarHBondContact CE1-OG 3.33Å; E124-S128 VanDerWaalsContact O-CB 3.29Å; E124-S128 WeakPolarHBondContact O-CB 3.31Å; E124-S128 PolarHBondContact O-N 3.19Å; G125-S128 WeakPolarHBondContact O-CB 3.32Å; G125-S128 PolarHBondContact O-N 3.36Å; I126-S128 VanDerWaalsContact C-N 3.3Å; I126-S128 PolarHBondContact O-N 3.4Å; S128-F130 VanDerWaalsContact C-N 3.3Å; S128-F130 PolarHBondContact O-N 3.13Å; S128-G131 PolarHBondContact O-N 2.95Å; S128-G131 VanDerWaalsContact O-N 3.12Å; S128-C132 PolarHBondContact O-N 3Å; S128-C132 PolarHBondContact O-SG 3.19Å; S128-C132 VanDerWaalsContact O-SG 3.37Å |
| 129 | V | 85.9 | Confident | 82.4 | Confident | 37 Ų | 37 | 52.5 Ų | 52.5 | 22% | 0.224 | 27% | 0.274 | C | S | . | . | H | α-helix | trans | -56 | -45.5 | 175.8 | 173.2 | 0 | 0 | 0 | 0 | 111.5 | G125 I126 V127 C132 L133 L197 L201 | G125-V129 WeakPolarHBondContact O-CG2 3.36Å; G125-V129 PolarHBondContact O-N 3.35Å; I126-V129 PolarHBondContact O-N 3.22Å; V127-V129 PolarHBondContact O-N 2.77Å; V129-C132 PolarHBondContact O-N 2.73Å; V129-L133 VanDerWaalsContact O-CB 3.31Å; V129-L133 WeakPolarHBondContact O-CB 3.25Å; V129-L133 PolarHBondContact O-N 3.43Å; V129-L197 HydrophobicContact CB-CD2 4.41Å; V129-L197 HydrophobicContact CG1-CD2 4.34Å; V129-L197 HydrophobicContact CG2-CD1 3.74Å; V129-L197 HydrophobicContact CG2-CD2 4Å; V129-L197 HydrophobicContact CG2-CG 4.01Å; V129-L201 HydrophobicContact CG2-CD1 3.8Å; V129-L201 HydrophobicContact CG2-CD2 3.78Å; V129-L201 HydrophobicContact CG2-CG 4.06Å |
| 130 | F | 85.5 | Confident | 82.9 | Confident | 94 Ų | 94 | 45 Ų | 45 | 41% | 0.412 | 24% | 0.243 | S | C | . | . | H | α-helix | trans | -70 | -34.9 | 179.5 | -73.9 | -69.4 | 0 | 0 | 0 | 112.3 | I90 L94 I126 V127 S128 L133 T134 | I90-F130 HydrophobicContact CG2-CD1 4.45Å; L94-F130 HydrophobicContact CD1-CB 3.71Å; L94-F130 HydrophobicContact CD2-CB 3.29Å; L94-F130 HydrophobicContact CD2-CD2 4.28Å; L94-F130 HydrophobicContact CD2-CG 4Å; L94-F130 HydrophobicContact CG-CB 3.88Å; I126-F130 HydrophobicContact CG2-CD2 4.02Å; I126-F130 HydrophobicContact CG2-CE2 3.69Å; I126-F130 WeakPolarHBondContact O-CD2 3.43Å; I126-F130 PolarHBondContact O-N 3.5Å; V127-F130 PolarHBondContact O-N 2.88Å; S128-F130 VanDerWaalsContact C-N 3.3Å; S128-F130 PolarHBondContact O-N 3.13Å; F130-L133 PolarHBondContact O-N 2.82Å; F130-T134 WeakPolarHBondContact O-CB 3.28Å; F130-T134 PolarHBondContact O-N 2.88Å; F130-T134 PolarHBondContact O-OG1 2.97Å |
| 131 | G | 85.9 | Confident | 83.3 | Confident | 17 Ų | 17 | 45.1 Ų | 45.1 | 18% | 0.175 | 24% | 0.241 | C | C | . | . | H | α-helix | trans | -59.8 | -51.3 | 170.6 | 0 | 0 | 0 | 0 | 0 | 111.7 | V127 S128 L133 T134 I135 | V127-G131 PolarHBondContact O-N 3.17Å; S128-G131 PolarHBondContact O-N 2.95Å; S128-G131 VanDerWaalsContact O-N 3.12Å; G131-L133 VanDerWaalsContact C-N 3.34Å; G131-L133 PolarHBondContact O-N 2.87Å; G131-T134 WeakPolarHBondContact O-CB 3.4Å; G131-T134 PolarHBondContact O-N 2.61Å; G131-I135 WeakPolarHBondContact O-CG1 3.26Å; G131-I135 PolarHBondContact O-N 2.98Å |
| 132 | C | 86.9 | Confident | 83.6 | Confident | 36 Ų | 36 | 46.1 Ų | 46.1 | 24% | 0.243 | 25% | 0.246 | C | C | . | . | H | α-helix | trans | -59.7 | -42.7 | 175.7 | -67.8 | 0 | 0 | 0 | 0 | 112.1 | S128 V129 T134 I135 F136 L197 | S128-C132 PolarHBondContact O-N 3Å; S128-C132 PolarHBondContact O-SG 3.19Å; S128-C132 VanDerWaalsContact O-SG 3.37Å; V129-C132 PolarHBondContact O-N 2.73Å; C132-T134 VanDerWaalsContact C-N 3.31Å; C132-T134 PolarHBondContact O-N 3.43Å; C132-I135 PolarHBondContact O-N 3.13Å; C132-F136 VanDerWaalsContact O-CB 3.32Å; C132-F136 WeakPolarHBondContact O-CB 3.27Å; C132-F136 PolarHBondContact O-N 3.4Å; C132-L197 HydrophobicContact CB-CD2 4.5Å |
| 133 | L | 85.1 | Confident | 83.8 | Confident | 58 Ų | 58 | 48.7 Ų | 48.7 | 30% | 0.304 | 26% | 0.257 | S | S | . | . | H | α-helix | trans | -62.1 | -40.3 | 176.8 | -177.9 | 64.8 | 0 | 0 | 0 | 111.5 | I90 V129 F130 G131 F136 L137 | I90-L133 HydrophobicContact CD1-CD2 4.3Å; V129-L133 VanDerWaalsContact O-CB 3.31Å; V129-L133 WeakPolarHBondContact O-CB 3.25Å; V129-L133 PolarHBondContact O-N 3.43Å; F130-L133 PolarHBondContact O-N 2.82Å; G131-L133 VanDerWaalsContact C-N 3.34Å; G131-L133 PolarHBondContact O-N 2.87Å; L133-F136 PolarHBondContact O-N 3.44Å; L133-L137 HydrophobicContact CG-CD1 4.29Å; L133-L137 VanDerWaalsContact O-CG 3.26Å; L133-L137 WeakPolarHBondContact O-CG 3.38Å; L133-L137 PolarHBondContact O-N 2.76Å |
| 134 | T | 84.1 | Confident | 83.9 | Confident | 12 Ų | 12 | 47.2 Ų | 47.2 | 7% | 0.074 | 25% | 0.251 | C | S | . | . | H | α-helix | trans | -63.8 | -49.5 | 177.3 | -60.8 | 0 | 0 | 0 | 0 | 111 | I90 T91 F130 G131 C132 F136 L137 F138 | I90-T134 VanDerWaalsContact CG2-OG1 3.27Å; I90-T134 WeakPolarHBondContact CG2-OG1 3.42Å; T91-T134 WeakPolarHBondContact OG1-CG2 3.4Å; F130-T134 WeakPolarHBondContact O-CB 3.28Å; F130-T134 PolarHBondContact O-N 2.88Å; F130-T134 PolarHBondContact O-OG1 2.97Å; G131-T134 WeakPolarHBondContact O-CB 3.4Å; G131-T134 PolarHBondContact O-N 2.61Å; C132-T134 VanDerWaalsContact C-N 3.31Å; C132-T134 PolarHBondContact O-N 3.43Å; T134-F136 VanDerWaalsContact C-N 3.29Å; T134-F136 PolarHBondContact O-N 3.28Å; T134-L137 PolarHBondContact O-N 2.98Å; T134-F138 HydrophobicContact CG2-CD2 3.82Å; T134-F138 HydrophobicContact CG2-CE2 3.68Å; T134-F138 VanDerWaalsContact O-CD2 3.24Å; T134-F138 WeakPolarHBondContact O-CD2 3.48Å; T134-F138 PolarHBondContact O-N 3.42Å |
| 135 | I | 85.6 | Confident | 83.9 | Confident | 75 Ų | 75 | 48.1 Ų | 48.1 | 39% | 0.385 | 26% | 0.259 | S | S | . | . | H | α-helix | trans | -57.9 | -45.2 | 175.6 | -63.9 | 158.2 | 0 | 0 | 0 | 110.3 | L27 G131 C132 L137 F138 A139 | L27-I135 HydrophobicContact CD1-CD1 3.5Å; L27-I135 HydrophobicContact CD1-CG1 4.31Å; L27-I135 HydrophobicContact CD2-CD1 4Å; L27-I135 HydrophobicContact CD2-CG1 3.95Å; L27-I135 HydrophobicContact CG-CD1 3.7Å; L27-I135 HydrophobicContact CG-CG1 4.22Å; G131-I135 WeakPolarHBondContact O-CG1 3.26Å; G131-I135 PolarHBondContact O-N 2.98Å; C132-I135 PolarHBondContact O-N 3.13Å; I135-L137 PolarHBondContact O-N 3.39Å; I135-F138 PolarHBondContact O-N 3.24Å; I135-A139 WeakPolarHBondContact O-CB 3.49Å; I135-A139 PolarHBondContact O-N 2.87Å |
| 136 | F | 85.4 | Confident | 83.8 | Confident | 33 Ų | 33 | 55.1 Ų | 55.1 | 15% | 0.145 | 28% | 0.284 | C | S | . | . | H | α-helix | trans | -58.8 | -46.8 | 178.8 | 176.8 | -94.7 | 0 | 0 | 0 | 111.7 | C132 L133 T134 F138 A139 T140 L183 L188 | C132-F136 VanDerWaalsContact O-CB 3.32Å; C132-F136 WeakPolarHBondContact O-CB 3.27Å; C132-F136 PolarHBondContact O-N 3.4Å; L133-F136 PolarHBondContact O-N 3.44Å; T134-F136 VanDerWaalsContact C-N 3.29Å; T134-F136 PolarHBondContact O-N 3.28Å; F136-F138 VanDerWaalsContact C-N 3.35Å; F136-F138 PolarHBondContact O-N 2.89Å; F136-A139 PolarHBondContact O-N 3.45Å; F136-T140 HydrophobicContact CD1-CG2 4.22Å; F136-T140 HydrophobicContact CD2-CG2 4.35Å; F136-T140 HydrophobicContact CE1-CG2 3.7Å; F136-T140 HydrophobicContact CE2-CG2 3.85Å; F136-T140 HydrophobicContact CZ-CG2 3.48Å; F136-T140 VanDerWaalsContact CZ-CG2 3.48Å; F136-T140 VanDerWaalsContact O-CG2 3.32Å; F136-T140 WeakPolarHBondContact O-CG2 3.03Å; F136-T140 PolarHBondContact O-N 3.39Å; F136-T140 PolarHBondContact O-OG1 2.96Å; F136-L183 HydrophobicContact CE1-CD2 4.05Å; F136-L183 HydrophobicContact CZ-CD2 3.94Å; F136-L188 HydrophobicContact CD1-CD1 3.61Å; F136-L188 HydrophobicContact CD1-CD2 4.43Å; F136-L188 HydrophobicContact CD1-CG 4.5Å; F136-L188 HydrophobicContact CD2-CD1 3.65Å; F136-L188 HydrophobicContact CE1-CB 4.07Å; F136-L188 HydrophobicContact CE1-CD1 3.62Å; F136-L188 HydrophobicContact CE1-CD2 3.89Å; F136-L188 HydrophobicContact CE1-CG 4.05Å; F136-L188 HydrophobicContact CE2-CB 3.82Å; F136-L188 HydrophobicContact CE2-CD1 3.66Å; F136-L188 HydrophobicContact CE2-CG 4.28Å; F136-L188 HydrophobicContact CG-CD1 3.63Å; F136-L188 HydrophobicContact CZ-CB 3.48Å; F136-L188 VanDerWaalsContact CZ-CB 3.48Å; F136-L188 HydrophobicContact CZ-CD1 3.65Å; F136-L188 HydrophobicContact CZ-CD2 4.19Å; F136-L188 HydrophobicContact CZ-CG 3.94Å |
| 137 | L | 82.8 | Confident | 83.9 | Confident | 33 Ų | 33 | 55.1 Ų | 55.1 | 17% | 0.173 | 28% | 0.282 | C | S | . | . | H | α-helix | trans | -59.8 | -45.2 | 177 | -70.8 | 169 | 0 | 0 | 0 | 111.2 | I90 L133 T134 I135 T140 E141 | I90-L137 HydrophobicContact CD1-CD1 3.64Å; L133-L137 HydrophobicContact CG-CD1 4.29Å; L133-L137 VanDerWaalsContact O-CG 3.26Å; L133-L137 WeakPolarHBondContact O-CG 3.38Å; L133-L137 PolarHBondContact O-N 2.76Å; T134-L137 PolarHBondContact O-N 2.98Å; I135-L137 PolarHBondContact O-N 3.39Å; L137-T140 PolarHBondContact O-N 2.87Å; L137-T140 PolarHBondContact O-OG1 3.17Å; L137-E141 VanDerWaalsContact O-CG 3.32Å; L137-E141 WeakPolarHBondContact O-CG 3.39Å; L137-E141 PolarHBondContact O-N 2.73Å; L137-E141 VanDerWaalsContact O-N 3.14Å |
| 138 | F | 81.7 | Confident | 83.6 | Confident | 74 Ų | 74 | 56.2 Ų | 56.2 | 33% | 0.325 | 29% | 0.291 | S | S | . | . | H | α-helix | trans | -64.7 | -42.2 | 175.9 | -80.1 | -68.1 | 0 | 0 | 0 | 113.2 | V88 T134 I135 F136 T140 E141 I142 | V88-F138 HydrophobicContact CG2-CZ 4.11Å; T134-F138 HydrophobicContact CG2-CD2 3.82Å; T134-F138 HydrophobicContact CG2-CE2 3.68Å; T134-F138 VanDerWaalsContact O-CD2 3.24Å; T134-F138 WeakPolarHBondContact O-CD2 3.48Å; T134-F138 PolarHBondContact O-N 3.42Å; I135-F138 PolarHBondContact O-N 3.24Å; F136-F138 VanDerWaalsContact C-N 3.35Å; F136-F138 PolarHBondContact O-N 2.89Å; F138-T140 PolarHBondContact O-N 2.77Å; F138-E141 PolarHBondContact O-N 3.02Å; F138-I142 VanDerWaalsContact O-CG1 3.31Å; F138-I142 WeakPolarHBondContact O-CG1 3.45Å; F138-I142 PolarHBondContact O-N 3.5Å |
| 139 | A | 86.2 | Confident | 83.3 | Confident | 49 Ų | 49 | 58.1 Ų | 58.1 | 41% | 0.405 | 30% | 0.304 | S | S | . | . | H | α-helix | trans | -60.2 | -45.7 | 178.6 | 0 | 0 | 0 | 0 | 0 | 111.2 | I135 F136 E141 I142 E143 | I135-A139 WeakPolarHBondContact O-CB 3.49Å; I135-A139 PolarHBondContact O-N 2.87Å; F136-A139 PolarHBondContact O-N 3.45Å; A139-E141 VanDerWaalsContact C-N 3.3Å; A139-E141 PolarHBondContact O-N 3.24Å; A139-I142 PolarHBondContact O-N 2.94Å; A139-E143 WeakPolarHBondContact O-CB 3.27Å; A139-E143 PolarHBondContact O-N 3.39Å |
| 140 | T | 83.5 | Confident | 83.2 | Confident | 17 Ų | 17 | 61.3 Ų | 61.3 | 10% | 0.104 | 32% | 0.316 | C | S | . | . | H | α-helix | trans | -64.9 | -33.4 | 177.5 | 61 | 0 | 0 | 0 | 0 | 112.9 | F136 L137 F138 R144 L183 | F136-T140 HydrophobicContact CD1-CG2 4.22Å; F136-T140 HydrophobicContact CD2-CG2 4.35Å; F136-T140 HydrophobicContact CE1-CG2 3.7Å; F136-T140 HydrophobicContact CE2-CG2 3.85Å; F136-T140 HydrophobicContact CZ-CG2 3.48Å; F136-T140 VanDerWaalsContact CZ-CG2 3.48Å; F136-T140 VanDerWaalsContact O-CG2 3.32Å; F136-T140 WeakPolarHBondContact O-CG2 3.03Å; F136-T140 PolarHBondContact O-N 3.39Å; F136-T140 PolarHBondContact O-OG1 2.96Å; L137-T140 PolarHBondContact O-N 2.87Å; L137-T140 PolarHBondContact O-OG1 3.17Å; F138-T140 PolarHBondContact O-N 2.77Å; T140-R144 WeakPolarHBondContact O-CB 3.37Å; T140-R144 PolarHBondContact O-N 2.9Å; T140-L183 HydrophobicContact CG2-CD2 3.92Å |
