| 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 | 40.5 | Very low | 44.3 | Very low | 258 Ų | 258 | 154.1 Ų | 154.1 | 100% | 1.271 | 85% | 0.854 | S | S | * | * | 0 | 101.4 | 0 | -74.6 | 162.3 | 169.2 | 0 | 0 | 107.3 | |||||
| 2 | G | 44.7 | Very low | 44.8 | Very low | 74 Ų | 74 | 153.5 Ų | 153.5 | 76% | 0.763 | 85% | 0.847 | S | S | * | * | trans | -130.4 | 135.3 | -168.7 | 0 | 0 | 0 | 0 | 0 | 112.5 | ||||
| 3 | H | 45.8 | Very low | 44.7 | Very low | 190 Ų | 190 | 150.5 Ų | 150.5 | 88% | 0.88 | 84% | 0.839 | S | S | * | * | trans | 36.4 | 121 | 155.8 | -82.9 | -145.1 | 0 | 0 | 0 | 121.6 | ||||
| 4 | K | 44 | Very low | 45.2 | Very low | 198 Ų | 198 | 150.1 Ų | 150.1 | 86% | 0.861 | 84% | 0.842 | S | S | * | * | trans | -94.9 | 135.3 | 158.6 | -70.5 | 176.9 | 173 | 179.1 | 0 | 109.3 | ||||
| 5 | N | 49.7 | Very low | 44.9 | Very low | 167 Ų | 167 | 155.9 Ų | 155.9 | 89% | 0.893 | 85% | 0.846 | S | S | * | * | trans | -154.3 | 129.9 | 146.9 | -87.9 | -31.1 | 0 | 0 | 0 | 108.4 | ||||
| 6 | H | 48.6 | Very low | 45 | Very low | 191 Ų | 191 | 155.3 Ų | 155.3 | 88% | 0.884 | 85% | 0.848 | S | S | * | * | trans | -126 | 127.3 | -167.2 | -149.3 | -98.3 | 0 | 0 | 0 | 107.9 | ||||
| 7 | C | 37.7 | Very low | 44.9 | Very low | 125 Ų | 125 | 151.7 Ų | 151.7 | 85% | 0.845 | 84% | 0.837 | S | S | * | * | trans | -174.1 | 131.7 | 138 | -135.4 | 0 | 0 | 0 | 0 | 111.3 | ||||
| 8 | S | 39.6 | Very low | 45 | Very low | 109 Ų | 109 | 149.6 Ų | 149.6 | 76% | 0.762 | 83% | 0.829 | S | S | * | * | trans | -148.3 | 170.6 | 173.6 | -87.8 | 0 | 0 | 0 | 0 | 108.9 | ||||
| 9 | T | 46.1 | Very low | 44.7 | Very low | 127 Ų | 127 | 151.5 Ų | 151.5 | 78% | 0.779 | 83% | 0.831 | S | S | * | * | trans | 105.8 | 98.9 | 169.1 | -34.6 | 0 | 0 | 0 | 0 | 112 | ||||
| 10 | S | 44 | Very low | 44.5 | Very low | 93 Ų | 93 | 147.5 Ų | 147.5 | 65% | 0.65 | 83% | 0.826 | S | S | * | * | cis | 88.9 | 153.6 | 47 | 81.9 | 0 | 0 | 0 | 0 | 114.8 | ||||
| 11 | M | 46.6 | Very low | 44.5 | Very low | 163 Ų | 163 | 148.9 Ų | 148.9 | 80% | 0.803 | 83% | 0.832 | S | S | * | * | trans | 92.5 | 134.4 | 170.5 | -47.5 | -83.1 | -175.7 | 0 | 0 | 115.8 | ||||
| 12 | L | 49.9 | Very low | 45 | Very low | 147 Ų | 147 | 139.7 Ų | 139.7 | 77% | 0.77 | 80% | 0.803 | S | S | * | * | cis | -177.1 | 147 | -17.3 | -145.6 | 128.3 | 0 | 0 | 0 | 105.5 | ||||
| 13 | P | 44.3 | Very low | 44.8 | Very low | 115 Ų | 115 | 141.8 Ų | 141.8 | 75% | 0.747 | 80% | 0.803 | S | S | * | * | trans | -104 | 153.4 | -174.7 | 36.7 | -29.2 | 0 | 0 | 0 | 114 | ||||
| 14 | T | 51.4 | Low | 44.8 | Very low | 144 Ų | 144 | 140.4 Ų | 140.4 | 88% | 0.883 | 80% | 0.802 | S | S | * | * | trans | -132.5 | 126.5 | 170.1 | -46.7 | 0 | 0 | 0 | 0 | 111 | ||||