| 141 | E | 82.4 | Confident | 82.9 | Confident | 23 Ų | 23 | 59.3 Ų | 59.3 | 11% | 0.107 | 31% | 0.307 | C | S | . | . | H | α-helix | trans | -69.5 | -43.7 | 174.6 | -73 | -60.8 | 135.5 | 0 | 0 | 112 | K83 L137 F138 A139 R144 L145 | K83-E141 HydrophobicContact CB-CG 4.48Å; K83-E141 WeakPolarHBondContact CB-OE1 3.31Å; K83-E141 WeakPolarHBondContact CD-OE1 3.5Å; L137-E141 VanDerWaalsContact O-CG 3.32Å; L137-E141 WeakPolarHBondContact O-CG 3.39Å; L137-E141 PolarHBondContact O-N 2.73Å; L137-E141 VanDerWaalsContact O-N 3.14Å; F138-E141 PolarHBondContact O-N 3.02Å; A139-E141 VanDerWaalsContact C-N 3.3Å; A139-E141 PolarHBondContact O-N 3.24Å; E141-R144 PolarHBondContact O-N 3.17Å; E141-R144 IonicContact OE1-CZ 3.48Å; E141-R144 IonicContact OE1-NH2 2.66Å; E141-R144 PolarHBondContact OE1-NH2 3.49Å; E141-R144 IonicContact OE2-CZ 3.63Å; E141-R144 IonicContact OE2-NE 3.95Å; E141-R144 IonicContact OE2-NH2 2.62Å; E141-R144 PolarHBondContact OE2-NH2 3.35Å; E141-L145 WeakPolarHBondContact O-CB 3.47Å; E141-L145 PolarHBondContact O-N 3.47Å |
| 142 | I | 81.3 | Confident | 82.5 | Confident | 115 Ų | 115 | 61.9 Ų | 61.9 | 59% | 0.59 | 32% | 0.319 | S | S | * | . | H | α-helix | trans | -64.1 | -45.1 | 176.8 | -68.1 | 167.3 | 0 | 0 | 0 | 110.5 | F138 A139 R144 L145 W146 | F138-I142 VanDerWaalsContact O-CG1 3.31Å; F138-I142 WeakPolarHBondContact O-CG1 3.45Å; F138-I142 PolarHBondContact O-N 3.5Å; A139-I142 PolarHBondContact O-N 2.94Å; I142-R144 PolarHBondContact O-N 2.91Å; I142-L145 PolarHBondContact O-N 3.46Å; I142-W146 WeakPolarHBondContact O-CB 3.29Å; I142-W146 PolarHBondContact O-N 3.33Å |
| 143 | E | 86.4 | Confident | 82 | Confident | 82 Ų | 82 | 65.1 Ų | 65.1 | 38% | 0.383 | 33% | 0.332 | S | S | . | . | H | α-helix | trans | -59.8 | -46.8 | 177.4 | -178.1 | 169.9 | -157.5 | 0 | 0 | 111 | A139 L145 W146 H147 | A139-E143 WeakPolarHBondContact O-CB 3.27Å; A139-E143 PolarHBondContact O-N 3.39Å; E143-L145 PolarHBondContact O-N 2.9Å; E143-W146 WeakPolarHBondContact O-CB 3.19Å; E143-W146 PolarHBondContact O-N 3.45Å; E143-H147 PolarHBondContact O-CD2 3.23Å; E143-H147 PolarHBondContact O-N 2.89Å |
| 144 | R | 80.1 | Confident | 81.9 | Confident | 24 Ų | 24 | 64.9 Ų | 64.9 | 9% | 0.091 | 34% | 0.335 | C | S | . | . | H | α-helix | trans | -63.4 | -41.6 | 176.9 | -174.1 | 175.8 | 61.6 | -178.7 | -7.6 | 112.4 | L80 T140 E141 I142 W146 H147 C148 | L80-R144 VanDerWaalsContact CA-NH2 3.27Å; T140-R144 WeakPolarHBondContact O-CB 3.37Å; T140-R144 PolarHBondContact O-N 2.9Å; E141-R144 PolarHBondContact O-N 3.17Å; E141-R144 IonicContact OE1-CZ 3.48Å; E141-R144 IonicContact OE1-NH2 2.66Å; E141-R144 PolarHBondContact OE1-NH2 3.49Å; E141-R144 IonicContact OE2-CZ 3.63Å; E141-R144 IonicContact OE2-NE 3.95Å; E141-R144 IonicContact OE2-NH2 2.62Å; E141-R144 PolarHBondContact OE2-NH2 3.35Å; I142-R144 PolarHBondContact O-N 2.91Å; R144-W146 VanDerWaalsContact C-N 3.32Å; R144-H147 PolarHBondContact O-N 3.33Å; R144-C148 VanDerWaalsContact O-CB 3.28Å; R144-C148 WeakPolarHBondContact O-CB 3.31Å; R144-C148 PolarHBondContact O-N 2.9Å |
| 145 | L | 78.8 | Confident | 81.5 | Confident | 102 Ų | 102 | 66.3 Ų | 66.3 | 53% | 0.534 | 34% | 0.342 | S | S | . | . | H | α-helix | trans | -61.8 | -44 | 176.1 | -176.4 | 66.1 | 0 | 0 | 0 | 110.6 | E141 I142 E143 C148 C149 | E141-L145 WeakPolarHBondContact O-CB 3.47Å; E141-L145 PolarHBondContact O-N 3.47Å; I142-L145 PolarHBondContact O-N 3.46Å; E143-L145 PolarHBondContact O-N 2.9Å; L145-C148 PolarHBondContact O-N 3.45Å; L145-C149 WeakPolarHBondContact O-CB 3.23Å; L145-C149 PolarHBondContact O-N 3.27Å; L145-C149 PolarHBondContact O-SG 3.49Å |
| 146 | W | 83.1 | Confident | 81.2 | Confident | 150 Ų | 150 | 68.4 Ų | 68.4 | 57% | 0.568 | 35% | 0.353 | S | S | * | . | H | α-helix | trans | -61.8 | -48.5 | 178 | -177.6 | -95.1 | 0 | 0 | 0 | 112.2 | I142 E143 R144 C148 C149 Q150 | I142-W146 WeakPolarHBondContact O-CB 3.29Å; I142-W146 PolarHBondContact O-N 3.33Å; E143-W146 WeakPolarHBondContact O-CB 3.19Å; E143-W146 PolarHBondContact O-N 3.45Å; R144-W146 VanDerWaalsContact C-N 3.32Å; W146-C148 VanDerWaalsContact C-N 3.33Å; W146-C148 PolarHBondContact O-N 3.3Å; W146-C149 PolarHBondContact O-N 2.85Å; W146-Q150 PolarHBondContact O-N 2.89Å |
| 147 | H | 81.9 | Confident | 81.1 | Confident | 71 Ų | 71 | 74.1 Ų | 74.1 | 33% | 0.329 | 38% | 0.38 | S | S | . | . | H | α-helix | trans | -60.8 | -41.5 | 176 | -90.1 | -79.6 | 0 | 0 | 0 | 112.1 | E143 R144 Q150 F151 M175 | E143-H147 PolarHBondContact O-CD2 3.23Å; E143-H147 PolarHBondContact O-N 2.89Å; R144-H147 PolarHBondContact O-N 3.33Å; H147-Q150 PolarHBondContact O-N 3.23Å; H147-F151 WeakPolarHBondContact O-CB 3.38Å; H147-F151 PolarHBondContact O-N 3.06Å; H147-M175 HydrophobicContact CB-CE 3.89Å |
| 148 | C | 77.7 | Confident | 81.1 | Confident | 52 Ų | 52 | 77.5 Ų | 77.5 | 35% | 0.351 | 40% | 0.398 | S | S | . | . | H | α-helix | trans | -61.4 | -46.1 | 174.4 | -172.3 | 0 | 0 | 0 | 0 | 111.6 | R144 L145 W146 Q150 F151 V152 | R144-C148 VanDerWaalsContact O-CB 3.28Å; R144-C148 WeakPolarHBondContact O-CB 3.31Å; R144-C148 PolarHBondContact O-N 2.9Å; L145-C148 PolarHBondContact O-N 3.45Å; W146-C148 VanDerWaalsContact C-N 3.33Å; W146-C148 PolarHBondContact O-N 3.3Å; C148-Q150 PolarHBondContact O-N 2.84Å; C148-F151 PolarHBondContact O-N 3.44Å; C148-V152 WeakPolarHBondContact O-CG2 2.97Å; C148-V152 PolarHBondContact O-N 2.85Å |
| 149 | C | 77.9 | Confident | 80.9 | Confident | 67 Ų | 67 | 77 Ų | 77 | 45% | 0.453 | 41% | 0.414 | S | S | . | . | H | α-helix | trans | -60.4 | -44.8 | 175.7 | -72.5 | 0 | 0 | 0 | 0 | 112 | L145 W146 F151 V152 M153 | L145-C149 WeakPolarHBondContact O-CB 3.23Å; L145-C149 PolarHBondContact O-N 3.27Å; L145-C149 PolarHBondContact O-SG 3.49Å; W146-C149 PolarHBondContact O-N 2.85Å; C149-F151 PolarHBondContact O-N 3.43Å; C149-V152 PolarHBondContact O-N 2.83Å; C149-M153 WeakPolarHBondContact O-CB 3.47Å; C149-M153 WeakPolarHBondContact O-CG 3.48Å; C149-M153 PolarHBondContact O-N 3.02Å |
| 150 | Q | 85.5 | Confident | 79.8 | Confident | 104 Ų | 104 | 80.8 Ų | 80.8 | 49% | 0.486 | 42% | 0.423 | S | S | . | . | H | α-helix | trans | -61.6 | -42.8 | 176.8 | -75.9 | -161.2 | -6 | 0 | 0 | 112.3 | W146 H147 C148 M153 S154 | W146-Q150 PolarHBondContact O-N 2.89Å; H147-Q150 PolarHBondContact O-N 3.23Å; C148-Q150 PolarHBondContact O-N 2.84Å; Q150-M153 PolarHBondContact O-N 3.49Å; Q150-S154 WeakPolarHBondContact O-CB 3.45Å; Q150-S154 PolarHBondContact O-N 3.33Å |
| 151 | F | 79.6 | Confident | 78.8 | Confident | 52 Ų | 52 | 88.2 Ų | 88.2 | 23% | 0.228 | 45% | 0.454 | C | S | . | . | H | α-helix | trans | -61.9 | -47 | 177.3 | 179.2 | -103.4 | 0 | 0 | 0 | 111.7 | H147 C148 C149 M153 S154 L155 V168 M172 M175 | H147-F151 WeakPolarHBondContact O-CB 3.38Å; H147-F151 PolarHBondContact O-N 3.06Å; C148-F151 PolarHBondContact O-N 3.44Å; C149-F151 PolarHBondContact O-N 3.43Å; F151-M153 PolarHBondContact O-N 2.72Å; F151-S154 WeakPolarHBondContact O-CB 3.15Å; F151-S154 PolarHBondContact O-N 3.01Å; F151-L155 HydrophobicContact CD1-CD1 3.99Å; F151-L155 HydrophobicContact CE1-CD1 3.48Å; F151-L155 VanDerWaalsContact CE1-CD1 3.48Å; F151-L155 HydrophobicContact CE1-CG 4.21Å; F151-L155 HydrophobicContact CZ-CD1 3.88Å; F151-L155 HydrophobicContact CZ-CD2 4.44Å; F151-L155 HydrophobicContact CZ-CG 4.25Å; F151-L155 WeakPolarHBondContact O-CG 3.24Å; F151-L155 PolarHBondContact O-N 3.24Å; F151-V168 HydrophobicContact CE1-CG1 4.35Å; F151-M172 HydrophobicContact CE1-CG 3.97Å; F151-M172 HydrophobicContact CE1-SD 4.42Å; F151-M172 HydrophobicContact CZ-CG 4.44Å; F151-M175 HydrophobicContact CB-CE 4.45Å |
| 152 | V | 76 | Confident | 77.8 | Confident | 70 Ų | 70 | 91.4 Ų | 91.4 | 42% | 0.424 | 47% | 0.471 | S | S | . | . | H | α-helix | trans | -61.4 | -43.5 | 176.6 | 172.7 | 0 | 0 | 0 | 0 | 111.2 | C148 C149 S154 L155 I156 | C148-V152 WeakPolarHBondContact O-CG2 2.97Å; C148-V152 PolarHBondContact O-N 2.85Å; C149-V152 PolarHBondContact O-N 2.83Å; V152-S154 VanDerWaalsContact C-N 3.35Å; V152-S154 PolarHBondContact O-N 3.44Å; V152-L155 PolarHBondContact O-N 3.43Å; V152-I156 HydrophobicContact CG1-CD1 3.99Å; V152-I156 WeakPolarHBondContact O-CG1 3.04Å; V152-I156 PolarHBondContact O-N 2.67Å |
| 153 | M | 77.6 | Confident | 77 | Confident | 105 Ų | 105 | 89.6 Ų | 89.6 | 52% | 0.517 | 47% | 0.465 | S | S | . | . | H | α-helix | trans | -64 | -39.2 | 177.3 | -70.4 | -64.3 | -75.9 | 0 | 0 | 112.2 | C149 Q150 F151 I156 Q157 | C149-M153 WeakPolarHBondContact O-CB 3.47Å; C149-M153 WeakPolarHBondContact O-CG 3.48Å; C149-M153 PolarHBondContact O-N 3.02Å; Q150-M153 PolarHBondContact O-N 3.49Å; F151-M153 PolarHBondContact O-N 2.72Å; M153-I156 PolarHBondContact O-N 2.83Å; M153-I156 HydrophobicContact SD-CD1 4.42Å; M153-Q157 WeakPolarHBondContact O-CB 3.44Å; M153-Q157 WeakPolarHBondContact O-CG 3.33Å; M153-Q157 PolarHBondContact O-N 2.75Å |
| 154 | S | 82.5 | Confident | 76 | Confident | 52 Ų | 52 | 89.9 Ų | 89.9 | 36% | 0.364 | 47% | 0.469 | S | S | . | . | H | α-helix | trans | -63.4 | -40.9 | 174.7 | -177.1 | 0 | 0 | 0 | 0 | 112.1 | Q150 F151 V152 I156 Q157 N158 | Q150-S154 WeakPolarHBondContact O-CB 3.45Å; Q150-S154 PolarHBondContact O-N 3.33Å; F151-S154 WeakPolarHBondContact O-CB 3.15Å; F151-S154 PolarHBondContact O-N 3.01Å; V152-S154 VanDerWaalsContact C-N 3.35Å; V152-S154 PolarHBondContact O-N 3.44Å; S154-I156 VanDerWaalsContact C-N 3.34Å; S154-I156 PolarHBondContact O-N 3.45Å; S154-Q157 PolarHBondContact O-N 3.21Å; S154-N158 WeakPolarHBondContact O-CB 3.04Å; S154-N158 PolarHBondContact O-N 3.02Å; S154-N158 PolarHBondContact O-ND2 2.79Å; S154-N158 PolarHBondContact OG-ND2 3.18Å |
| 155 | L | 75.7 | Confident | 75.2 | Confident | 42 Ų | 42 | 91.9 Ų | 91.9 | 22% | 0.22 | 48% | 0.484 | C | S | . | . | H | α-helix | trans | -62.1 | -40.8 | 174.5 | -73.6 | 177.2 | 0 | 0 | 0 | 112.1 | F151 V152 V168 | F151-L155 HydrophobicContact CD1-CD1 3.99Å; F151-L155 HydrophobicContact CE1-CD1 3.48Å; F151-L155 VanDerWaalsContact CE1-CD1 3.48Å; F151-L155 HydrophobicContact CE1-CG 4.21Å; F151-L155 HydrophobicContact CZ-CD1 3.88Å; F151-L155 HydrophobicContact CZ-CD2 4.44Å; F151-L155 HydrophobicContact CZ-CG 4.25Å; F151-L155 WeakPolarHBondContact O-CG 3.24Å; F151-L155 PolarHBondContact O-N 3.24Å; V152-L155 PolarHBondContact O-N 3.43Å; L155-V168 HydrophobicContact CD1-CG2 4.46Å |
| 156 | I | 78.8 | Confident | 74.7 | Confident | 120 Ų | 120 | 93 Ų | 93 | 62% | 0.615 | 49% | 0.49 | S | S | * | . | H | α-helix | trans | -66.4 | -46 | 177.9 | -66.2 | 165.7 | 0 | 0 | 0 | 110.7 | V152 M153 S154 G159 | V152-I156 HydrophobicContact CG1-CD1 3.99Å; V152-I156 WeakPolarHBondContact O-CG1 3.04Å; V152-I156 PolarHBondContact O-N 2.67Å; M153-I156 PolarHBondContact O-N 2.83Å; M153-I156 HydrophobicContact SD-CD1 4.42Å; S154-I156 VanDerWaalsContact C-N 3.34Å; S154-I156 PolarHBondContact O-N 3.45Å; I156-G159 PolarHBondContact O-N 2.83Å |
| 157 | Q | 84.1 | Confident | 74 | Confident | 152 Ų | 152 | 90.5 Ų | 90.5 | 71% | 0.71 | 49% | 0.488 | S | S | * | . | H | α-helix | trans | -67.8 | -40 | -176.3 | -76.5 | -178.8 | -18.8 | 0 | 0 | 113.2 | M153 S154 G159 | M153-Q157 WeakPolarHBondContact O-CB 3.44Å; M153-Q157 WeakPolarHBondContact O-CG 3.33Å; M153-Q157 PolarHBondContact O-N 2.75Å; S154-Q157 PolarHBondContact O-N 3.21Å; Q157-G159 PolarHBondContact O-N 2.77Å |
| 158 | N | 82.4 | Confident | 73.4 | Confident | 104 Ų | 104 | 88.4 Ų | 88.4 | 56% | 0.556 | 48% | 0.48 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -76.5 | -0.7 | -175.4 | -70.2 | -45.3 | 0 | 0 | 0 | 113.5 | S154 H160 | S154-N158 WeakPolarHBondContact O-CB 3.04Å; S154-N158 PolarHBondContact O-N 3.02Å; S154-N158 PolarHBondContact O-ND2 2.79Å; S154-N158 PolarHBondContact OG-ND2 3.18Å; N158-H160 PolarHBondContact O-N 2.82Å |
| 159 | G | 76.7 | Confident | 73.1 | Confident | 63 Ų | 63 | 88.1 Ų | 88.1 | 65% | 0.649 | 48% | 0.477 | S | S | * | . | T | Hydrogen-bonded Turn | trans | 56.8 | 17.2 | 179 | 0 | 0 | 0 | 0 | 0 | 113.1 | I156 Q157 K161 | I156-G159 PolarHBondContact O-N 2.83Å; Q157-G159 PolarHBondContact O-N 2.77Å; G159-K161 PolarHBondContact O-N 3.25Å |
| 160 | H | 64.4 | Low | 73 | Confident | 130 Ų | 130 | 89.6 Ų | 89.6 | 60% | 0.602 | 48% | 0.48 | S | S | * | . | trans | -61.4 | 111.1 | 177.5 | -96.7 | -110.2 | 0 | 0 | 0 | 105.9 | N158 L162 | N158-H160 PolarHBondContact O-N 2.82Å; H160-L162 PolarHBondContact O-N 3.47Å | ||
| 161 | K | 62.4 | Low | 72.3 | Confident | 173 Ų | 173 | 85.8 Ų | 85.8 | 75% | 0.752 | 47% | 0.469 | S | S | * | . | trans | -52.5 | 117.2 | 164 | -72.7 | -179.7 | 178.8 | 174.6 | 0 | 104.7 | G159 T163 | G159-K161 PolarHBondContact O-N 3.25Å; K161-T163 HydrophobicContact CB-CG2 3.9Å; K161-T163 PolarHBondContact O-N 3.37Å; K161-T163 PolarHBondContact O-OG1 3.42Å | ||
| 162 | L | 62 | Low | 71.9 | Confident | 89 Ų | 89 | 84.8 Ų | 84.8 | 47% | 0.466 | 47% | 0.465 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -62.7 | 41.6 | 170.9 | -97.7 | 109 | 0 | 0 | 0 | 111 | R65 H160 N164 V168 | R65-L162 PolarHBondContact NH1-O 2.85Å; H160-L162 PolarHBondContact O-N 3.47Å; L162-N164 VanDerWaalsContact C-N 3.3Å; L162-V168 HydrophobicContact CD2-CG2 3.9Å; L162-V168 HydrophobicContact CG-CG2 4.37Å |
| 163 | T | 63.8 | Low | 71.8 | Confident | 77 Ų | 77 | 86.3 Ų | 86.3 | 47% | 0.472 | 47% | 0.471 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -75.4 | -24.6 | -174.2 | 33.8 | 0 | 0 | 0 | 0 | 112.1 | R65 K161 | R65-T163 PolarHBondContact NH2-O 3.12Å; K161-T163 HydrophobicContact CB-CG2 3.9Å; K161-T163 PolarHBondContact O-N 3.37Å; K161-T163 PolarHBondContact O-OG1 3.42Å |
| 164 | N | 65.1 | Low | 71.7 | Confident | 88 Ų | 88 | 88 Ų | 88 | 47% | 0.471 | 47% | 0.472 | S | S | . | . | trans | -108.1 | 100.5 | 175.1 | -60.5 | -19.9 | 0 | 0 | 0 | 108.6 | L162 L166 D167 | L162-N164 VanDerWaalsContact C-N 3.3Å; N164-L166 PolarHBondContact O-N 2.96Å; N164-D167 HydrophobicContact CB-CB 4.2Å; N164-D167 VanDerWaalsContact CB-OD2 3.24Å; N164-D167 WeakPolarHBondContact CB-OD2 3.17Å; N164-D167 PolarHBondContact ND2-OD2 3.32Å; N164-D167 PolarHBondContact O-N 2.83Å | ||
| 165 | V | 62.8 | Low | 71.1 | Confident | 66 Ų | 66 | 87.7 Ų | 87.7 | 40% | 0.4 | 47% | 0.466 | S | S | . | . | H | α-helix | trans | -56.6 | -30.6 | 169.6 | 174.2 | 0 | 0 | 0 | 0 | 110.3 | R65 V168 T169 | R65-V165 HydrophobicContact CG-CG2 4.48Å; V165-V168 PolarHBondContact O-N 3.44Å; V165-T169 HydrophobicContact CG1-CG2 4.28Å; V165-T169 PolarHBondContact O-N 2.86Å; V165-T169 PolarHBondContact O-OG1 3.44Å |
| 166 | L | 68.3 | Low | 70.7 | Confident | 125 Ų | 125 | 88.8 Ų | 88.8 | 65% | 0.654 | 47% | 0.471 | S | S | * | . | H | α-helix | trans | -60.6 | -42.3 | 177.6 | -69 | 168.5 | 0 | 0 | 0 | 113.3 | N164 V168 T169 D170 | N164-L166 PolarHBondContact O-N 2.96Å; L166-V168 VanDerWaalsContact C-N 3.27Å; L166-V168 PolarHBondContact O-N 2.92Å; L166-T169 VanDerWaalsContact CA-OG1 3.29Å; L166-T169 WeakPolarHBondContact CA-OG1 3.31Å; L166-T169 PolarHBondContact O-N 3.45Å; L166-T169 PolarHBondContact O-OG1 3.3Å; L166-D170 WeakPolarHBondContact O-CB 3.47Å; L166-D170 PolarHBondContact O-N 3.25Å |
| 167 | D | 68.6 | Low | 70.3 | Confident | 98 Ų | 98 | 86.6 Ų | 86.6 | 52% | 0.524 | 46% | 0.464 | S | S | . | . | H | α-helix | trans | -65.9 | -34 | -179.3 | -66 | -21.3 | 0 | 0 | 0 | 111.4 | N164 G171 | N164-D167 HydrophobicContact CB-CB 4.2Å; N164-D167 VanDerWaalsContact CB-OD2 3.24Å; N164-D167 WeakPolarHBondContact CB-OD2 3.17Å; N164-D167 PolarHBondContact ND2-OD2 3.32Å; N164-D167 PolarHBondContact O-N 2.83Å; D167-G171 PolarHBondContact O-N 3.1Å; D167-G171 VanDerWaalsContact O-N 3.11Å |
| 168 | V | 69.3 | Low | 69.7 | Low | 28 Ų | 28 | 84 Ų | 84 | 17% | 0.17 | 45% | 0.452 | C | S | . | . | H | α-helix | trans | -72.8 | -44.1 | 176 | 179.4 | 0 | 0 | 0 | 0 | 110.7 | F151 L155 L162 V165 L166 M172 | F151-V168 HydrophobicContact CE1-CG1 4.35Å; L155-V168 HydrophobicContact CD1-CG2 4.46Å; L162-V168 HydrophobicContact CD2-CG2 3.9Å; L162-V168 HydrophobicContact CG-CG2 4.37Å; V165-V168 PolarHBondContact O-N 3.44Å; L166-V168 VanDerWaalsContact C-N 3.27Å; L166-V168 PolarHBondContact O-N 2.92Å; V168-M172 HydrophobicContact CG1-CG 4.49Å; V168-M172 HydrophobicContact CG1-SD 3.92Å; V168-M172 WeakPolarHBondContact O-CB 3.43Å; V168-M172 VanDerWaalsContact O-CG 3.22Å; V168-M172 WeakPolarHBondContact O-CG 3.46Å; V168-M172 PolarHBondContact O-N 3Å |
| 169 | T | 71.5 | Confident | 68.9 | Low | 45 Ų | 45 | 81.1 Ų | 81.1 | 28% | 0.276 | 44% | 0.436 | S | S | . | . | H | α-helix | trans | -66.4 | -39 | 179 | 50.2 | 0 | 0 | 0 | 0 | 112.1 | V165 L166 M172 L173 | V165-T169 HydrophobicContact CG1-CG2 4.28Å; V165-T169 PolarHBondContact O-N 2.86Å; V165-T169 PolarHBondContact O-OG1 3.44Å; L166-T169 VanDerWaalsContact CA-OG1 3.29Å; L166-T169 WeakPolarHBondContact CA-OG1 3.31Å; L166-T169 PolarHBondContact O-N 3.45Å; L166-T169 PolarHBondContact O-OG1 3.3Å; T169-M172 PolarHBondContact O-N 3.36Å; T169-L173 VanDerWaalsContact O-CB 3.24Å; T169-L173 WeakPolarHBondContact O-CB 3.37Å; T169-L173 PolarHBondContact O-N 3.35Å |
| 170 | D | 75.2 | Confident | 68.1 | Low | 99 Ų | 99 | 84.6 Ų | 84.6 | 53% | 0.529 | 43% | 0.433 | S | S | . | . | H | α-helix | trans | -69.8 | -43.7 | 178.9 | -74.8 | -6.8 | 0 | 0 | 0 | 111.2 | L166 M172 L173 Y174 | L166-D170 WeakPolarHBondContact O-CB 3.47Å; L166-D170 PolarHBondContact O-N 3.25Å; D170-M172 VanDerWaalsContact C-N 3.3Å; D170-M172 PolarHBondContact O-N 3.47Å; D170-L173 PolarHBondContact O-N 3.24Å; D170-Y174 WeakPolarHBondContact O-CB 3.3Å; D170-Y174 PolarHBondContact O-N 3.34Å |
| 171 | G | 72.6 | Confident | 67.9 | Low | 24 Ų | 24 | 82.1 Ų | 82.1 | 25% | 0.247 | 43% | 0.425 | C | S | . | . | H | α-helix | trans | -60.4 | -39.4 | 174.2 | 0 | 0 | 0 | 0 | 0 | 112.6 | D167 M175 | D167-G171 PolarHBondContact O-N 3.1Å; D167-G171 VanDerWaalsContact O-N 3.11Å; G171-M175 WeakPolarHBondContact O-CG 3.25Å; G171-M175 PolarHBondContact O-N 2.81Å; G171-M175 VanDerWaalsContact O-N 3.07Å |
| 172 | M | 69.6 | Low | 67.9 | Low | 31 Ų | 31 | 79.6 Ų | 79.6 | 15% | 0.153 | 41% | 0.411 | C | S | . | . | H | α-helix | trans | -75.2 | -34.9 | 177.5 | -70 | -176.3 | 71.3 | 0 | 0 | 113.2 | F72 W76 F151 V168 T169 D170 Y174 M175 L176 | F72-M172 HydrophobicContact CE1-CE 3.57Å; F72-M172 HydrophobicContact CE1-SD 3.62Å; F72-M172 HydrophobicContact CZ-CE 4.28Å; F72-M172 HydrophobicContact CZ-SD 4.31Å; W76-M172 HydrophobicContact CD2-CE 4.38Å; W76-M172 HydrophobicContact CH2-CE 4.35Å; W76-M172 HydrophobicContact CZ2-CB 4.43Å; W76-M172 HydrophobicContact CZ2-CE 3.71Å; F151-M172 HydrophobicContact CE1-CG 3.97Å; F151-M172 HydrophobicContact CE1-SD 4.42Å; F151-M172 HydrophobicContact CZ-CG 4.44Å; V168-M172 HydrophobicContact CG1-CG 4.49Å; V168-M172 HydrophobicContact CG1-SD 3.92Å; V168-M172 WeakPolarHBondContact O-CB 3.43Å; V168-M172 VanDerWaalsContact O-CG 3.22Å; V168-M172 WeakPolarHBondContact O-CG 3.46Å; V168-M172 PolarHBondContact O-N 3Å; T169-M172 PolarHBondContact O-N 3.36Å; D170-M172 VanDerWaalsContact C-N 3.3Å; D170-M172 PolarHBondContact O-N 3.47Å; M172-Y174 VanDerWaalsContact C-N 3.33Å; M172-M175 PolarHBondContact O-N 3.18Å; M172-L176 PolarHBondContact O-N 2.9Å |
| 173 | L | 74 | Confident | 67.6 | Low | 102 Ų | 102 | 77.6 Ų | 77.6 | 53% | 0.534 | 40% | 0.401 | S | S | . | . | H | α-helix | trans | -67 | -37.7 | 173.6 | -174 | 67.2 | 0 | 0 | 0 | 111.2 | T169 D170 L176 T177 | T169-L173 VanDerWaalsContact O-CB 3.24Å; T169-L173 WeakPolarHBondContact O-CB 3.37Å; T169-L173 PolarHBondContact O-N 3.35Å; D170-L173 PolarHBondContact O-N 3.24Å; L173-L176 PolarHBondContact O-N 3.49Å; L173-T177 WeakPolarHBondContact O-CB 3.31Å; L173-T177 PolarHBondContact O-N 3.36Å; L173-T177 PolarHBondContact O-OG1 2.86Å |
| 174 | Y | 75.8 | Confident | 67.2 | Low | 141 Ų | 141 | 77.3 Ų | 77.3 | 55% | 0.553 | 40% | 0.401 | S | S | * | . | H | α-helix | trans | -60 | -49.1 | 171.9 | -175.7 | -91.3 | 0 | 0 | 0 | 110.8 | D170 M172 L176 T177 E178 | D170-Y174 WeakPolarHBondContact O-CB 3.3Å; D170-Y174 PolarHBondContact O-N 3.34Å; M172-Y174 VanDerWaalsContact C-N 3.33Å; Y174-L176 VanDerWaalsContact C-N 3.35Å; Y174-L176 PolarHBondContact O-N 3.39Å; Y174-T177 PolarHBondContact O-N 3.46Å; Y174-T177 VanDerWaalsContact O-N 3.13Å; Y174-E178 HydrophobicContact CD1-CG 4.31Å; Y174-E178 HydrophobicContact CE1-CG 3.77Å; Y174-E178 VanDerWaalsContact CE1-OE1 3.3Å; Y174-E178 WeakPolarHBondContact CE1-OE1 3.06Å; Y174-E178 WeakPolarHBondContact CE1-OE2 3.35Å; Y174-E178 PolarHBondContact O-N 3.39Å; Y174-E178 PolarHBondContact OH-OE1 3.32Å |
| 175 | M | 69.5 | Low | 66.6 | Low | 45 Ų | 45 | 79 Ų | 79 | 22% | 0.222 | 41% | 0.41 | C | S | . | . | H | α-helix | trans | -59 | -42.7 | 175.5 | -65.3 | -113.5 | -62.1 | 0 | 0 | 112.2 | H147 F151 G171 M172 T177 E178 D179 | H147-M175 HydrophobicContact CB-CE 3.89Å; F151-M175 HydrophobicContact CB-CE 4.45Å; G171-M175 WeakPolarHBondContact O-CG 3.25Å; G171-M175 PolarHBondContact O-N 2.81Å; G171-M175 VanDerWaalsContact O-N 3.07Å; M172-M175 PolarHBondContact O-N 3.18Å; M175-T177 VanDerWaalsContact C-N 3.3Å; M175-T177 PolarHBondContact O-N 3.28Å; M175-E178 PolarHBondContact O-N 3.31Å; M175-D179 VanDerWaalsContact O-CB 3.28Å; M175-D179 WeakPolarHBondContact O-CB 3.33Å; M175-D179 PolarHBondContact O-N 3.45Å |
| 176 | L | 67.3 | Low | 66.2 | Low | 65 Ų | 65 | 77.1 Ų | 77.1 | 34% | 0.34 | 40% | 0.401 | S | S | . | . | H | α-helix | trans | -60.2 | -40.7 | 175.1 | -85.8 | 163.4 | 0 | 0 | 0 | 113 | W76 M172 L173 Y174 F180 | W76-L176 HydrophobicContact CH2-CD1 3.51Å; W76-L176 HydrophobicContact CH2-CD2 3.49Å; W76-L176 VanDerWaalsContact CH2-CD2 3.49Å; W76-L176 HydrophobicContact CH2-CG 3.36Å; W76-L176 HydrophobicContact CZ2-CD1 3.38Å; W76-L176 HydrophobicContact CZ2-CD2 4.23Å; W76-L176 HydrophobicContact CZ2-CG 3.8Å; W76-L176 HydrophobicContact CZ3-CD2 3.91Å; W76-L176 HydrophobicContact CZ3-CG 4.27Å; M172-L176 PolarHBondContact O-N 2.9Å; L173-L176 PolarHBondContact O-N 3.49Å; Y174-L176 VanDerWaalsContact C-N 3.35Å; Y174-L176 PolarHBondContact O-N 3.39Å; L176-F180 VanDerWaalsContact O-CB 3.28Å; L176-F180 WeakPolarHBondContact O-CB 3.31Å; L176-F180 PolarHBondContact O-N 3.35Å |
| 177 | T | 71.1 | Confident | 65.9 | Low | 74 Ų | 74 | 71.9 Ų | 71.9 | 45% | 0.454 | 38% | 0.376 | S | S | . | . | H | α-helix | trans | -73.2 | -40.6 | -176.9 | -54 | 0 | 0 | 0 | 0 | 110.3 | L173 Y174 M175 N181 | L173-T177 WeakPolarHBondContact O-CB 3.31Å; L173-T177 PolarHBondContact O-N 3.36Å; L173-T177 PolarHBondContact O-OG1 2.86Å; Y174-T177 PolarHBondContact O-N 3.46Å; Y174-T177 VanDerWaalsContact O-N 3.13Å; M175-T177 VanDerWaalsContact C-N 3.3Å; M175-T177 PolarHBondContact O-N 3.28Å; T177-N181 WeakPolarHBondContact O-CB 3.28Å; T177-N181 VanDerWaalsContact O-CG 3.31Å; T177-N181 PolarHBondContact O-N 3.12Å; T177-N181 PolarHBondContact O-ND2 3.32Å |