| 15 | R | 40.6 | Very low | 45 | Very low | 237 Ų | 237 | 137.5 Ų | 137.5 | 89% | 0.894 | 80% | 0.796 | S | S | * | * | trans | -71.4 | 152.7 | 178.8 | -67.5 | 178.7 | 174.8 | 160 | -2.9 | 112.7 | ||||
| 16 | V | 46.2 | Very low | 45.1 | Very low | 146 Ų | 146 | 135.1 Ų | 135.1 | 89% | 0.885 | 79% | 0.789 | S | S | * | * | -164.6 | 168.7 | 128.1 | -168.3 | 0 | 0 | 0 | 0 | 107 | |||||
| 17 | S | 42.8 | Very low | 44.8 | Very low | 95 Ų | 95 | 130.9 Ų | 130.9 | 66% | 0.664 | 77% | 0.772 | S | S | * | * | -167.5 | 158.5 | -86.5 | -173.6 | 0 | 0 | 0 | 0 | 106.5 | |||||
| 18 | V | 47.9 | Very low | 45.5 | Very low | 113 Ų | 113 | 130.8 Ų | 130.8 | 69% | 0.685 | 77% | 0.773 | S | S | * | * | trans | 78.9 | 141.7 | 157.2 | -163.2 | 0 | 0 | 0 | 0 | 116.6 | ||||
| 19 | Q | 38.8 | Very low | 45.9 | Very low | 186 Ų | 186 | 132.9 Ų | 132.9 | 87% | 0.869 | 77% | 0.768 | S | S | * | * | cis | -157.3 | 143.4 | 0.2 | -143 | 126.7 | 32.4 | 0 | 0 | 105 | ||||
| 20 | G | 41.4 | Very low | 46.1 | Very low | 71 Ų | 71 | 133.5 Ų | 133.5 | 73% | 0.732 | 77% | 0.766 | S | S | * | * | 129.8 | 149.6 | 78.5 | 0 | 0 | 0 | 0 | 0 | 111.4 | |||||
| 21 | D | 44.6 | Very low | 46 | Very low | 178 Ų | 178 | 134.7 Ų | 134.7 | 95% | 0.952 | 77% | 0.774 | S | S | * | * | trans | 93.9 | 108.6 | 165.9 | -122.6 | -90.8 | 0 | 0 | 0 | 121.2 | ||||
| 22 | G | 50.2 | Low | 45.8 | Very low | 64 Ų | 64 | 130.4 Ų | 130.4 | 66% | 0.66 | 77% | 0.772 | S | S | * | * | trans | 114.8 | 135.6 | 148.9 | 0 | 0 | 0 | 0 | 0 | 118.3 | ||||
| 23 | P | 41.4 | Very low | 45.6 | Very low | 119 Ų | 119 | 130.9 Ų | 130.9 | 77% | 0.773 | 78% | 0.776 | S | S | * | * | trans | -96.3 | 121.2 | -151.1 | 35.8 | -29.7 | 0 | 0 | 0 | 113.8 | ||||
| 24 | N | 45.3 | Very low | 45.6 | Very low | 160 Ų | 160 | 130.9 Ų | 130.9 | 86% | 0.856 | 78% | 0.778 | S | S | * | * | trans | -148 | 88.3 | 156.6 | -79.3 | -66.8 | 0 | 0 | 0 | 109.5 | ||||
| 25 | L | 48.6 | Very low | 45.1 | Very low | 138 Ų | 138 | 131.6 Ų | 131.6 | 72% | 0.723 | 78% | 0.776 | S | S | * | * | trans | -73.6 | 129.1 | 163.9 | -81.2 | 151.7 | 0 | 0 | 0 | 108.5 | I27 | L25-I27 HydrophobicContact CD2-CB 3.79Å; L25-I27 HydrophobicContact CD2-CD1 3.21Å; L25-I27 HydrophobicContact CD2-CG1 3.24Å | ||
| 26 | P | 50.7 | Low | 45.3 | Very low | 117 Ų | 117 | 126.6 Ų | 126.6 | 76% | 0.76 | 77% | 0.772 | S | S | * | * | -117.1 | 97.7 | 115.1 | 31.3 | -30.3 | 0 | 0 | 0 | 109.4 | S28 | P26-S28 PolarHBondContact O-N 2.93Š| |||