| 178 | E | 71.5 | Confident | 65.5 | Low | 98 Ų | 98 | 69.6 Ų | 69.6 | 46% | 0.458 | 36% | 0.363 | S | S | . | . | H | α-helix | trans | -64.2 | -45.7 | 171.5 | -80.6 | -161.4 | 157 | 0 | 0 | 111.7 | Y174 M175 F180 N181 Y182 | Y174-E178 HydrophobicContact CD1-CG 4.31Å; Y174-E178 HydrophobicContact CE1-CG 3.77Å; Y174-E178 VanDerWaalsContact CE1-OE1 3.3Å; Y174-E178 WeakPolarHBondContact CE1-OE1 3.06Å; Y174-E178 WeakPolarHBondContact CE1-OE2 3.35Å; Y174-E178 PolarHBondContact O-N 3.39Å; Y174-E178 PolarHBondContact OH-OE1 3.32Å; M175-E178 PolarHBondContact O-N 3.31Å; E178-F180 PolarHBondContact O-N 2.96Å; E178-N181 CarbonylContact O-C 3.53Å; E178-N181 PolarHBondContact O-N 3.37Å; E178-Y182 VanDerWaalsContact O-CB 3.31Å; E178-Y182 WeakPolarHBondContact O-CB 3.42Å; E178-Y182 PolarHBondContact O-N 3.32Å |
| 179 | D | 65.1 | Low | 65.1 | Low | 43 Ų | 43 | 74 Ų | 74 | 23% | 0.23 | 38% | 0.377 | C | S | . | . | H | α-helix | trans | -59.7 | -45.8 | 177 | -76.9 | -9.8 | 0 | 0 | 0 | 111.1 | M175 N181 Y182 L183 | M175-D179 VanDerWaalsContact O-CB 3.28Å; M175-D179 WeakPolarHBondContact O-CB 3.33Å; M175-D179 PolarHBondContact O-N 3.45Å; D179-N181 VanDerWaalsContact C-N 3.33Å; D179-N181 PolarHBondContact O-N 3.49Å; D179-Y182 PolarHBondContact O-N 3.2Å; D179-L183 VanDerWaalsContact O-CB 3.25Å; D179-L183 WeakPolarHBondContact O-CB 3.41Å; D179-L183 WeakPolarHBondContact O-CD1 3.42Å; D179-L183 PolarHBondContact O-N 2.93Å |
| 180 | F | 60.2 | Low | 64.7 | Low | 135 Ų | 135 | 77.6 Ų | 77.6 | 59% | 0.592 | 39% | 0.39 | S | S | * | . | H | α-helix | trans | -62.3 | -42.7 | 177.4 | -171.6 | -95.3 | 0 | 0 | 0 | 111.1 | L176 E178 Y182 C184 | L176-F180 VanDerWaalsContact O-CB 3.28Å; L176-F180 WeakPolarHBondContact O-CB 3.31Å; L176-F180 PolarHBondContact O-N 3.35Å; E178-F180 PolarHBondContact O-N 2.96Å; F180-Y182 VanDerWaalsContact C-N 3.34Å; F180-C184 HydrophobicContact CE1-CB 4.48Å; F180-C184 VanDerWaalsContact CZ-SG 3.54Å; F180-C184 WeakPolarHBondContact O-CB 3.41Å; F180-C184 PolarHBondContact O-N 3.03Å; F180-C184 PolarHBondContact O-SG 3.04Å; F180-C184 VanDerWaalsContact O-SG 3.42Å |
| 181 | N | 59.6 | Low | 63.9 | Low | 78 Ų | 78 | 75 Ų | 75 | 42% | 0.417 | 38% | 0.383 | S | S | . | . | H | α-helix | trans | -65.5 | -36.7 | 174.1 | -76.8 | -43.3 | 0 | 0 | 0 | 112.1 | T177 E178 D179 N185 | T177-N181 WeakPolarHBondContact O-CB 3.28Å; T177-N181 VanDerWaalsContact O-CG 3.31Å; T177-N181 PolarHBondContact O-N 3.12Å; T177-N181 PolarHBondContact O-ND2 3.32Å; E178-N181 CarbonylContact O-C 3.53Å; E178-N181 PolarHBondContact O-N 3.37Å; D179-N181 VanDerWaalsContact C-N 3.33Å; D179-N181 PolarHBondContact O-N 3.49Å; N181-N185 WeakPolarHBondContact O-CA 3.06Å; N181-N185 WeakPolarHBondContact O-CB 3Å; N181-N185 PolarHBondContact O-N 3.47Å; N181-N185 PolarHBondContact OD1-ND2 3.2Å |
| 182 | Y | 62.5 | Low | 63.3 | Low | 120 Ų | 120 | 75.9 Ų | 75.9 | 47% | 0.471 | 38% | 0.382 | S | S | . | . | H | α-helix | trans | -70.3 | -41.5 | 179 | -167.3 | -102.3 | 0 | 0 | 0 | 111.8 | E178 D179 F180 S187 | E178-Y182 VanDerWaalsContact O-CB 3.31Å; E178-Y182 WeakPolarHBondContact O-CB 3.42Å; E178-Y182 PolarHBondContact O-N 3.32Å; D179-Y182 PolarHBondContact O-N 3.2Å; F180-Y182 VanDerWaalsContact C-N 3.34Å; Y182-S187 WeakPolarHBondContact CD1-OG 3.42Å; Y182-S187 WeakPolarHBondContact O-CB 3.35Å; Y182-S187 PolarHBondContact O-N 3.42Å; Y182-S187 PolarHBondContact O-OG 2.87Å |
| 183 | L | 57.1 | Low | 62.9 | Low | 48 Ų | 48 | 77.7 Ų | 77.7 | 25% | 0.251 | 39% | 0.392 | S | S | . | . | I | π-helix | trans | -65.7 | -46.1 | 174.1 | -87.8 | 148.7 | 0 | 0 | 0 | 111.6 | F136 T140 D179 | F136-L183 HydrophobicContact CE1-CD2 4.05Å; F136-L183 HydrophobicContact CZ-CD2 3.94Å; T140-L183 HydrophobicContact CG2-CD2 3.92Å; D179-L183 VanDerWaalsContact O-CB 3.25Å; D179-L183 WeakPolarHBondContact O-CB 3.41Å; D179-L183 WeakPolarHBondContact O-CD1 3.42Å; D179-L183 PolarHBondContact O-N 2.93Å |
| 184 | C | 54.7 | Low | 62.2 | Low | 71 Ų | 71 | 76.8 Ų | 76.8 | 48% | 0.48 | 40% | 0.399 | S | S | . | . | I | π-helix | trans | -82.6 | -36.4 | -174.8 | -72.6 | 0 | 0 | 0 | 0 | 114 | F180 | F180-C184 HydrophobicContact CE1-CB 4.48Å; F180-C184 VanDerWaalsContact CZ-SG 3.54Å; F180-C184 WeakPolarHBondContact O-CB 3.41Å; F180-C184 PolarHBondContact O-N 3.03Å; F180-C184 PolarHBondContact O-SG 3.04Å; F180-C184 VanDerWaalsContact O-SG 3.42Å |
| 185 | N | 51.8 | Low | 61.4 | Low | 122 Ų | 122 | 72 Ų | 72 | 65% | 0.652 | 39% | 0.386 | S | S | * | . | I | π-helix | trans | -105.1 | -14.3 | -165 | -62.7 | -34.9 | 0 | 0 | 0 | 115.4 | N181 | N181-N185 WeakPolarHBondContact O-CA 3.06Å; N181-N185 WeakPolarHBondContact O-CB 3Å; N181-N185 PolarHBondContact O-N 3.47Å; N181-N185 PolarHBondContact OD1-ND2 3.2Å |
| 186 | A | 55.2 | Low | 61.3 | Low | 27 Ų | 27 | 75.9 Ų | 75.9 | 22% | 0.223 | 40% | 0.404 | C | S | . | . | I | π-helix | trans | -145.6 | -56.9 | -176.1 | 0 | 0 | 0 | 0 | 0 | 114.1 | Q190 | A186-Q190 WeakPolarHBondContact O-CA 3.23Å; A186-Q190 WeakPolarHBondContact O-CB 3.23Å; A186-Q190 WeakPolarHBondContact O-CG 3.38Å; A186-Q190 PolarHBondContact O-N 2.7Å; A186-Q190 PolarHBondContact O-OE1 3.2Å |
| 187 | S | 62.6 | Low | 60.9 | Low | 16 Ų | 16 | 73 Ų | 73 | 11% | 0.112 | 39% | 0.389 | C | S | . | . | I | π-helix | trans | -71.7 | -44.5 | -159.1 | 61.7 | 0 | 0 | 0 | 0 | 114.7 | Y182 A191 | Y182-S187 WeakPolarHBondContact CD1-OG 3.42Å; Y182-S187 WeakPolarHBondContact O-CB 3.35Å; Y182-S187 PolarHBondContact O-N 3.42Å; Y182-S187 PolarHBondContact O-OG 2.87Å; S187-A191 WeakPolarHBondContact O-CA 3.29Å; S187-A191 WeakPolarHBondContact O-CB 3.49Å; S187-A191 PolarHBondContact O-N 2.7Å |
| 188 | L | 60.4 | Low | 60.2 | Low | 50 Ų | 50 | 70.9 Ų | 70.9 | 26% | 0.262 | 38% | 0.375 | S | S | . | . | H | α-helix | trans | -69.1 | -48.8 | -179.5 | -179.7 | 54 | 0 | 0 | 0 | 111.3 | F136 Q190 A191 I192 | F136-L188 HydrophobicContact CD1-CD1 3.61Å; F136-L188 HydrophobicContact CD1-CD2 4.43Å; F136-L188 HydrophobicContact CD1-CG 4.5Å; F136-L188 HydrophobicContact CD2-CD1 3.65Å; F136-L188 HydrophobicContact CE1-CB 4.07Å; F136-L188 HydrophobicContact CE1-CD1 3.62Å; F136-L188 HydrophobicContact CE1-CD2 3.89Å; F136-L188 HydrophobicContact CE1-CG 4.05Å; F136-L188 HydrophobicContact CE2-CB 3.82Å; F136-L188 HydrophobicContact CE2-CD1 3.66Å; F136-L188 HydrophobicContact CE2-CG 4.28Å; F136-L188 HydrophobicContact CG-CD1 3.63Å; F136-L188 HydrophobicContact CZ-CB 3.48Å; F136-L188 VanDerWaalsContact CZ-CB 3.48Å; F136-L188 HydrophobicContact CZ-CD1 3.65Å; F136-L188 HydrophobicContact CZ-CD2 4.19Å; F136-L188 HydrophobicContact CZ-CG 3.94Å; L188-Q190 VanDerWaalsContact C-N 3.35Å; L188-A191 PolarHBondContact O-N 2.97Å; L188-I192 HydrophobicContact CD1-CD1 3.66Å; L188-I192 HydrophobicContact CD1-CG1 3.91Å; L188-I192 HydrophobicContact CD2-CD1 4.49Å; L188-I192 HydrophobicContact CG-CD1 3.76Å; L188-I192 HydrophobicContact CG-CG1 4.39Å; L188-I192 WeakPolarHBondContact O-CB 3.36Å; L188-I192 VanDerWaalsContact O-CG1 3.23Å; L188-I192 WeakPolarHBondContact O-CG1 3.35Å; L188-I192 PolarHBondContact O-N 2.86Å |
| 189 | W | 60.2 | Low | 59.6 | Low | 119 Ų | 119 | 71.7 Ų | 71.7 | 45% | 0.451 | 38% | 0.375 | S | S | . | . | H | α-helix | trans | -67 | -38.2 | -179.8 | -172 | -113.7 | 0 | 0 | 0 | 111.5 | N193 | W189-N193 VanDerWaalsContact CD1-ND2 3.28Å; W189-N193 PolarHBondContact NE1-ND2 3.48Å; W189-N193 VanDerWaalsContact O-CB 3.23Å; W189-N193 WeakPolarHBondContact O-CB 3.29Å; W189-N193 PolarHBondContact O-N 3.04Å; W189-N193 PolarHBondContact O-ND2 2.79Å |
| 190 | Q | 63.3 | Low | 59.3 | Low | 121 Ų | 121 | 73.2 Ų | 73.2 | 57% | 0.565 | 38% | 0.38 | S | S | * | . | H | α-helix | trans | -67.2 | -38.2 | 171.1 | -72.5 | 173.3 | -17.2 | 0 | 0 | 111.6 | A186 L188 N193 A194 | A186-Q190 WeakPolarHBondContact O-CA 3.23Å; A186-Q190 WeakPolarHBondContact O-CB 3.23Å; A186-Q190 WeakPolarHBondContact O-CG 3.38Å; A186-Q190 PolarHBondContact O-N 2.7Å; A186-Q190 PolarHBondContact O-OE1 3.2Å; L188-Q190 VanDerWaalsContact C-N 3.35Å; Q190-N193 PolarHBondContact O-N 3.28Å; Q190-A194 WeakPolarHBondContact O-CA 3.45Å; Q190-A194 WeakPolarHBondContact O-CB 3.18Å; Q190-A194 PolarHBondContact O-N 3.42Å |
| 191 | A | 58.2 | Low | 59.2 | Low | 46 Ų | 46 | 70.2 Ų | 70.2 | 38% | 0.38 | 37% | 0.37 | S | S | . | . | H | α-helix | trans | -67 | -42.3 | 176.4 | 0 | 0 | 0 | 0 | 0 | 111.5 | S187 L188 A194 S195 | S187-A191 WeakPolarHBondContact O-CA 3.29Å; S187-A191 WeakPolarHBondContact O-CB 3.49Å; S187-A191 PolarHBondContact O-N 2.7Å; L188-A191 PolarHBondContact O-N 2.97Å; A191-A194 PolarHBondContact O-N 3.13Å; A191-S195 VanDerWaalsContact O-CB 3.24Å; A191-S195 WeakPolarHBondContact O-CB 3.49Å; A191-S195 PolarHBondContact O-N 3.39Å; A191-S195 PolarHBondContact O-OG 3.4Å |
| 192 | I | 59.3 | Low | 59.2 | Low | 42 Ų | 42 | 68.4 Ų | 68.4 | 22% | 0.215 | 36% | 0.36 | C | S | . | . | H | α-helix | trans | -64.2 | -41.9 | 175 | -70 | 171.1 | 0 | 0 | 0 | 110.3 | L188 S195 L197 T198 | L188-I192 HydrophobicContact CD1-CD1 3.66Å; L188-I192 HydrophobicContact CD1-CG1 3.91Å; L188-I192 HydrophobicContact CD2-CD1 4.49Å; L188-I192 HydrophobicContact CG-CD1 3.76Å; L188-I192 HydrophobicContact CG-CG1 4.39Å; L188-I192 WeakPolarHBondContact O-CB 3.36Å; L188-I192 VanDerWaalsContact O-CG1 3.23Å; L188-I192 WeakPolarHBondContact O-CG1 3.35Å; L188-I192 PolarHBondContact O-N 2.86Å; I192-S195 WeakPolarHBondContact CA-OG 3.28Å; I192-S195 PolarHBondContact O-OG 3.31Å; I192-L197 HydrophobicContact CG2-CB 4.2Å; I192-L197 HydrophobicContact CG2-CD2 4.35Å; I192-L197 WeakPolarHBondContact O-CB 3.4Å; I192-L197 PolarHBondContact O-N 2.94Å; I192-T198 WeakPolarHBondContact CG2-OG1 3.17Å |
| 193 | N | 62 | Low | 59.1 | Low | 69 Ų | 69 | 69.5 Ų | 69.5 | 37% | 0.369 | 36% | 0.363 | S | S | . | . | H | α-helix | trans | -73.3 | -36.7 | 177.4 | -72.6 | -24.1 | 0 | 0 | 0 | 112.7 | W189 Q190 E196 T198 | W189-N193 VanDerWaalsContact CD1-ND2 3.28Å; W189-N193 PolarHBondContact NE1-ND2 3.48Å; W189-N193 VanDerWaalsContact O-CB 3.23Å; W189-N193 WeakPolarHBondContact O-CB 3.29Å; W189-N193 PolarHBondContact O-N 3.04Å; W189-N193 PolarHBondContact O-ND2 2.79Å; Q190-N193 PolarHBondContact O-N 3.28Å; N193-E196 PolarHBondContact O-N 3.32Å; N193-T198 PolarHBondContact OD1-OG1 3.35Å |
| 194 | A | 58.8 | Low | 59 | Low | 82 Ų | 82 | 69.2 Ų | 69.2 | 68% | 0.678 | 36% | 0.362 | S | S | * | . | H | α-helix | trans | -75.3 | -29.5 | 179.6 | 0 | 0 | 0 | 0 | 0 | 112.4 | Q190 A191 E196 | Q190-A194 WeakPolarHBondContact O-CA 3.45Å; Q190-A194 WeakPolarHBondContact O-CB 3.18Å; Q190-A194 PolarHBondContact O-N 3.42Å; A191-A194 PolarHBondContact O-N 3.13Å; A194-E196 PolarHBondContact O-N 3.42Å |