| 27 | I | 43.4 | Very low | 44.9 | Very low | 101 Ų | 101 | 125.9 Ų | 125.9 | 52% | 0.518 | 77% | 0.77 | S | S | . | * | trans | -68.9 | 115.9 | 152.2 | -90.1 | 170.4 | 0 | 0 | 0 | 106.5 | L25 F29 | L25-I27 HydrophobicContact CD2-CB 3.79Å; L25-I27 HydrophobicContact CD2-CD1 3.21Å; L25-I27 HydrophobicContact CD2-CG1 3.24Å; I27-F29 HydrophobicContact CB-CD2 4.47Å; I27-F29 HydrophobicContact CB-CE2 4.26Å; I27-F29 HydrophobicContact CD1-CE2 3.99Å; I27-F29 HydrophobicContact CD1-CZ 4.18Å; I27-F29 HydrophobicContact CG1-CE2 4.18Å; I27-F29 HydrophobicContact CG1-CZ 4.43Å; I27-F29 HydrophobicContact CG2-CD2 3.09Å; I27-F29 HydrophobicContact CG2-CE2 3.07Å; I27-F29 HydrophobicContact CG2-CG 4.07Å; I27-F29 HydrophobicContact CG2-CZ 4.04Å | ||
| 28 | S | 51.1 | Low | 45 | Very low | 123 Ų | 123 | 126.1 Ų | 126.1 | 86% | 0.86 | 77% | 0.772 | S | S | * | * | trans | -132 | 104.9 | 155 | -68.8 | 0 | 0 | 0 | 0 | 107 | P26 | P26-S28 PolarHBondContact O-N 2.93Š| ||
| 29 | F | 48.7 | Very low | 44.9 | Very low | 153 Ų | 153 | 125.9 Ų | 125.9 | 67% | 0.671 | 78% | 0.775 | S | S | * | * | trans | -80 | 150.7 | -172.4 | -85.5 | -71.8 | 0 | 0 | 0 | 113.3 | I27 | I27-F29 HydrophobicContact CB-CD2 4.47Å; I27-F29 HydrophobicContact CB-CE2 4.26Å; I27-F29 HydrophobicContact CD1-CE2 3.99Å; I27-F29 HydrophobicContact CD1-CZ 4.18Å; I27-F29 HydrophobicContact CG1-CE2 4.18Å; I27-F29 HydrophobicContact CG1-CZ 4.43Å; I27-F29 HydrophobicContact CG2-CD2 3.09Å; I27-F29 HydrophobicContact CG2-CE2 3.07Å; I27-F29 HydrophobicContact CG2-CG 4.07Å; I27-F29 HydrophobicContact CG2-CZ 4.04Å | ||
| 30 | L | 50 | Low | 45.4 | Very low | 140 Ų | 140 | 122.3 Ų | 122.3 | 73% | 0.733 | 77% | 0.771 | S | S | * | * | trans | 63.8 | 109.9 | 135.5 | -72.5 | 157.2 | 0 | 0 | 0 | 116.9 | ||||
| 31 | S | 41.4 | Very low | 45.7 | Very low | 118 Ų | 118 | 124.3 Ų | 124.3 | 83% | 0.825 | 77% | 0.774 | S | S | * | * | 91 | 126.5 | 77.1 | -91.8 | 0 | 0 | 0 | 0 | 112.5 | |||||
| 32 | G | 42.5 | Very low | 45.6 | Very low | 73 Ų | 73 | 121.5 Ų | 121.5 | 75% | 0.753 | 77% | 0.768 | S | S | * | * | trans | 176.6 | 79.3 | 170.8 | 0 | 0 | 0 | 0 | 0 | 111.6 | ||||
| 33 | N | 46.4 | Very low | 45.6 | Very low | 158 Ų | 158 | 123.8 Ų | 123.8 | 85% | 0.845 | 77% | 0.771 | S | S | * | * | trans | 36.9 | 121.6 | 150 | -72.8 | 13.8 | 0 | 0 | 0 | 119.9 | ||||
| 34 | S | 43.9 | Very low | 45.7 | Very low | 114 Ų | 114 | 129.2 Ų | 129.2 | 80% | 0.797 | 78% | 0.776 | S | S | * | * | 171.2 | 152.3 | 96.2 | 47.3 | 0 | 0 | 0 | 0 | 112.1 | |||||
| 35 | L | 40.6 | Very low | 45.6 | Very low | 159 Ų | 159 | 126.9 Ų | 126.9 | 83% | 0.832 | 77% | 0.771 | S | S | * | * | trans | -69.4 | 142 | -162 | -63.4 | 76 | 0 | 0 | 0 | 113.7 | ||||
| 36 | T | 46.2 | Very low | 45.7 | Very low | 132 Ų | 132 | 124.7 Ų | 124.7 | 81% | 0.81 | 76% | 0.763 | S | S | * | * | trans | 178.6 | 127.7 | 134.2 | 24.9 | 0 | 0 | 0 | 0 | 109.8 | ||||