| 195 | S | 60.1 | Low | 59.3 | Low | 41 Ų | 41 | 68.4 Ų | 68.4 | 29% | 0.287 | 36% | 0.361 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -74 | 5.9 | 169.2 | 53.7 | 0 | 0 | 0 | 0 | 113 | A191 I192 L197 | A191-S195 VanDerWaalsContact O-CB 3.24Å; A191-S195 WeakPolarHBondContact O-CB 3.49Å; A191-S195 PolarHBondContact O-N 3.39Å; A191-S195 PolarHBondContact O-OG 3.4Å; I192-S195 WeakPolarHBondContact CA-OG 3.28Å; I192-S195 PolarHBondContact O-OG 3.31Å; S195-L197 PolarHBondContact O-N 2.96Å; S195-L197 WeakPolarHBondContact OG-CB 3.47Å |
| 196 | E | 66 | Low | 59.6 | Low | 126 Ų | 126 | 66.6 Ų | 66.6 | 59% | 0.589 | 35% | 0.348 | S | S | * | . | T | Hydrogen-bonded Turn | trans | 52.9 | 15.3 | -171.7 | -58.1 | -167.9 | 163.8 | 0 | 0 | 113 | N193 A194 T198 Y199 F200 | N193-E196 PolarHBondContact O-N 3.32Å; A194-E196 PolarHBondContact O-N 3.42Å; E196-T198 VanDerWaalsContact C-N 3.31Å; E196-T198 PolarHBondContact O-N 3.01Å; E196-Y199 CarbonylContact O-C 3.29Å; E196-Y199 WeakPolarHBondContact O-CA 3.28Å; E196-Y199 WeakPolarHBondContact O-CB 2.99Å; E196-Y199 PolarHBondContact O-N 3.44Å; E196-F200 VanDerWaalsContact O-CB 3.28Å; E196-F200 WeakPolarHBondContact O-CB 3.27Å; E196-F200 PolarHBondContact O-N 2.95Å |
| 197 | L | 58.8 | Low | 59.2 | Low | 6 Ų | 6 | 69.3 Ų | 69.3 | 3% | 0.031 | 36% | 0.363 | C | S | . | . | H | α-helix | trans | -65 | -38 | -171 | -169.8 | 69 | 0 | 0 | 0 | 111 | V129 C132 I192 S195 L201 | V129-L197 HydrophobicContact CB-CD2 4.41Å; V129-L197 HydrophobicContact CG1-CD2 4.34Å; V129-L197 HydrophobicContact CG2-CD1 3.74Å; V129-L197 HydrophobicContact CG2-CD2 4Å; V129-L197 HydrophobicContact CG2-CG 4.01Å; C132-L197 HydrophobicContact CB-CD2 4.5Å; I192-L197 HydrophobicContact CG2-CB 4.2Å; I192-L197 HydrophobicContact CG2-CD2 4.35Å; I192-L197 WeakPolarHBondContact O-CB 3.4Å; I192-L197 PolarHBondContact O-N 2.94Å; S195-L197 PolarHBondContact O-N 2.96Å; S195-L197 WeakPolarHBondContact OG-CB 3.47Å; L197-L201 HydrophobicContact CG-CD1 4.35Å; L197-L201 VanDerWaalsContact O-CB 3.26Å; L197-L201 WeakPolarHBondContact O-CB 3.44Å; L197-L201 WeakPolarHBondContact O-CG 3.48Å; L197-L201 PolarHBondContact O-N 2.99Å |
| 198 | T | 56.7 | Low | 58.5 | Low | 28 Ų | 28 | 72.4 Ų | 72.4 | 17% | 0.172 | 40% | 0.398 | C | S | . | . | H | α-helix | trans | -62 | -45.5 | 171.6 | -50.8 | 0 | 0 | 0 | 0 | 111.3 | I192 N193 E196 L201 L202 | I192-T198 WeakPolarHBondContact CG2-OG1 3.17Å; N193-T198 PolarHBondContact OD1-OG1 3.35Å; E196-T198 VanDerWaalsContact C-N 3.31Å; E196-T198 PolarHBondContact O-N 3.01Å; T198-L201 PolarHBondContact O-N 3.3Å; T198-L202 HydrophobicContact CG2-CD1 4.01Å; T198-L202 VanDerWaalsContact O-CB 3.32Å; T198-L202 WeakPolarHBondContact O-CB 3.41Å; T198-L202 VanDerWaalsContact O-CG 3.22Å; T198-L202 WeakPolarHBondContact O-CG 3.44Å; T198-L202 PolarHBondContact O-N 3.42Å |
| 199 | Y | 58.1 | Low | 58.2 | Low | 115 Ų | 115 | 80.5 Ų | 80.5 | 45% | 0.451 | 43% | 0.425 | S | S | . | . | H | α-helix | trans | -65.1 | -44.2 | 179.6 | 176.9 | -101.9 | 0 | 0 | 0 | 111.1 | E196 L202 R203 | E196-Y199 CarbonylContact O-C 3.29Å; E196-Y199 WeakPolarHBondContact O-CA 3.28Å; E196-Y199 WeakPolarHBondContact O-CB 2.99Å; E196-Y199 PolarHBondContact O-N 3.44Å; Y199-L202 PolarHBondContact O-N 3.13Å; Y199-R203 WeakPolarHBondContact O-CB 3.16Å; Y199-R203 PolarHBondContact O-N 3.46Å |
| 200 | F | 58.8 | Low | 57.5 | Low | 75 Ų | 75 | 77.9 Ų | 77.9 | 33% | 0.329 | 42% | 0.415 | S | S | . | . | H | α-helix | trans | -62.5 | -47.6 | 176.5 | 178 | -93.1 | 0 | 0 | 0 | 111.4 | G125 E196 L202 R203 N204 | G125-F200 VanDerWaalsContact CA-CE1 3.45Å; E196-F200 VanDerWaalsContact O-CB 3.28Å; E196-F200 WeakPolarHBondContact O-CB 3.27Å; E196-F200 PolarHBondContact O-N 2.95Å; F200-L202 VanDerWaalsContact C-N 3.34Å; F200-L202 PolarHBondContact O-N 3.06Å; F200-R203 PolarHBondContact O-N 3.45Å; F200-N204 WeakPolarHBondContact CD1-ND2 3.22Å; F200-N204 WeakPolarHBondContact CD2-ND2 3.32Å; F200-N204 WeakPolarHBondContact CE1-ND2 3.2Å; F200-N204 WeakPolarHBondContact CE2-ND2 3.25Å; F200-N204 WeakPolarHBondContact CZ-ND2 3.39Å; F200-N204 WeakPolarHBondContact O-CB 3.1Å; F200-N204 PolarHBondContact O-N 3.38Å; F200-N204 PolarHBondContact O-ND2 2.95Å; F200-N204 VanDerWaalsContact O-ND2 3.09Å |
| 201 | L | 58.4 | Low | 56.5 | Low | 72 Ų | 72 | 77.9 Ų | 77.9 | 38% | 0.377 | 43% | 0.427 | S | S | . | . | H | α-helix | trans | -61.3 | -41.2 | 175.2 | -75.6 | 174.2 | 0 | 0 | 0 | 112.2 | V129 L197 T198 A205 | V129-L201 HydrophobicContact CG2-CD1 3.8Å; V129-L201 HydrophobicContact CG2-CD2 3.78Å; V129-L201 HydrophobicContact CG2-CG 4.06Å; L197-L201 HydrophobicContact CG-CD1 4.35Å; L197-L201 VanDerWaalsContact O-CB 3.26Å; L197-L201 WeakPolarHBondContact O-CB 3.44Å; L197-L201 WeakPolarHBondContact O-CG 3.48Å; L197-L201 PolarHBondContact O-N 2.99Å; T198-L201 PolarHBondContact O-N 3.3Å; L201-A205 WeakPolarHBondContact O-CB 3.4Å; L201-A205 PolarHBondContact O-N 2.86Å |
| 202 | L | 61 | Low | 55.8 | Low | 41 Ų | 41 | 81.3 Ų | 81.3 | 22% | 0.215 | 45% | 0.449 | C | S | . | . | H | α-helix | trans | -69 | -40.6 | 177.3 | -75.3 | 173.4 | 0 | 0 | 0 | 112.7 | T198 Y199 F200 N204 A205 H206 I219 | T198-L202 HydrophobicContact CG2-CD1 4.01Å; T198-L202 VanDerWaalsContact O-CB 3.32Å; T198-L202 WeakPolarHBondContact O-CB 3.41Å; T198-L202 VanDerWaalsContact O-CG 3.22Å; T198-L202 WeakPolarHBondContact O-CG 3.44Å; T198-L202 PolarHBondContact O-N 3.42Å; Y199-L202 PolarHBondContact O-N 3.13Å; F200-L202 VanDerWaalsContact C-N 3.34Å; F200-L202 PolarHBondContact O-N 3.06Å; L202-N204 VanDerWaalsContact C-N 3.3Å; L202-N204 PolarHBondContact O-N 3.23Å; L202-A205 PolarHBondContact O-N 3.35Å; L202-H206 PolarHBondContact O-N 2.93Å; L202-I219 HydrophobicContact CD1-CG2 3.75Å; L202-I219 HydrophobicContact CD2-CG2 3.24Å; L202-I219 HydrophobicContact CG-CG2 4.12Å |
| 203 | R | 59.1 | Low | 55.3 | Low | 143 Ų | 143 | 88.8 Ų | 88.8 | 54% | 0.54 | 48% | 0.482 | S | S | . | . | H | α-helix | trans | -64.1 | -38.6 | 176.9 | -171.3 | 176.9 | -176.2 | -169.2 | 0.6 | 111.2 | Y199 F200 H206 | Y199-R203 WeakPolarHBondContact O-CB 3.16Å; Y199-R203 PolarHBondContact O-N 3.46Å; F200-R203 PolarHBondContact O-N 3.45Å; R203-H206 CarbonylContact O-C 3.53Å; R203-H206 VanDerWaalsContact O-C 3.29Å |
| 204 | N | 56.5 | Low | 55.2 | Low | 41 Ų | 41 | 93.9 Ų | 93.9 | 22% | 0.219 | 50% | 0.504 | C | S | . | . | H | α-helix | trans | -81.7 | -29.5 | 179.6 | -79 | -32 | 0 | 0 | 0 | 113.8 | N122 F200 L202 H206 P207 | N122-N204 PolarHBondContact ND2-O 3.47Å; N122-N204 VanDerWaalsContact OD1-CB 3.24Å; N122-N204 WeakPolarHBondContact OD1-CB 3.26Å; N122-N204 PolarHBondContact OD1-O 3.35Å; F200-N204 WeakPolarHBondContact CD1-ND2 3.22Å; F200-N204 WeakPolarHBondContact CD2-ND2 3.32Å; F200-N204 WeakPolarHBondContact CE1-ND2 3.2Å; F200-N204 WeakPolarHBondContact CE2-ND2 3.25Å; F200-N204 WeakPolarHBondContact CZ-ND2 3.39Å; F200-N204 WeakPolarHBondContact O-CB 3.1Å; F200-N204 PolarHBondContact O-N 3.38Å; F200-N204 PolarHBondContact O-ND2 2.95Å; F200-N204 VanDerWaalsContact O-ND2 3.09Å; L202-N204 VanDerWaalsContact C-N 3.3Å; L202-N204 PolarHBondContact O-N 3.23Å; N204-H206 PolarHBondContact O-N 2.92Å; N204-P207 WeakPolarHBondContact O-CD 3.19Å |
| 205 | A | 59.2 | Low | 55.2 | Low | 55 Ų | 55 | 95.4 Ų | 95.4 | 46% | 0.455 | 50% | 0.504 | S | S | . | . | H | α-helix | trans | -67.1 | -22.6 | 170.9 | 0 | 0 | 0 | 0 | 0 | 112.6 | L201 L202 | L201-A205 WeakPolarHBondContact O-CB 3.4Å; L201-A205 PolarHBondContact O-N 2.86Å; L202-A205 PolarHBondContact O-N 3.35Å |
| 206 | H | 57.9 | Low | 56 | Low | 84 Ų | 84 | 96.7 Ų | 96.7 | 39% | 0.389 | 51% | 0.508 | S | S | . | . | S | Bend | trans | -136.1 | 70 | -177.9 | -70 | -65.5 | 0 | 0 | 0 | 111.8 | L202 R203 N204 G208 R209 Y210 | L202-H206 PolarHBondContact O-N 2.93Å; R203-H206 CarbonylContact O-C 3.53Å; R203-H206 VanDerWaalsContact O-C 3.29Å; N204-H206 PolarHBondContact O-N 2.92Å; H206-G208 PolarHBondContact O-N 3.31Å; H206-R209 PolarHBondContact O-N 3.44Å; H206-Y210 HydrophobicContact CB-CD2 3.87Å; H206-Y210 HydrophobicContact CB-CE2 3.46Å; H206-Y210 VanDerWaalsContact CB-CE2 3.46Å; H206-Y210 AromaticContact CD2-CE2 3.75Å; H206-Y210 AromaticContact CG-CE2 3.84Å |
| 207 | P | 48.3 | Very low | 56.5 | Low | 84 Ų | 84 | 95.7 Ų | 95.7 | 55% | 0.545 | 51% | 0.512 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -61.3 | 113 | 175.4 | 25.2 | -30.2 | 0 | 0 | 0 | 108.5 | L118 N204 | L118-P207 HydrophobicContact CD2-CG 3.61Å; N204-P207 WeakPolarHBondContact O-CD 3.19Å |
| 208 | G | 48.4 | Very low | 57.4 | Low | 81 Ų | 81 | 102 Ų | 102 | 84% | 0.835 | 54% | 0.542 | S | S | * | . | T | Hydrogen-bonded Turn | trans | 110.8 | 6.9 | 173.3 | 0 | 0 | 0 | 0 | 0 | 118 | H206 | H206-G208 PolarHBondContact O-N 3.31Š|
| 209 | R | 52.5 | Low | 57.9 | Low | 219 Ų | 219 | 101.7 Ų | 101.7 | 83% | 0.826 | 54% | 0.539 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -122.7 | -8.8 | 177 | -76.4 | -163.1 | -174.5 | -174.1 | 3.4 | 117.7 | H206 | H206-R209 PolarHBondContact O-N 3.44Š|
| 210 | Y | 45.8 | Very low | 58.3 | Low | 64 Ų | 64 | 100 Ų | 100 | 25% | 0.251 | 54% | 0.537 | S | S | . | . | trans | -106.4 | 89.1 | -174.8 | -69.1 | -81.4 | 0 | 0 | 0 | 112.3 | H206 I219 | H206-Y210 HydrophobicContact CB-CD2 3.87Å; H206-Y210 HydrophobicContact CB-CE2 3.46Å; H206-Y210 VanDerWaalsContact CB-CE2 3.46Å; H206-Y210 AromaticContact CD2-CE2 3.75Å; H206-Y210 AromaticContact CG-CE2 3.84Å; Y210-I219 HydrophobicContact CE1-CD1 3.61Å; Y210-I219 WeakPolarHBondContact OH-CD1 3.36Å; Y210-I219 WeakPolarHBondContact OH-CG1 3.4Å | ||
| 211 | C | 41.8 | Very low | 59 | Low | 122 Ų | 122 | 98.8 Ų | 98.8 | 82% | 0.824 | 54% | 0.542 | S | S | * | . | trans | -140.2 | 69.1 | 161.7 | -79.1 | 0 | 0 | 0 | 0 | 107.7 | ||||
| 212 | S | 44.3 | Very low | 59.7 | Low | 118 Ų | 118 | 100.1 Ų | 100.1 | 83% | 0.825 | 55% | 0.549 | S | S | * | . | S | Bend | trans | 174.9 | 156.3 | 157.9 | -88.7 | 0 | 0 | 0 | 0 | 112.9 | E214 | S212-E214 VanDerWaalsContact C-N 3.32Å; S212-E214 PolarHBondContact O-N 3.48Å; S212-E214 VanDerWaalsContact O-N 3.09Å |
| 213 | H | 49.9 | Very low | 59.9 | Low | 198 Ų | 198 | 99.4 Ų | 99.4 | 92% | 0.917 | 55% | 0.549 | S | S | * | . | S | Bend | trans | -79.2 | 24.9 | -155.3 | -138.2 | -80.6 | 0 | 0 | 0 | 117 | ||
| 214 | E | 59.4 | Low | 60.8 | Low | 177 Ų | 177 | 100.9 Ų | 100.9 | 83% | 0.827 | 55% | 0.554 | S | S | * | * | trans | -121.4 | 104.8 | 179.2 | -82.5 | -178.5 | 153.2 | 0 | 0 | 110.9 | S212 N216 | S212-E214 VanDerWaalsContact C-N 3.32Å; S212-E214 PolarHBondContact O-N 3.48Å; S212-E214 VanDerWaalsContact O-N 3.09Å; E214-N216 PolarHBondContact O-N 3.27Å; E214-N216 VanDerWaalsContact O-N 3.1Å | ||
| 215 | V | 58.6 | Low | 61.8 | Low | 113 Ų | 113 | 104.4 Ų | 104.4 | 69% | 0.685 | 57% | 0.572 | S | S | * | * | trans | -73.1 | 103.3 | 171.8 | -173.3 | 0 | 0 | 0 | 0 | 107.7 | ||||
| 216 | N | 75.9 | Confident | 62.2 | Low | 68 Ų | 68 | 105.5 Ų | 105.5 | 36% | 0.364 | 57% | 0.574 | S | S | . | * | trans | -57 | 127.8 | 175.6 | 178 | -14.5 | 0 | 0 | 0 | 109.5 | E214 E218 I219 | E214-N216 PolarHBondContact O-N 3.27Å; E214-N216 VanDerWaalsContact O-N 3.1Å; N216-E218 PolarHBondContact O-N 3.47Å; N216-E218 WeakPolarHBondContact OD1-CB 3.22Å; N216-E218 WeakPolarHBondContact OD1-CG 3.31Å; N216-E218 PolarHBondContact OD1-N 2.72Å; N216-I219 HydrophobicContact CB-CD1 3.72Å; N216-I219 HydrophobicContact CB-CG1 4.14Å; N216-I219 WeakPolarHBondContact O-CB 3.47Å; N216-I219 PolarHBondContact O-N 2.89Å | ||