| 37 | P | 38.1 | Very low | 45.4 | Very low | 131 Ų | 131 | 126 Ų | 126 | 85% | 0.851 | 77% | 0.772 | S | S | * | * | trans | -97.7 | 117 | -177.6 | 34.5 | -26.1 | 0 | 0 | 0 | 110.8 | ||||
| 38 | S | 44.1 | Very low | 45.3 | Very low | 101 Ų | 101 | 123.5 Ų | 123.5 | 71% | 0.706 | 77% | 0.771 | S | S | * | * | trans | -157.5 | 99.7 | 164.4 | 33.9 | 0 | 0 | 0 | 0 | 111.5 | ||||
| 39 | S | 46.2 | Very low | 45.1 | Very low | 107 Ų | 107 | 120.3 Ų | 120.3 | 75% | 0.748 | 75% | 0.749 | S | S | * | * | trans | 37.6 | 123.7 | 133.8 | 53.8 | 0 | 0 | 0 | 0 | 120.2 | ||||
| 40 | S | 48.8 | Very low | 45 | Very low | 112 Ų | 112 | 119.5 Ų | 119.5 | 78% | 0.783 | 76% | 0.756 | S | S | * | * | trans | 103.7 | 123.6 | 143.6 | 77.8 | 0 | 0 | 0 | 0 | 118.3 | ||||
| 41 | S | 48 | Very low | 45.1 | Very low | 113 Ų | 113 | 119.2 Ų | 119.2 | 79% | 0.79 | 75% | 0.754 | S | S | * | * | trans | 68.8 | 85.2 | 165.5 | 64.8 | 0 | 0 | 0 | 0 | 118.1 | P43 | S41-P43 WeakPolarHBondContact O-CD 3.29Š| ||
| 42 | S | 43.1 | Very low | 45.5 | Very low | 118 Ų | 118 | 116.2 Ų | 116.2 | 83% | 0.825 | 74% | 0.737 | S | S | * | * | trans | -64.4 | 125.6 | 157.7 | -54.1 | 0 | 0 | 0 | 0 | 110.1 | R44 | S42-R44 PolarHBondContact O-N 3.39Š| ||
| 43 | P | 50.3 | Low | 45.9 | Very low | 112 Ų | 112 | 116.7 Ų | 116.7 | 73% | 0.727 | 73% | 0.728 | S | S | * | * | trans | -68.8 | 117.7 | 160.4 | 27.7 | -27.7 | 0 | 0 | 0 | 107 | S41 C45 | S41-P43 WeakPolarHBondContact O-CD 3.29Å; P43-C45 PolarHBondContact O-N 3.13Å | ||
| 44 | R | 41.9 | Very low | 46 | Very low | 233 Ų | 233 | 114.5 Ų | 114.5 | 88% | 0.879 | 71% | 0.713 | S | S | * | * | trans | -69 | 87.5 | 173.2 | -166.9 | -178.2 | -86 | 162.2 | -8.2 | 107.4 | S42 T46 | S42-R44 PolarHBondContact O-N 3.39Å; R44-T46 VanDerWaalsContact C-N 3.33Å; R44-T46 PolarHBondContact O-N 3.43Å | ||
| 45 | C | 43.5 | Very low | 46.1 | Very low | 112 Ų | 112 | 118.5 Ų | 118.5 | 76% | 0.757 | 71% | 0.71 | S | S | * | * | trans | -62.6 | 96.6 | 167.3 | -69.7 | 0 | 0 | 0 | 0 | 107.8 | P43 | P43-C45 PolarHBondContact O-N 3.13Š| ||
| 46 | T | 51.2 | Low | 46.5 | Very low | 91 Ų | 91 | 115.3 Ų | 115.3 | 56% | 0.558 | 70% | 0.701 | S | S | * | * | trans | -66.5 | 129.4 | 167 | 41.1 | 0 | 0 | 0 | 0 | 108.2 | R44 G48 S49 | R44-T46 VanDerWaalsContact C-N 3.33Å; R44-T46 PolarHBondContact O-N 3.43Å; T46-G48 PolarHBondContact O-N 3.26Å; T46-S49 PolarHBondContact O-N 3.43Å | ||
| 47 | P | 43.8 | Very low | 46.9 | Very low | 145 Ų | 145 | 110.6 Ų | 110.6 | 94% | 0.942 | 68% | 0.679 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -72.7 | 68.7 | 169.7 | 29.6 | -30.6 | 0 | 0 | 0 | 109.4 | ||
| 48 | G | 41.9 | Very low | 47.5 | Very low | 49 Ų | 49 | 107.8 Ų | 107.8 | 51% | 0.505 | 66% | 0.657 | S | S | . | * | T | Hydrogen-bonded Turn | trans | -148 | 3.3 | 165.6 | 0 | 0 | 0 | 0 | 0 | 111 | T46 | T46-G48 PolarHBondContact O-N 3.26Š|
| 49 | S | 45.9 | Very low | 48.3 | Very low | 56 Ų | 56 | 106.6 Ų | 106.6 | 39% | 0.392 | 65% | 0.648 | S | S | . | * | H | α-helix | trans | -96.6 | 7.7 | -168.6 | -170.5 | 0 | 0 | 0 | 0 | 115.1 | T46 | T46-S49 PolarHBondContact O-N 3.43Å |
| 50 | V | 47.8 | Very low | 49.4 | Very low | 136 Ų | 136 | 105.1 Ų | 105.1 | 82% | 0.824 | 64% | 0.638 | S | S | * | * | H | α-helix | trans | -86.6 | -11.9 | 169.1 | -69.4 | 0 | 0 | 0 | 0 | 112.9 | ||
| 51 | I | 51.4 | Low | 50.4 | Low | 133 Ų | 133 | 106 Ų | 106 | 68% | 0.682 | 63% | 0.63 | S | S | * | * | H | α-helix | trans | -109 | -22.7 | 176 | -52.6 | 177.1 | 0 | 0 | 0 | 111.4 | ||
| 52 | A | 50.3 | Low | 51.7 | Low | 56 Ų | 56 | 103.5 Ų | 103.5 | 46% | 0.463 | 61% | 0.612 | S | S | . | * | H | α-helix | trans | -84.1 | -35.3 | 179.6 | 0 | 0 | 0 | 0 | 0 | 114 | H54 R55 | A52-H54 VanDerWaalsContact C-N 3.27Å; A52-H54 PolarHBondContact O-N 3.19Å; A52-R55 PolarHBondContact O-N 3.09Å |
| 53 | S | 50.8 | Low | 53.6 | Low | 82 Ų | 82 | 101 Ų | 101 | 57% | 0.573 | 59% | 0.592 | S | S | * | * | H | α-helix | trans | -72.6 | -21.5 | 173.9 | -66.1 | 0 | 0 | 0 | 0 | 113 | R55 | S53-R55 VanDerWaalsContact C-N 3.34Å |
| 54 | H | 48.9 | Very low | 55.2 | Low | 113 Ų | 113 | 100.8 Ų | 100.8 | 52% | 0.523 | 59% | 0.588 | S | S | . | * | H | α-helix | trans | -72.8 | -28.8 | 172.9 | -159.6 | -135.1 | 0 | 0 | 0 | 111.5 | A52 S56 L58 | A52-H54 VanDerWaalsContact C-N 3.27Å; A52-H54 PolarHBondContact O-N 3.19Å; H54-S56 PolarHBondContact O-N 2.88Å; H54-L58 HydrophobicContact CB-CD1 4.45Å; H54-L58 WeakPolarHBondContact CE1-CD1 3.45Å; H54-L58 VanDerWaalsContact CE1-CD2 3.46Å; H54-L58 WeakPolarHBondContact CE1-CD2 3.3Å; H54-L58 WeakPolarHBondContact CE1-CG 3.36Å; H54-L58 WeakPolarHBondContact ND1-CD1 3.45Å; H54-L58 WeakPolarHBondContact ND1-CG 3.19Å; H54-L58 WeakPolarHBondContact O-CB 3.06Å; H54-L58 WeakPolarHBondContact O-CG 3.33Å; H54-L58 PolarHBondContact O-N 2.86Å |
| 55 | R | 44.8 | Very low | 57.3 | Low | 197 Ų | 197 | 95.9 Ų | 95.9 | 74% | 0.743 | 58% | 0.579 | S | S | * | * | H | α-helix | trans | -68.6 | -34.5 | 179.9 | -81.9 | -162.8 | 173.7 | -151.9 | 0.4 | 113.8 | A52 S53 S59 | A52-R55 PolarHBondContact O-N 3.09Å; S53-R55 VanDerWaalsContact C-N 3.34Å; R55-S59 WeakPolarHBondContact O-CB 3.49Å; R55-S59 PolarHBondContact O-N 3.44Å |
| 56 | S | 50.6 | Low | 59.3 | Low | 92 Ų | 92 | 93 Ų | 93 | 64% | 0.643 | 56% | 0.558 | S | S | * | * | H | α-helix | trans | -73.9 | -36.3 | -179.6 | -52.9 | 0 | 0 | 0 | 0 | 112.5 | H54 | H54-S56 PolarHBondContact O-N 2.88Å |