| 217 | P | 76.8 | Confident | 62.6 | Low | 105 Ų | 105 | 103.2 Ų | 103.2 | 68% | 0.682 | 57% | 0.573 | S | S | * | * | H | α-helix | trans | -54.6 | -26.1 | 179.5 | 21.6 | -34.6 | 0 | 0 | 0 | 113.8 | I219 N220 A221 | P217-I219 VanDerWaalsContact C-N 3.32Å; P217-I219 PolarHBondContact O-N 2.99Å; P217-N220 PolarHBondContact O-N 3.3Å; P217-A221 PolarHBondContact O-N 3.28Å |
| 218 | E | 77.5 | Confident | 63.7 | Low | 140 Ų | 140 | 101.7 Ų | 101.7 | 65% | 0.654 | 57% | 0.567 | S | S | * | * | H | α-helix | trans | -64.4 | -34.6 | 175.4 | -64.6 | -178 | 159.4 | 0 | 0 | 112.7 | N216 A221 L222 | N216-E218 PolarHBondContact O-N 3.47Å; N216-E218 WeakPolarHBondContact OD1-CB 3.22Å; N216-E218 WeakPolarHBondContact OD1-CG 3.31Å; N216-E218 PolarHBondContact OD1-N 2.72Å; E218-A221 PolarHBondContact O-N 2.89Å; E218-L222 PolarHBondContact O-N 3.49Å |
| 219 | I | 68 | Low | 64.9 | Low | 21 Ų | 21 | 101.9 Ų | 101.9 | 11% | 0.108 | 55% | 0.552 | C | S | . | * | H | α-helix | trans | -69.4 | -41 | 177.9 | -59.2 | 159.7 | 0 | 0 | 0 | 110.1 | L202 Y210 N216 P217 A221 L222 A223 | L202-I219 HydrophobicContact CD1-CG2 3.75Å; L202-I219 HydrophobicContact CD2-CG2 3.24Å; L202-I219 HydrophobicContact CG-CG2 4.12Å; Y210-I219 HydrophobicContact CE1-CD1 3.61Å; Y210-I219 WeakPolarHBondContact OH-CD1 3.36Å; Y210-I219 WeakPolarHBondContact OH-CG1 3.4Å; N216-I219 HydrophobicContact CB-CD1 3.72Å; N216-I219 HydrophobicContact CB-CG1 4.14Å; N216-I219 WeakPolarHBondContact O-CB 3.47Å; N216-I219 PolarHBondContact O-N 2.89Å; P217-I219 VanDerWaalsContact C-N 3.32Å; P217-I219 PolarHBondContact O-N 2.99Å; I219-A221 VanDerWaalsContact C-N 3.32Å; I219-A221 PolarHBondContact O-N 2.99Å; I219-L222 WeakPolarHBondContact O-CB 3.41Å; I219-L222 PolarHBondContact O-N 2.82Å; I219-A223 PolarHBondContact O-N 3.44Å |
| 220 | N | 66.1 | Low | 65.6 | Low | 78 Ų | 78 | 95.6 Ų | 95.6 | 42% | 0.417 | 54% | 0.538 | S | S | . | . | H | α-helix | trans | -63.1 | -42.2 | 175.7 | -166.2 | 28.4 | 0 | 0 | 0 | 110.4 | P217 L222 A223 W224 | P217-N220 PolarHBondContact O-N 3.3Å; N220-L222 VanDerWaalsContact C-N 3.31Å; N220-L222 PolarHBondContact O-N 2.98Å; N220-A223 PolarHBondContact O-N 2.93Å; N220-W224 VanDerWaalsContact O-CD1 3.23Å; N220-W224 PolarHBondContact O-N 2.93Å |
| 221 | A | 74.8 | Confident | 66.7 | Low | 51 Ų | 51 | 96.3 Ų | 96.3 | 42% | 0.421 | 55% | 0.549 | S | S | . | . | H | α-helix | trans | -61 | -39.5 | 174 | 0 | 0 | 0 | 0 | 0 | 112.4 | P217 E218 I219 W224 L225 | P217-A221 PolarHBondContact O-N 3.28Å; E218-A221 PolarHBondContact O-N 2.89Å; I219-A221 VanDerWaalsContact C-N 3.32Å; I219-A221 PolarHBondContact O-N 2.99Å; A221-W224 PolarHBondContact O-N 2.91Å; A221-L225 WeakPolarHBondContact O-CB 3.44Å; A221-L225 PolarHBondContact O-N 3.09Å |
| 222 | L | 72.6 | Confident | 68.4 | Low | 100 Ų | 100 | 96 Ų | 96 | 52% | 0.524 | 54% | 0.539 | S | S | . | . | H | α-helix | trans | -66.5 | -39.6 | 176.3 | -150.5 | 97.3 | 0 | 0 | 0 | 112.2 | E218 I219 N220 L225 T226 | E218-L222 PolarHBondContact O-N 3.49Å; I219-L222 WeakPolarHBondContact O-CB 3.41Å; I219-L222 PolarHBondContact O-N 2.82Å; N220-L222 VanDerWaalsContact C-N 3.31Å; N220-L222 PolarHBondContact O-N 2.98Å; L222-L225 PolarHBondContact O-N 3.35Å; L222-T226 WeakPolarHBondContact O-CB 3.19Å; L222-T226 WeakPolarHBondContact O-CG2 3.21Å; L222-T226 PolarHBondContact O-N 2.77Å; L222-T226 PolarHBondContact O-OG1 3.29Å |
| 223 | A | 64.9 | Low | 69.6 | Low | 26 Ų | 26 | 94.4 Ų | 94.4 | 22% | 0.215 | 52% | 0.524 | C | S | . | . | H | α-helix | trans | -63.3 | -42.3 | 174.5 | 0 | 0 | 0 | 0 | 0 | 111.5 | I219 N220 T226 G227 | I219-A223 PolarHBondContact O-N 3.44Å; N220-A223 PolarHBondContact O-N 2.93Å; A223-T226 WeakPolarHBondContact CA-OG1 3.48Å; A223-T226 PolarHBondContact O-N 3.01Å; A223-T226 PolarHBondContact O-OG1 2.83Å; A223-G227 PolarHBondContact O-N 2.71Å |
| 224 | W | 77.1 | Confident | 70.6 | Confident | 174 Ų | 174 | 89.8 Ų | 89.8 | 66% | 0.659 | 51% | 0.505 | S | S | * | . | H | α-helix | trans | -62 | -44.2 | 173.2 | -87.5 | 101.3 | 0 | 0 | 0 | 112.6 | N220 A221 A228 | N220-W224 VanDerWaalsContact O-CD1 3.23Å; N220-W224 PolarHBondContact O-N 2.93Å; A221-W224 PolarHBondContact O-N 2.91Å; W224-A228 VanDerWaalsContact O-CB 3.29Å; W224-A228 WeakPolarHBondContact O-CB 3.49Å; W224-A228 PolarHBondContact O-N 3.04Å |
| 225 | L | 79.2 | Confident | 71.4 | Confident | 114 Ų | 114 | 85.8 Ų | 85.8 | 60% | 0.597 | 49% | 0.489 | S | S | * | . | H | α-helix | trans | -62.5 | -46.6 | 177.1 | -98.3 | 155 | 0 | 0 | 0 | 112.1 | A221 L222 A228 V229 | A221-L225 WeakPolarHBondContact O-CB 3.44Å; A221-L225 PolarHBondContact O-N 3.09Å; L222-L225 PolarHBondContact O-N 3.35Å; L225-A228 PolarHBondContact O-N 3.12Å; L225-V229 VanDerWaalsContact O-CG2 3.28Å; L225-V229 WeakPolarHBondContact O-CG2 3.32Å; L225-V229 PolarHBondContact O-N 3.45Å |
| 226 | T | 67.5 | Low | 72.4 | Confident | 78 Ų | 78 | 83.7 Ų | 83.7 | 48% | 0.479 | 48% | 0.476 | S | S | . | . | H | α-helix | trans | -65.4 | -43.4 | 178.9 | 46.9 | 0 | 0 | 0 | 0 | 111.6 | L222 A223 A228 V229 V230 | L222-T226 WeakPolarHBondContact O-CB 3.19Å; L222-T226 WeakPolarHBondContact O-CG2 3.21Å; L222-T226 PolarHBondContact O-N 2.77Å; L222-T226 PolarHBondContact O-OG1 3.29Å; A223-T226 WeakPolarHBondContact CA-OG1 3.48Å; A223-T226 PolarHBondContact O-N 3.01Å; A223-T226 PolarHBondContact O-OG1 2.83Å; T226-A228 PolarHBondContact O-N 3.15Å; T226-V229 PolarHBondContact O-N 2.98Å; T226-V230 WeakPolarHBondContact O-CG2 3.49Å; T226-V230 PolarHBondContact O-N 2.93Å |
| 227 | G | 66 | Low | 72.3 | Confident | 36 Ų | 36 | 85.4 Ų | 85.4 | 37% | 0.371 | 49% | 0.485 | S | S | . | . | H | α-helix | trans | -60.5 | -41.5 | 173.4 | 0 | 0 | 0 | 0 | 0 | 113.1 | A223 T231 | A223-G227 PolarHBondContact O-N 2.71Å; G227-T231 WeakPolarHBondContact O-CB 3.36Å; G227-T231 PolarHBondContact O-N 3.02Å; G227-T231 PolarHBondContact O-OG1 2.98Å |
| 228 | A | 69.9 | Low | 72 | Confident | 52 Ų | 52 | 84.9 Ų | 84.9 | 43% | 0.43 | 48% | 0.479 | S | S | . | . | H | α-helix | trans | -63.3 | -44.5 | 175.5 | 0 | 0 | 0 | 0 | 0 | 111.7 | W224 L225 T226 T231 L232 | W224-A228 VanDerWaalsContact O-CB 3.29Å; W224-A228 WeakPolarHBondContact O-CB 3.49Å; W224-A228 PolarHBondContact O-N 3.04Å; L225-A228 PolarHBondContact O-N 3.12Å; T226-A228 PolarHBondContact O-N 3.15Å; A228-T231 PolarHBondContact O-N 3.41Å; A228-L232 WeakPolarHBondContact O-CB 3.24Å; A228-L232 PolarHBondContact O-N 3.03Å |
| 229 | V | 74.8 | Confident | 72.1 | Confident | 85 Ų | 85 | 83.4 Ų | 83.4 | 52% | 0.515 | 48% | 0.475 | S | S | . | . | H | α-helix | trans | -61.9 | -48.2 | 177.9 | 170.6 | 0 | 0 | 0 | 0 | 111.2 | L225 T226 T231 L232 T233 | L225-V229 VanDerWaalsContact O-CG2 3.28Å; L225-V229 WeakPolarHBondContact O-CG2 3.32Å; L225-V229 PolarHBondContact O-N 3.45Å; T226-V229 PolarHBondContact O-N 2.98Å; V229-T231 VanDerWaalsContact C-N 3.32Å; V229-T231 PolarHBondContact O-N 3.39Å; V229-L232 PolarHBondContact O-N 2.89Å; V229-T233 PolarHBondContact O-N 3.47Å; V229-T233 PolarHBondContact O-OG1 3.2Å |
| 230 | V | 67.8 | Low | 72.5 | Confident | 87 Ų | 87 | 87.4 Ų | 87.4 | 53% | 0.527 | 50% | 0.496 | S | S | . | . | H | α-helix | trans | -60.3 | -43.6 | 178.6 | 172.8 | 0 | 0 | 0 | 0 | 111.1 | T226 L232 T233 L234 | T226-V230 WeakPolarHBondContact O-CG2 3.49Å; T226-V230 PolarHBondContact O-N 2.93Å; V230-L232 PolarHBondContact O-N 2.93Å; V230-T233 PolarHBondContact O-N 2.97Å; V230-L234 HydrophobicContact CG1-CD1 4.27Å; V230-L234 WeakPolarHBondContact O-CG 3.41Å; V230-L234 PolarHBondContact O-N 3.34Å |
| 231 | T | 67.4 | Low | 72.6 | Confident | 80 Ų | 80 | 87.6 Ų | 87.6 | 49% | 0.491 | 50% | 0.503 | S | S | . | . | H | α-helix | trans | -61.7 | -43.7 | 177.1 | -56.2 | 0 | 0 | 0 | 0 | 111.3 | G227 A228 V229 L234 I235 | G227-T231 WeakPolarHBondContact O-CB 3.36Å; G227-T231 PolarHBondContact O-N 3.02Å; G227-T231 PolarHBondContact O-OG1 2.98Å; A228-T231 PolarHBondContact O-N 3.41Å; V229-T231 VanDerWaalsContact C-N 3.32Å; V229-T231 PolarHBondContact O-N 3.39Å; T231-L234 PolarHBondContact O-N 3.32Å; T231-I235 HydrophobicContact CG2-CD1 4.05Å; T231-I235 VanDerWaalsContact O-CG1 3.29Å; T231-I235 WeakPolarHBondContact O-CG1 3.42Å; T231-I235 PolarHBondContact O-N 2.96Å |
| 232 | L | 77.5 | Confident | 72.5 | Confident | 115 Ų | 115 | 88.1 Ų | 88.1 | 60% | 0.602 | 51% | 0.507 | S | S | * | . | H | α-helix | trans | -65.1 | -41.1 | 178.2 | -130.8 | 133.4 | 0 | 0 | 0 | 111.6 | A228 V229 V230 I235 V236 | A228-L232 WeakPolarHBondContact O-CB 3.24Å; A228-L232 PolarHBondContact O-N 3.03Å; V229-L232 PolarHBondContact O-N 2.89Å; V230-L232 PolarHBondContact O-N 2.93Å; L232-I235 PolarHBondContact O-N 3.49Å; L232-V236 VanDerWaalsContact O-CG2 3.32Å; L232-V236 WeakPolarHBondContact O-CG2 3.29Å; L232-V236 PolarHBondContact O-N 3.26Å |
| 233 | T | 70.3 | Confident | 72.6 | Confident | 84 Ų | 84 | 91.8 Ų | 91.8 | 52% | 0.515 | 52% | 0.519 | S | S | . | . | H | α-helix | trans | -61.7 | -43.4 | 175.1 | -58.5 | 0 | 0 | 0 | 0 | 111.6 | V229 V230 V236 L237 | V229-T233 PolarHBondContact O-N 3.47Å; V229-T233 PolarHBondContact O-OG1 3.2Å; V230-T233 PolarHBondContact O-N 2.97Å; T233-V236 PolarHBondContact O-N 2.9Å; T233-L237 WeakPolarHBondContact O-CB 3.28Å; T233-L237 PolarHBondContact O-N 2.8Å |
| 234 | L | 70.6 | Confident | 72.7 | Confident | 101 Ų | 101 | 99.4 Ų | 99.4 | 53% | 0.529 | 55% | 0.547 | S | S | . | . | H | α-helix | trans | -64.4 | -42.6 | 176.2 | -73.1 | 173.3 | 0 | 0 | 0 | 112.1 | V230 T231 V236 L237 V238 | V230-L234 HydrophobicContact CG1-CD1 4.27Å; V230-L234 WeakPolarHBondContact O-CG 3.41Å; V230-L234 PolarHBondContact O-N 3.34Å; T231-L234 PolarHBondContact O-N 3.32Å; L234-V236 VanDerWaalsContact C-N 3.34Å; L234-V236 PolarHBondContact O-N 3.34Å; L234-L237 WeakPolarHBondContact O-CB 3.41Å; L234-L237 PolarHBondContact O-N 3.49Å; L234-V238 WeakPolarHBondContact O-CG2 3.48Å; L234-V238 PolarHBondContact O-N 3.31Å |
| 235 | I | 76 | Confident | 71.8 | Confident | 93 Ų | 93 | 99.7 Ų | 99.7 | 48% | 0.477 | 55% | 0.553 | S | S | . | * | H | α-helix | trans | -59.4 | -46.4 | 175 | -69.6 | 166.1 | 0 | 0 | 0 | 110.4 | T231 L232 L237 V238 L239 | T231-I235 HydrophobicContact CG2-CD1 4.05Å; T231-I235 VanDerWaalsContact O-CG1 3.29Å; T231-I235 WeakPolarHBondContact O-CG1 3.42Å; T231-I235 PolarHBondContact O-N 2.96Å; L232-I235 PolarHBondContact O-N 3.49Å; I235-L237 VanDerWaalsContact C-N 3.33Å; I235-L237 PolarHBondContact O-N 2.84Å; I235-V238 PolarHBondContact O-N 2.95Å; I235-L239 HydrophobicContact CG2-CD1 3.91Å; I235-L239 HydrophobicContact CG2-CG 4.35Å; I235-L239 WeakPolarHBondContact O-CB 3.21Å; I235-L239 VanDerWaalsContact O-CG 3.28Å; I235-L239 WeakPolarHBondContact O-CG 2.91Å; I235-L239 PolarHBondContact O-N 3.38Å |
| 236 | V | 80.2 | Confident | 70.8 | Confident | 70 Ų | 70 | 103.9 Ų | 103.9 | 42% | 0.424 | 57% | 0.566 | S | S | . | * | H | α-helix | trans | -60.4 | -43.9 | 177 | 170.8 | 0 | 0 | 0 | 0 | 110.9 | L232 T233 L234 V238 L239 L240 | L232-V236 VanDerWaalsContact O-CG2 3.32Å; L232-V236 WeakPolarHBondContact O-CG2 3.29Å; L232-V236 PolarHBondContact O-N 3.26Å; T233-V236 PolarHBondContact O-N 2.9Å; L234-V236 VanDerWaalsContact C-N 3.34Å; L234-V236 PolarHBondContact O-N 3.34Å; V236-V238 PolarHBondContact O-N 2.85Å; V236-L239 PolarHBondContact O-N 3.14Å; V236-L240 HydrophobicContact CG1-CD1 3.95Å; V236-L240 HydrophobicContact CG1-CG 4.31Å; V236-L240 WeakPolarHBondContact O-CB 3.4Å; V236-L240 VanDerWaalsContact O-CG 3.27Å; V236-L240 WeakPolarHBondContact O-CG 3.49Å; V236-L240 PolarHBondContact O-N 2.97Å |