| 57 | G | 52.7 | Low | 60.9 | Low | 33 Ų | 33 | 89.4 Ų | 89.4 | 34% | 0.34 | 54% | 0.536 | S | S | . | . | H | α-helix | trans | -77.1 | -43.2 | 174.1 | 0 | 0 | 0 | 0 | 0 | 113 | S60 Q61 | G57-S60 PolarHBondContact O-N 3.47Å; G57-Q61 WeakPolarHBondContact O-CB 3.18Å; G57-Q61 WeakPolarHBondContact O-CG 3.5Å; G57-Q61 PolarHBondContact O-N 2.82Å |
| 58 | L | 52 | Low | 63 | Low | 73 Ų | 73 | 83.8 Ų | 83.8 | 38% | 0.382 | 50% | 0.504 | S | S | . | . | H | α-helix | trans | -64.6 | -38.4 | 176.9 | -78.5 | 178.4 | 0 | 0 | 0 | 112.5 | H54 S60 Q61 S62 | H54-L58 HydrophobicContact CB-CD1 4.45Å; H54-L58 WeakPolarHBondContact CE1-CD1 3.45Å; H54-L58 VanDerWaalsContact CE1-CD2 3.46Å; H54-L58 WeakPolarHBondContact CE1-CD2 3.3Å; H54-L58 WeakPolarHBondContact CE1-CG 3.36Å; H54-L58 WeakPolarHBondContact ND1-CD1 3.45Å; H54-L58 WeakPolarHBondContact ND1-CG 3.19Å; H54-L58 WeakPolarHBondContact O-CB 3.06Å; H54-L58 WeakPolarHBondContact O-CG 3.33Å; H54-L58 PolarHBondContact O-N 2.86Å; L58-S60 VanDerWaalsContact C-N 3.27Å; L58-S60 PolarHBondContact O-N 3.45Å; L58-Q61 PolarHBondContact O-N 2.86Å; L58-S62 WeakPolarHBondContact O-CA 3.26Å; L58-S62 WeakPolarHBondContact O-CB 3.46Å; L58-S62 PolarHBondContact O-N 3.26Å |
| 59 | S | 61.2 | Low | 65.2 | Low | 75 Ų | 75 | 83.1 Ų | 83.1 | 52% | 0.524 | 50% | 0.497 | S | S | . | . | H | α-helix | trans | -62.7 | -40.1 | -177.4 | -166.3 | 0 | 0 | 0 | 0 | 110.7 | R55 T63 | R55-S59 WeakPolarHBondContact O-CB 3.49Å; R55-S59 PolarHBondContact O-N 3.44Å; S59-T63 VanDerWaalsContact O-CB 3.26Å; S59-T63 WeakPolarHBondContact O-CB 3.34Å; S59-T63 PolarHBondContact O-N 3.23Å; S59-T63 PolarHBondContact O-OG1 3.43Å |
| 60 | S | 68 | Low | 67.3 | Low | 77 Ų | 77 | 84 Ų | 84 | 54% | 0.538 | 49% | 0.494 | S | S | . | . | H | α-helix | trans | -72.5 | -47.1 | 177 | -60.2 | 0 | 0 | 0 | 0 | 112 | G57 L58 S62 T63 V64 | G57-S60 PolarHBondContact O-N 3.47Å; L58-S60 VanDerWaalsContact C-N 3.27Å; L58-S60 PolarHBondContact O-N 3.45Å; S60-S62 PolarHBondContact O-N 2.78Å; S60-T63 PolarHBondContact O-N 2.81Å; S60-V64 WeakPolarHBondContact O-CG2 3.28Å; S60-V64 PolarHBondContact O-N 3.03Å |
| 61 | Q | 70.3 | Confident | 69.3 | Low | 130 Ų | 130 | 80.7 Ų | 80.7 | 61% | 0.607 | 47% | 0.472 | S | S | * | . | H | α-helix | trans | -62.8 | -44.6 | 178.1 | -71.1 | -178 | 41.1 | 0 | 0 | 111.9 | G57 L58 T63 V64 L65 | G57-Q61 WeakPolarHBondContact O-CB 3.18Å; G57-Q61 WeakPolarHBondContact O-CG 3.5Å; G57-Q61 PolarHBondContact O-N 2.82Å; L58-Q61 PolarHBondContact O-N 2.86Å; Q61-T63 VanDerWaalsContact C-N 3.35Å; Q61-T63 PolarHBondContact O-N 3.2Å; Q61-V64 PolarHBondContact O-N 3.18Å; Q61-L65 WeakPolarHBondContact O-CB 3.36Å; Q61-L65 VanDerWaalsContact O-CG 3.31Å; Q61-L65 WeakPolarHBondContact O-CG 3.49Å; Q61-L65 PolarHBondContact O-N 3.2Å |
| 62 | S | 76.4 | Confident | 71.2 | Confident | 60 Ų | 60 | 79.9 Ų | 79.9 | 42% | 0.42 | 47% | 0.468 | S | S | . | . | H | α-helix | trans | -63 | -40.7 | 175.5 | -176.3 | 0 | 0 | 0 | 0 | 111.3 | L58 S60 V64 L65 T66 | L58-S62 WeakPolarHBondContact O-CA 3.26Å; L58-S62 WeakPolarHBondContact O-CB 3.46Å; L58-S62 PolarHBondContact O-N 3.26Å; S60-S62 PolarHBondContact O-N 2.78Å; S62-V64 PolarHBondContact O-N 3.02Å; S62-L65 PolarHBondContact O-N 3.27Å; S62-T66 WeakPolarHBondContact O-CB 3.3Å; S62-T66 PolarHBondContact O-N 2.79Å; S62-T66 PolarHBondContact O-OG1 3.45Å |
| 63 | T | 81.8 | Confident | 73.2 | Confident | 67 Ų | 67 | 80.9 Ų | 80.9 | 41% | 0.411 | 47% | 0.468 | S | S | . | . | H | α-helix | trans | -62.4 | -44.2 | 175.6 | -59.3 | 0 | 0 | 0 | 0 | 111 | S59 S60 Q61 T66 V67 | S59-T63 VanDerWaalsContact O-CB 3.26Å; S59-T63 WeakPolarHBondContact O-CB 3.34Å; S59-T63 PolarHBondContact O-N 3.23Å; S59-T63 PolarHBondContact O-OG1 3.43Å; S60-T63 PolarHBondContact O-N 2.81Å; Q61-T63 VanDerWaalsContact C-N 3.35Å; Q61-T63 PolarHBondContact O-N 3.2Å; T63-T66 PolarHBondContact O-N 3.35Å; T63-V67 HydrophobicContact CG2-CG2 4.18Å; T63-V67 VanDerWaalsContact O-CB 3.3Å; T63-V67 WeakPolarHBondContact O-CB 3.29Å; T63-V67 WeakPolarHBondContact O-CG2 3.43Å; T63-V67 PolarHBondContact O-N 2.93Å |
| 64 | V | 85.1 | Confident | 75.2 | Confident | 106 Ų | 106 | 77 Ų | 77 | 64% | 0.642 | 44% | 0.44 | S | S | * | . | H | α-helix | trans | -64.9 | -44.5 | 177.8 | 175.1 | 0 | 0 | 0 | 0 | 111.4 | S60 Q61 S62 T66 V67 G68 | S60-V64 WeakPolarHBondContact O-CG2 3.28Å; S60-V64 PolarHBondContact O-N 3.03Å; Q61-V64 PolarHBondContact O-N 3.18Å; S62-V64 PolarHBondContact O-N 3.02Å; V64-T66 VanDerWaalsContact C-N 3.33Å; V64-T66 PolarHBondContact O-N 2.73Å; V64-V67 PolarHBondContact O-N 3.43Å; V64-G68 PolarHBondContact O-N 2.92Å |
| 65 | L | 85.4 | Confident | 77.2 | Confident | 130 Ų | 130 | 77 Ų | 77 | 68% | 0.681 | 44% | 0.444 | S | S | * | . | H | α-helix | trans | -63.1 | -40 | 175.9 | -72.4 | 173.3 | 0 | 0 | 0 | 111.9 | Q61 S62 G69 | Q61-L65 WeakPolarHBondContact O-CB 3.36Å; Q61-L65 VanDerWaalsContact O-CG 3.31Å; Q61-L65 WeakPolarHBondContact O-CG 3.49Å; Q61-L65 PolarHBondContact O-N 3.2Å; S62-L65 PolarHBondContact O-N 3.27Å; L65-G69 WeakPolarHBondContact O-CA 3.45Å; L65-G69 PolarHBondContact O-N 3.48Å |