| 237 | L | 73.9 | Confident | 70.2 | Confident | 104 Ų | 104 | 109 Ų | 109 | 55% | 0.545 | 58% | 0.582 | S | S | . | * | H | α-helix | trans | -60.3 | -46.1 | 178 | -153.1 | 87 | 0 | 0 | 0 | 111.5 | T233 L234 I235 L239 L240 C241 | T233-L237 WeakPolarHBondContact O-CB 3.28Å; T233-L237 PolarHBondContact O-N 2.8Å; L234-L237 WeakPolarHBondContact O-CB 3.41Å; L234-L237 PolarHBondContact O-N 3.49Å; I235-L237 VanDerWaalsContact C-N 3.33Å; I235-L237 PolarHBondContact O-N 2.84Å; L237-L239 PolarHBondContact O-N 3.42Å; L237-L240 PolarHBondContact O-N 3.25Å; L237-C241 PolarHBondContact O-N 2.85Å; L237-C241 PolarHBondContact O-SG 2.9Å; L237-C241 VanDerWaalsContact O-SG 3.32Å |
| 238 | V | 70.7 | Confident | 69.3 | Low | 93 Ų | 93 | 113.8 Ų | 113.8 | 56% | 0.564 | 60% | 0.604 | S | S | * | * | H | α-helix | trans | -62 | -42.7 | 176.8 | 171.7 | 0 | 0 | 0 | 0 | 111.3 | L234 I235 V236 C241 A242 | L234-V238 WeakPolarHBondContact O-CG2 3.48Å; L234-V238 PolarHBondContact O-N 3.31Å; I235-V238 PolarHBondContact O-N 2.95Å; V236-V238 PolarHBondContact O-N 2.85Å; V238-C241 PolarHBondContact O-N 3.48Å; V238-A242 WeakPolarHBondContact O-CB 3.43Å; V238-A242 PolarHBondContact O-N 3.35Å |
| 239 | L | 78.9 | Confident | 68.4 | Low | 109 Ų | 109 | 116.6 Ų | 116.6 | 57% | 0.571 | 62% | 0.615 | S | S | * | * | H | α-helix | trans | -65.6 | -37.5 | 177.1 | -70.7 | 174.5 | 0 | 0 | 0 | 112.5 | I235 V236 L237 A242 K243 | I235-L239 HydrophobicContact CG2-CD1 3.91Å; I235-L239 HydrophobicContact CG2-CG 4.35Å; I235-L239 WeakPolarHBondContact O-CB 3.21Å; I235-L239 VanDerWaalsContact O-CG 3.28Å; I235-L239 WeakPolarHBondContact O-CG 2.91Å; I235-L239 PolarHBondContact O-N 3.38Å; V236-L239 PolarHBondContact O-N 3.14Å; L237-L239 PolarHBondContact O-N 3.42Å; L239-A242 PolarHBondContact O-N 3.35Å; L239-K243 PolarHBondContact O-N 2.93Å |
| 240 | L | 75.6 | Confident | 67.5 | Low | 105 Ų | 105 | 118 Ų | 118 | 55% | 0.55 | 62% | 0.624 | S | S | . | * | H | α-helix | trans | -65.4 | -41.4 | 174.2 | -72.1 | 173.1 | 0 | 0 | 0 | 111.4 | V236 L237 K243 K244 | V236-L240 HydrophobicContact CG1-CD1 3.95Å; V236-L240 HydrophobicContact CG1-CG 4.31Å; V236-L240 WeakPolarHBondContact O-CB 3.4Å; V236-L240 VanDerWaalsContact O-CG 3.27Å; V236-L240 WeakPolarHBondContact O-CG 3.49Å; V236-L240 PolarHBondContact O-N 2.97Å; L237-L240 PolarHBondContact O-N 3.25Å; L240-K243 PolarHBondContact O-N 2.91Å; L240-K244 PolarHBondContact O-N 2.94Å |
| 241 | C | 69.6 | Low | 66.8 | Low | 83 Ų | 83 | 119.7 Ų | 119.7 | 56% | 0.561 | 63% | 0.634 | S | S | * | * | H | α-helix | trans | -63.9 | -42 | 173.4 | -70 | 0 | 0 | 0 | 0 | 111.9 | L237 V238 K243 K244 | L237-C241 PolarHBondContact O-N 2.85Å; L237-C241 PolarHBondContact O-SG 2.9Å; L237-C241 VanDerWaalsContact O-SG 3.32Å; V238-C241 PolarHBondContact O-N 3.48Å; C241-K243 PolarHBondContact O-N 3.46Å; C241-K244 PolarHBondContact O-N 3.39Å |
| 242 | A | 71.9 | Confident | 66.2 | Low | 61 Ų | 61 | 121 Ų | 121 | 50% | 0.504 | 64% | 0.642 | S | S | . | * | H | α-helix | trans | -64.9 | -38.5 | 178.4 | 0 | 0 | 0 | 0 | 0 | 112.4 | V238 L239 K244 K245 | V238-A242 WeakPolarHBondContact O-CB 3.43Å; V238-A242 PolarHBondContact O-N 3.35Å; L239-A242 PolarHBondContact O-N 3.35Å; A242-K244 VanDerWaalsContact C-N 3.29Å; A242-K244 PolarHBondContact O-N 3.02Å; A242-K245 PolarHBondContact O-N 3.05Å |
| 243 | K | 74.5 | Confident | 65.5 | Low | 178 Ų | 178 | 121.2 Ų | 121.2 | 77% | 0.774 | 65% | 0.648 | S | S | * | * | H | α-helix | trans | -64.6 | -29.3 | 177.4 | -90.5 | -170 | 170 | 177.2 | 0 | 113.5 | L239 L240 C241 K245 | L239-K243 PolarHBondContact O-N 2.93Å; L240-K243 PolarHBondContact O-N 2.91Å; C241-K243 PolarHBondContact O-N 3.46Å; K243-K245 VanDerWaalsContact C-N 3.29Å; K243-K245 PolarHBondContact O-N 3.18Å |
| 244 | K | 67 | Low | 64.7 | Low | 185 Ų | 185 | 126 Ų | 126 | 80% | 0.804 | 67% | 0.665 | S | S | * | * | H | α-helix | trans | -70.3 | -19.3 | 179 | -84.1 | -167.2 | 173 | -177.7 | 0 | 114.1 | L240 C241 A242 K246 | L240-K244 PolarHBondContact O-N 2.94Å; C241-K244 PolarHBondContact O-N 3.39Å; A242-K244 VanDerWaalsContact C-N 3.29Å; A242-K244 PolarHBondContact O-N 3.02Å; K244-K246 PolarHBondContact O-N 2.83Å |
| 245 | K | 58.8 | Low | 64.1 | Low | 181 Ų | 181 | 124.4 Ų | 124.4 | 79% | 0.787 | 67% | 0.673 | S | S | * | * | G | 310 helix | trans | -79.5 | -6.8 | -178.8 | -79 | -168.7 | 174.7 | -177 | 0 | 115.6 | A242 K243 K247 | A242-K245 PolarHBondContact O-N 3.05Å; K243-K245 VanDerWaalsContact C-N 3.29Å; K243-K245 PolarHBondContact O-N 3.18Å; K245-K247 PolarHBondContact O-N 3.28Å |
| 246 | K | 58.5 | Low | 63.7 | Low | 201 Ų | 201 | 126.1 Ų | 126.1 | 87% | 0.874 | 69% | 0.687 | S | S | * | * | G | 310 helix | trans | -87.7 | 10.4 | -177.9 | -98.8 | -176.2 | 178 | -177.7 | 0 | 116 | K244 | K244-K246 PolarHBondContact O-N 2.83Š|
| 247 | K | 54.7 | Low | 63.2 | Low | 187 Ų | 187 | 127.6 Ų | 127.6 | 81% | 0.813 | 70% | 0.698 | S | S | * | * | G | 310 helix | trans | -116.3 | 22 | -178.1 | -106.5 | -174.2 | -177.9 | -174.4 | 0 | 115.5 | K245 T249 | K245-K247 PolarHBondContact O-N 3.28Å; K247-T249 PolarHBondContact O-N 3.09Å |
| 248 | V | 47.7 | Very low | 63 | Low | 135 Ų | 135 | 128.2 Ų | 128.2 | 82% | 0.818 | 71% | 0.708 | S | S | * | * | trans | -81.1 | 77 | 161.2 | -174.7 | 0 | 0 | 0 | 0 | 107.4 | V250 | V248-V250 PolarHBondContact O-N 3.35Š| ||
| 249 | T | 51.1 | Low | 63.1 | Low | 111 Ų | 111 | 129.1 Ų | 129.1 | 68% | 0.681 | 72% | 0.717 | S | S | * | * | trans | -63.7 | 111.3 | 165.7 | -49 | 0 | 0 | 0 | 0 | 106.1 | K247 V251 | K247-T249 PolarHBondContact O-N 3.09Å; T249-V251 PolarHBondContact O-N 3.1Å | ||
| 250 | V | 54.3 | Low | 62.9 | Low | 114 Ų | 114 | 129.8 Ų | 129.8 | 69% | 0.691 | 73% | 0.727 | S | S | * | * | trans | -51.6 | 108.7 | 165 | 174.4 | 0 | 0 | 0 | 0 | 106.1 | V248 T252 | V248-V250 PolarHBondContact O-N 3.35Å; V250-T252 PolarHBondContact O-N 3.46Å | ||
| 251 | V | 53.6 | Low | 62.5 | Low | 123 Ų | 123 | 130 Ų | 130 | 75% | 0.745 | 74% | 0.738 | S | S | * | * | trans | -68.2 | 90.7 | 165.1 | 177.4 | 0 | 0 | 0 | 0 | 104.5 | T249 V253 | T249-V251 PolarHBondContact O-N 3.1Å; V251-V253 PolarHBondContact O-N 3.02Å | ||
| 252 | T | 55.8 | Low | 62.2 | Low | 108 Ų | 108 | 132.3 Ų | 132.3 | 66% | 0.663 | 75% | 0.752 | S | S | * | * | trans | -58.9 | 105.9 | 166.2 | -53.8 | 0 | 0 | 0 | 0 | 105.9 | V250 E254 | V250-T252 PolarHBondContact O-N 3.46Å; T252-E254 PolarHBondContact O-N 3.06Å | ||
| 253 | V | 62.3 | Low | 61.4 | Low | 119 Ų | 119 | 135.6 Ų | 135.6 | 72% | 0.721 | 77% | 0.771 | S | S | * | * | trans | -66.5 | 87.5 | 166.8 | 176.6 | 0 | 0 | 0 | 0 | 106.2 | V251 G255 | V251-V253 PolarHBondContact O-N 3.02Å; V253-G255 PolarHBondContact O-N 2.94Å | ||
| 254 | E | 54.1 | Low | 60.8 | Low | 185 Ų | 185 | 130.2 Ų | 130.2 | 86% | 0.864 | 77% | 0.766 | S | S | * | * | trans | -61.5 | 123.5 | 159.4 | -89 | -165.5 | 126.2 | 0 | 0 | 107.5 | T252 | T252-E254 PolarHBondContact O-N 3.06Š| ||
| 255 | G | 57 | Low | 60.6 | Low | 68 Ų | 68 | 130.3 Ų | 130.3 | 70% | 0.701 | 77% | 0.769 | S | S | * | * | trans | 133.5 | 19.7 | 159 | 0 | 0 | 0 | 0 | 0 | 118.6 | V253 | V253-G255 PolarHBondContact O-N 2.94Š| ||
| 256 | V | 67 | Low | 60.9 | Low | 128 Ų | 128 | 127.1 Ų | 127.1 | 78% | 0.776 | 77% | 0.767 | S | S | * | * | trans | -109.8 | 111.8 | 164.9 | -173.2 | 0 | 0 | 0 | 0 | 109.4 | ||||
| 257 | P | 70.8 | Confident | 61.2 | Low | 101 Ų | 101 | 123.5 Ų | 123.5 | 66% | 0.656 | 76% | 0.764 | S | S | * | * | P | Polyproline II helix | trans | -63.6 | 145.7 | 176.7 | 26.2 | -32 | 0 | 0 | 0 | 110.2 | ||
| 258 | P | 69.8 | Low | 61.9 | Low | 117 Ų | 117 | 123.8 Ų | 123.8 | 76% | 0.76 | 77% | 0.765 | S | S | * | * | P | Polyproline II helix | trans | -60.8 | 139.3 | -179.8 | 25.6 | -33.1 | 0 | 0 | 0 | 110.2 | ||
| 259 | P | 71.7 | Confident | 62.8 | Low | 113 Ų | 113 | 123.3 Ų | 123.3 | 73% | 0.734 | 77% | 0.765 | S | S | * | * | P | Polyproline II helix | trans | -61.3 | 145 | 171.9 | 26 | -32.1 | 0 | 0 | 0 | 109.6 | S261 | P259-S261 PolarHBondContact O-N 3.47Š|
| 260 | P | 74.3 | Confident | 63.3 | Low | 123 Ų | 123 | 127.1 Ų | 127.1 | 80% | 0.799 | 78% | 0.775 | S | S | * | * | P | Polyproline II helix | trans | -58.7 | 132.7 | -178.6 | 23.6 | -32.6 | 0 | 0 | 0 | 110.6 | ||
| 261 | S | 68.2 | Low | 63.2 | Low | 110 Ų | 110 | 126.7 Ų | 126.7 | 77% | 0.769 | 78% | 0.784 | S | S | * | * | P | Polyproline II helix | trans | -50.5 | 125.4 | 176.6 | -59 | 0 | 0 | 0 | 0 | 111 | P259 S263 | P259-S261 PolarHBondContact O-N 3.47Å; S261-S263 VanDerWaalsContact C-N 3.34Å; S261-S263 PolarHBondContact O-N 2.99Å |
| 262 | P | 64.2 | Low | 63.7 | Low | 131 Ų | 131 | 130.4 Ų | 130.4 | 85% | 0.851 | 79% | 0.79 | S | S | * | * | trans | -71.4 | 94.7 | 170 | 27.1 | -29.4 | 0 | 0 | 0 | 108.7 | G264 | P262-G264 PolarHBondContact O-N 3.35Š| ||
| 263 | S | 55 | Low | 64.1 | Low | 129 Ų | 129 | 132.9 Ų | 132.9 | 90% | 0.902 | 80% | 0.799 | S | S | * | * | trans | -74 | 99.3 | 161.1 | -175.4 | 0 | 0 | 0 | 0 | 107.3 | S261 | S261-S263 VanDerWaalsContact C-N 3.34Å; S261-S263 PolarHBondContact O-N 2.99Å | ||
| 264 | G | 61.3 | Low | 64 | Low | 66 Ų | 66 | 131.7 Ų | 131.7 | 68% | 0.68 | 80% | 0.802 | S | S | * | * | trans | -164.5 | 99.8 | -177.3 | 0 | 0 | 0 | 0 | 0 | 110.9 | P262 | P262-G264 PolarHBondContact O-N 3.35Š| ||
| 265 | E | 61.3 | Low | 65.1 | Low | 186 Ų | 186 | 128.5 Ų | 128.5 | 87% | 0.869 | 80% | 0.797 | S | S | * | * | P | Polyproline II helix | trans | -52.1 | 133.6 | 174.9 | -162.4 | 174 | 147.6 | 0 | 0 | 111.5 | P267 | E265-P267 WeakPolarHBondContact O-CD 3.4Š|
| 266 | P | 65.8 | Low | 65.8 | Low | 115 Ų | 115 | 131.2 Ų | 131.2 | 75% | 0.747 | 80% | 0.802 | S | S | * | * | P | Polyproline II helix | trans | -74.6 | 123.8 | -175.1 | 27.9 | -30.8 | 0 | 0 | 0 | 110.7 | K268 | P266-K268 PolarHBondContact O-N 3.2Š|
| 267 | P | 65.6 | Low | 65.7 | Low | 124 Ų | 124 | 129.9 Ų | 129.9 | 81% | 0.805 | 81% | 0.805 | S | S | * | * | P | Polyproline II helix | trans | -72.2 | 132.8 | 172.6 | 28.5 | -30.5 | 0 | 0 | 0 | 110.4 | E265 | E265-P267 WeakPolarHBondContact O-CD 3.4Š|
| 268 | K | 69.9 | Low | 65.8 | Low | 193 Ų | 193 | 130.4 Ų | 130.4 | 84% | 0.839 | 81% | 0.811 | S | S | * | * | P | Polyproline II helix | trans | -50.8 | 134 | 174.7 | -171.3 | 175.8 | -178 | 179.6 | 0 | 111.4 | P266 E270 | P266-K268 PolarHBondContact O-N 3.2Å; K268-E270 PolarHBondContact O-N 2.96Å |
| 269 | P | 64.9 | Low | 66.2 | Low | 126 Ų | 126 | 130.8 Ų | 130.8 | 82% | 0.818 | 81% | 0.813 | S | S | * | * | trans | -76.1 | 115.4 | -177.8 | 28.1 | -30.1 | 0 | 0 | 0 | 111 | ||||
| 270 | E | 61.8 | Low | 66.2 | Low | 190 Ų | 190 | 129.8 Ų | 129.8 | 89% | 0.888 | 82% | 0.815 | S | S | * | * | trans | -78.1 | 126.9 | 162 | -85.8 | -174.7 | 127.5 | 0 | 0 | 109.8 | K268 K272 | K268-E270 PolarHBondContact O-N 2.96Å; E270-K272 PolarHBondContact O-N 3.5Å | ||
| 271 | A | 53.3 | Low | 66.5 | Low | 105 Ų | 105 | 129.5 Ų | 129.5 | 87% | 0.868 | 81% | 0.813 | S | S | * | * | trans | -66.9 | 125.1 | 173 | 0 | 0 | 0 | 0 | 0 | 110 | ||||
| 272 | K | 63.8 | Low | 67.1 | Low | 201 Ų | 201 | 129.9 Ų | 129.9 | 87% | 0.874 | 81% | 0.813 | S | S | * | * | trans | -130.3 | 133.8 | 167.1 | -114 | 176.9 | -178.7 | 172.8 | 0 | 110.3 | E270 | E270-K272 PolarHBondContact O-N 3.5Š| ||
| 273 | D | 64.1 | Low | 67.8 | Low | 160 Ų | 160 | 129.6 Ų | 129.6 | 86% | 0.856 | 81% | 0.811 | S | S | * | * | P | Polyproline II helix | trans | -54.4 | 136.4 | -169.9 | -60.9 | -70.9 | 0 | 0 | 0 | 114.6 | ||
| 274 | A | 60.8 | Low | 68.8 | Low | 95 Ų | 95 | 129.7 Ų | 129.7 | 79% | 0.785 | 81% | 0.806 | S | S | * | * | P | Polyproline II helix | trans | -78.6 | 133.9 | 171.1 | 0 | 0 | 0 | 0 | 0 | 110.5 | ||
| 275 | P | 76.2 | Confident | 69.8 | Low | 117 Ų | 117 | 132 Ų | 132 | 76% | 0.76 | 81% | 0.809 | S | S | * | * | P | Polyproline II helix | trans | -78.5 | 154.2 | 169 | 20.3 | -12.3 | 0 | 0 | 0 | 111.7 | ||
| 276 | P | 71.6 | Confident | 70.6 | Confident | 125 Ų | 125 | 128.7 Ų | 128.7 | 81% | 0.812 | 80% | 0.804 | S | S | * | * | P | Polyproline II helix | trans | -70.5 | 138.8 | -174.2 | 28.3 | -33.1 | 0 | 0 | 0 | 112.2 | ||
| 277 | A | 65.5 | Low | 71.3 | Confident | 101 Ų | 101 | 129.4 Ų | 129.4 | 84% | 0.835 | 81% | 0.809 | S | S | * | * | P | Polyproline II helix | trans | -65.1 | 129.6 | 178 | 0 | 0 | 0 | 0 | 0 | 112.2 | ||
| 278 | S | 72.8 | Confident | 71.7 | Confident | 111 Ų | 111 | 126.6 Ų | 126.6 | 78% | 0.776 | 80% | 0.802 | S | S | * | * | P | Polyproline II helix | trans | -67.4 | 146.4 | 170.3 | -61.7 | 0 | 0 | 0 | 0 | 111.8 | ||
| 279 | P | 77.1 | Confident | 72.1 | Confident | 125 Ų | 125 | 123.3 Ų | 123.3 | 81% | 0.812 | 80% | 0.8 | S | S | * | * | P | Polyproline II helix | trans | -71.5 | 140 | -178.7 | 28.5 | -32.7 | 0 | 0 | 0 | 111.8 | ||
| 280 | A | 73 | Confident | 72.5 | Confident | 93 Ų | 93 | 122.9 Ų | 122.9 | 77% | 0.769 | 80% | 0.798 | S | S | * | * | P | Polyproline II helix | trans | -70.3 | 144 | 177 | 0 | 0 | 0 | 0 | 0 | 111.6 | ||
| 281 | P | 79.5 | Confident | 73.1 | Confident | 117 Ų | 117 | 119.9 Ų | 119.9 | 76% | 0.76 | 80% | 0.795 | S | S | * | * | P | Polyproline II helix | trans | -69.2 | 152.5 | 175.3 | 28 | -33 | 0 | 0 | 0 | 112 | ||
| 282 | P | 81.3 | Confident | 73.6 | Confident | 117 Ų | 117 | 120.1 Ų | 120.1 | 76% | 0.76 | 80% | 0.797 | S | S | * | * | P | Polyproline II helix | trans | -67.4 | 150.9 | -179.9 | 27.4 | -33.6 | 0 | 0 | 0 | 112.3 | ||
| 283 | P | 79 | Confident | 73.5 | Confident | 125 Ų | 125 | 114.2 Ų | 114.2 | 81% | 0.812 | 79% | 0.792 | S | S | * | * | P | Polyproline II helix | trans | -67.2 | 135.4 | -179.7 | 27 | -33.1 | 0 | 0 | 0 | 111.7 | ||
| 284 | T | 76.9 | Confident | 73.4 | Confident | 132 Ų | 132 | 116.2 Ų | 116.2 | 81% | 0.81 | 79% | 0.794 | S | S | * | * | P | Polyproline II helix | trans | -67.8 | 138.5 | 169.3 | 21.9 | 0 | 0 | 0 | 0 | 110.9 | ||
| 285 | P | 81.2 | Confident | 73.1 | Confident | 114 Ų | 114 | 117.8 Ų | 117.8 | 74% | 0.74 | 80% | 0.795 | S | S | * | * | P | Polyproline II helix | trans | -68.6 | 148.9 | 175.7 | 26.6 | -31.8 | 0 | 0 | 0 | 111.6 | ||
| 286 | P | 78.7 | Confident | 72.3 | Confident | 116 Ų | 116 | 121 Ų | 121 | 75% | 0.753 | 80% | 0.8 | S | S | * | * | P | Polyproline II helix | trans | -67 | 150.8 | 179.7 | 27 | -33.4 | 0 | 0 | 0 | 112.1 | ||
| 287 | P | 79.6 | Confident | 71.8 | Confident | 131 Ų | 131 | 123.1 Ų | 123.1 | 85% | 0.851 | 80% | 0.799 | S | S | * | * | P | Polyproline II helix | trans | -67.8 | 135.4 | 177.6 | 25.9 | -29.7 | 0 | 0 | 0 | 111.1 | ||
| 288 | G | 74.8 | Confident | 70.9 | Confident | 64 Ų | 64 | 124.8 Ų | 124.8 | 66% | 0.66 | 79% | 0.79 | S | S | * | * | P | Polyproline II helix | trans | -70.8 | 155.9 | 177.5 | 0 | 0 | 0 | 0 | 0 | 113.1 | ||
| 289 | P | 77.8 | Confident | 70.1 | Confident | 124 Ų | 124 | 124.5 Ų | 124.5 | 81% | 0.805 | 79% | 0.794 | S | S | * | * | P | Polyproline II helix | trans | -66.4 | 145.1 | -179.8 | 26.8 | -33.1 | 0 | 0 | 0 | 111.9 | ||
| 290 | P | 74.5 | Confident | 68.9 | Low | 118 Ų | 118 | 126.1 Ų | 126.1 | 77% | 0.766 | 79% | 0.789 | S | S | * | * | P | Polyproline II helix | trans | -70 | 150.7 | 175.4 | 28.3 | -32.2 | 0 | 0 | 0 | 111.7 | ||
| 291 | P | 73.1 | Confident | 67.9 | Low | 127 Ų | 127 | 130.3 Ų | 130.3 | 83% | 0.825 | 80% | 0.797 | S | S | * | * | P | Polyproline II helix | trans | -73.5 | 141 | 178.6 | 12.8 | -4.4 | 0 | 0 | 0 | 112.4 | G293 | P291-G293 PolarHBondContact O-N 3.37Š|
| 292 | A | 63.9 | Low | 66.5 | Low | 110 Ų | 110 | 129.7 Ų | 129.7 | 91% | 0.909 | 80% | 0.795 | S | S | * | * | P | Polyproline II helix | trans | -69.8 | 120.9 | 173 | 0 | 0 | 0 | 0 | 0 | 111.4 | ||
| 293 | G | 62 | Low | 64.9 | Low | 76 Ų | 76 | 130 Ų | 130 | 78% | 0.784 | 80% | 0.799 | S | S | * | * | P | Polyproline II helix | trans | -97.9 | 140.2 | 171.6 | 0 | 0 | 0 | 0 | 0 | 112 | P291 | P291-G293 PolarHBondContact O-N 3.37Š|
| 294 | K | 61.7 | Low | 63.5 | Low | 203 Ų | 203 | 128.6 Ų | 128.6 | 88% | 0.883 | 80% | 0.798 | S | S | * | * | P | Polyproline II helix | trans | -62.7 | 161.8 | -177.2 | -78.8 | 171.8 | 170.7 | 177.5 | 0 | 114.8 | ||
| 295 | P | 54.2 | Low | 62.3 | Low | 127 Ų | 127 | 132.7 Ų | 132.7 | 83% | 0.825 | 81% | 0.805 | S | S | * | * | P | Polyproline II helix | trans | -86.8 | 131.2 | 168.9 | 33.9 | -28.4 | 0 | 0 | 0 | 112.1 | ||
| 296 | E | 60.4 | Low | 61.1 | Low | 185 Ų | 185 | 130.2 Ų | 130.2 | 86% | 0.864 | 80% | 0.799 | S | S | * | * | trans | -104.1 | 119.4 | 161.2 | -83.6 | 176.5 | 144.1 | 0 | 0 | 106.8 | ||||
| 297 | E | 60.8 | Low | 59.7 | Low | 169 Ų | 169 | 133.8 Ų | 133.8 | 79% | 0.79 | 81% | 0.806 | S | S | * | * | 87.5 | 112.7 | 75.8 | -162.5 | 173.3 | 153.1 | 0 | 0 | 112.8 | |||||
| 298 | E | 47.7 | Very low | 58.3 | Low | 137 Ų | 137 | 133.2 Ų | 133.2 | 64% | 0.64 | 81% | 0.805 | S | S | * | * | trans | 19.7 | 124.6 | 156.9 | -57.6 | -162.6 | 148.7 | 0 | 0 | 121.4 | K300 | E298-K300 VanDerWaalsContact CD-NZ 3.3Å; E298-K300 IonicContact OE1-NZ 2.78Å; E298-K300 PolarHBondContact OE1-NZ 2.94Å; E298-K300 VanDerWaalsContact OE1-NZ 3.08Å; E298-K300 IonicContact OE2-NZ 3.08Å; E298-K300 PolarHBondContact OE2-NZ 2.98Å | ||
| 299 | A | 55.6 | Low | 57.4 | Low | 104 Ų | 104 | 134.6 Ų | 134.6 | 86% | 0.86 | 81% | 0.81 | S | S | * | * | trans | -133.6 | 104.1 | 142.3 | 0 | 0 | 0 | 0 | 0 | 110 | ||||
| 300 | K | 52.1 | Low | 56.3 | Low | 160 Ų | 160 | 138 Ų | 138 | 70% | 0.696 | 81% | 0.812 | S | S | * | * | trans | -72.3 | 128 | 165.6 | -70.8 | 163.8 | 178.4 | 124.9 | 0 | 108.4 | E298 | E298-K300 VanDerWaalsContact CD-NZ 3.3Å; E298-K300 IonicContact OE1-NZ 2.78Å; E298-K300 PolarHBondContact OE1-NZ 2.94Å; E298-K300 VanDerWaalsContact OE1-NZ 3.08Å; E298-K300 IonicContact OE2-NZ 3.08Å; E298-K300 PolarHBondContact OE2-NZ 2.98Å | ||
| 301 | L | 50.6 | Low | 55.2 | Low | 180 Ų | 180 | 141 Ų | 141 | 94% | 0.942 | 82% | 0.816 | S | S | * | * | trans | -126.7 | 107.7 | 160 | -137.5 | 87.2 | 0 | 0 | 0 | 109.5 | ||||
| 302 | S | 50.4 | Low | 54.6 | Low | 104 Ų | 104 | 141.3 Ų | 141.3 | 73% | 0.727 | 82% | 0.816 | S | S | * | * | trans | -88.3 | 142.7 | 166 | 58.3 | 0 | 0 | 0 | 0 | 110.1 | ||||
| 303 | C | 48.7 | Very low | 54.1 | Low | 124 Ų | 124 | 144.5 Ų | 144.5 | 84% | 0.838 | 81% | 0.814 | S | S | * | * | trans | 170 | 114.2 | 141.7 | -94.8 | 0 | 0 | 0 | 0 | 109.1 | ||||
| 304 | A | 49.5 | Very low | 54.1 | Low | 96 Ų | 96 | 149.9 Ų | 149.9 | 79% | 0.793 | 82% | 0.821 | S | S | * | * | 115 | 105.3 | 112 | 0 | 0 | 0 | 0 | 0 | 108.1 | |||||
| 305 | K | 51.9 | Low | 54.3 | Low | 218 Ų | 218 | 150 Ų | 150 | 95% | 0.948 | 82% | 0.822 | S | S | * | * | 58.3 | 98.6 | 69.5 | -157.6 | 174.9 | -173.8 | 179.1 | 0 | 113.7 | |||||
| 306 | G | 54.5 | Low | 55 | Low | 61 Ų | 61 | 151.6 Ų | 151.6 | 63% | 0.629 | 82% | 0.822 | S | S | * | * | trans | -167.4 | 102.5 | 160.1 | 0 | 0 | 0 | 0 | 0 | 107.9 | ||||
| 307 | E | 50.6 | Low | 55.6 | Low | 191 Ų | 191 | 148 Ų | 148 | 89% | 0.893 | 81% | 0.814 | S | S | * | * | 60.2 | 99.2 | 105 | -77.2 | -174.6 | 122.3 | 0 | 0 | 113.4 | |||||
| 308 | S | 49.7 | Very low | 56 | Low | 119 Ų | 119 | 145.2 Ų | 145.2 | 83% | 0.832 | 81% | 0.814 | S | S | * | * | 63.3 | 94.7 | 86 | 170.3 | 0 | 0 | 0 | 0 | 114.2 | |||||
| 309 | A | 56 | Low | 57.1 | Low | 93 Ų | 93 | 146.7 Ų | 146.7 | 77% | 0.769 | 82% | 0.824 | S | S | * | * | trans | -153.4 | 106.5 | 153 | 0 | 0 | 0 | 0 | 0 | 112.3 | ||||
| 310 | K | 54.2 | Low | 57.6 | Low | 195 Ų | 195 | 152.7 Ų | 152.7 | 85% | 0.848 | 83% | 0.825 | S | S | * | * | trans | 42.9 | 95 | 135.5 | -69.9 | 177.2 | 175.1 | 177.1 | 0 | 119.2 | ||||
| 311 | E | 51 | Low | 57.9 | Low | 182 Ų | 182 | 149.7 Ų | 149.7 | 85% | 0.85 | 83% | 0.83 | S | S | * | * | 13.5 | 111 | 111.5 | -155.8 | 173.1 | -160.4 | 0 | 0 | 116.6 | |||||
| 312 | T | 61.2 | Low | 58.8 | Low | 133 Ų | 133 | 149.7 Ų | 149.7 | 82% | 0.816 | 86% | 0.856 | S | S | * | * | trans | -142.5 | 106.3 | 151.5 | -47.2 | 0 | 0 | 0 | 0 | 108.5 | ||||
| 313 | M | 53.6 | Low | 59.2 | Low | 177 Ų | 177 | 152 Ų | 152 | 87% | 0.872 | 86% | 0.862 | S | S | * | * | trans | -54.5 | 127.5 | 166 | -85 | 173.4 | 133.7 | 0 | 0 | 110.7 | ||||
| 314 | M | 61.3 | Low | 59.8 | Low | 189 Ų | 189 | 153.5 Ų | 153.5 | 93% | 0.931 | 86% | 0.864 | S | S | * | * | trans | -114.2 | 121.7 | 152.7 | -105 | -171.8 | -176.3 | 0 | 0 | 109.5 | ||||
| 315 | K | 66.5 | Low | 60.3 | Low | 206 Ų | 206 | 156.7 Ų | 156.7 | 90% | 0.896 | 87% | 0.868 | S | S | * | * | P | Polyproline II helix | trans | -83.8 | 117.2 | -176.8 | -146.8 | 173 | -171.4 | 175.8 | 0 | 107.7 | ||
| 316 | I | 69.5 | Low | 60.8 | Low | 160 Ų | 160 | 153.1 Ų | 153.1 | 82% | 0.821 | 86% | 0.863 | S | S | * | * | P | Polyproline II helix | trans | -86.6 | 121 | 169.8 | -60.5 | 173.9 | 0 | 0 | 0 | 107.7 | ||
| 317 | P | 72.9 | Confident | 61.2 | Low | 110 Ų | 110 | 158.8 Ų | 158.8 | 71% | 0.714 | 88% | 0.878 | S | S | * | * | P | Polyproline II helix | trans | -78.4 | 124 | 168.2 | 18 | -9 | 0 | 0 | 0 | 110.5 | ||
| 318 | S | 69 | Low | 61.9 | Low | 111 Ų | 111 | 156.7 Ų | 156.7 | 78% | 0.776 | 88% | 0.877 | S | S | * | * | P | Polyproline II helix | trans | -65.5 | 123.2 | 164.5 | 178.4 | 0 | 0 | 0 | 0 | 109.6 | ||
| 319 | I | 69.5 | Low | 62.8 | Low | 168 Ų | 168 | 159.4 Ų | 159.4 | 86% | 0.862 | 88% | 0.88 | S | S | * | * | trans | -105 | 113.5 | 163.3 | -65.4 | 175.6 | 0 | 0 | 0 | 106.6 | ||||
| 320 | R | 66.3 | Low | 63.3 | Low | 229 Ų | 229 | 164.5 Ų | 164.5 | 86% | 0.864 | 89% | 0.888 | S | S | * | * | trans | -103.8 | 125.9 | 174.8 | -157.9 | -178.5 | -156.2 | 178.3 | 5.4 | 107.8 | ||||
| 321 | A | 59.8 | Low | 64.1 | Low | 97 Ų | 97 | 161.9 Ų | 161.9 | 80% | 0.802 | 89% | 0.892 | S | S | * | * | trans | 17.1 | 122.3 | 154.7 | 0 | 0 | 0 | 0 | 0 | 119.8 | ||||
| 322 | A | 68.5 | Low | 65.3 | Low | 181 Ų | 181 | 160.1 Ų | 160.1 | 100% | 1.496 | 90% | 0.895 | S | S | * | * | -133 | 0 | 123.2 | 0 | 0 | 0 | 0 | 0 | 107.6 |
Retrieved 322 of 322 residues in 121.1 ms
(Link to these results)