| 66 | T | 84.5 | Confident | 79.5 | Confident | 53 Ų | 53 | 71.8 Ų | 71.8 | 33% | 0.325 | 43% | 0.434 | S | S | . | . | H | α-helix | trans | -65.8 | -50.8 | 178.1 | -64.1 | 0 | 0 | 0 | 0 | 110.1 | S62 T63 V64 G68 G69 F70 | S62-T66 WeakPolarHBondContact O-CB 3.3Å; S62-T66 PolarHBondContact O-N 2.79Å; S62-T66 PolarHBondContact O-OG1 3.45Å; T63-T66 PolarHBondContact O-N 3.35Å; V64-T66 VanDerWaalsContact C-N 3.33Å; V64-T66 PolarHBondContact O-N 2.73Å; T66-G68 PolarHBondContact O-N 2.91Å; T66-G69 PolarHBondContact O-N 3.28Å; T66-F70 HydrophobicContact CG2-CD2 3.4Å; T66-F70 VanDerWaalsContact CG2-CD2 3.4Å; T66-F70 HydrophobicContact CG2-CE2 3.24Å; T66-F70 WeakPolarHBondContact O-CB 3.13Å; T66-F70 WeakPolarHBondContact O-CD2 3.42Å; T66-F70 WeakPolarHBondContact O-CG 3.24Å; T66-F70 PolarHBondContact O-N 2.96Å |
| 67 | V | 84.6 | Confident | 81.4 | Confident | 15 Ų | 15 | 69.1 Ų | 69.1 | 9% | 0.091 | 41% | 0.412 | C | S | . | . | H | α-helix | trans | -61.5 | -44.7 | 177 | 170 | 0 | 0 | 0 | 0 | 111.1 | T63 V64 L71 L114 Q115 | T63-V67 HydrophobicContact CG2-CG2 4.18Å; T63-V67 VanDerWaalsContact O-CB 3.3Å; T63-V67 WeakPolarHBondContact O-CB 3.29Å; T63-V67 WeakPolarHBondContact O-CG2 3.43Å; T63-V67 PolarHBondContact O-N 2.93Å; V64-V67 PolarHBondContact O-N 3.43Å; V67-L71 HydrophobicContact CG1-CD1 4.49Å; V67-L71 WeakPolarHBondContact O-CB 3.41Å; V67-L71 WeakPolarHBondContact O-CG 3.29Å; V67-L71 PolarHBondContact O-N 3.39Å; V67-L114 HydrophobicContact CG2-CB 4.03Å; V67-L114 HydrophobicContact CG2-CD1 4.46Å; V67-Q115 HydrophobicContact CG1-CG 3.94Å; V67-Q115 HydrophobicContact CG2-CG 4.24Å |
| 68 | G | 88.4 | Confident | 83.3 | Confident | 27 Ų | 27 | 69.1 Ų | 69.1 | 28% | 0.278 | 41% | 0.406 | S | S | . | . | H | α-helix | trans | -64.7 | -46.3 | 177.9 | 0 | 0 | 0 | 0 | 0 | 112.3 | V64 T66 L71 I72 | V64-G68 PolarHBondContact O-N 2.92Å; T66-G68 PolarHBondContact O-N 2.91Å; G68-L71 PolarHBondContact O-N 3.48Å; G68-I72 VanDerWaalsContact O-CG1 3.29Å; G68-I72 WeakPolarHBondContact O-CG1 3.2Å; G68-I72 PolarHBondContact O-N 3.39Å |
| 69 | G | 89.2 | Confident | 85.3 | Confident | 35 Ų | 35 | 68.9 Ų | 68.9 | 36% | 0.361 | 41% | 0.409 | S | S | . | . | H | α-helix | trans | -62.1 | -46.7 | 176.3 | 0 | 0 | 0 | 0 | 0 | 112.2 | L65 T66 L71 I72 V73 | L65-G69 WeakPolarHBondContact O-CA 3.45Å; L65-G69 PolarHBondContact O-N 3.48Å; T66-G69 PolarHBondContact O-N 3.28Å; G69-L71 VanDerWaalsContact C-N 3.33Å; G69-L71 PolarHBondContact O-N 3.41Å; G69-I72 PolarHBondContact O-N 2.93Å; G69-V73 WeakPolarHBondContact O-CB 3.46Å; G69-V73 VanDerWaalsContact O-CG2 3.26Å; G69-V73 WeakPolarHBondContact O-CG2 3.2Å; G69-V73 PolarHBondContact O-N 3.27Å |
| 70 | F | 89.9 | Confident | 86.6 | Confident | 73 Ų | 73 | 68 Ų | 68 | 32% | 0.32 | 40% | 0.403 | S | S | . | . | H | α-helix | trans | -65.3 | -33.8 | 175.4 | -77.3 | -62.3 | 0 | 0 | 0 | 112.5 | T66 G74 F107 C111 L114 | T66-F70 HydrophobicContact CG2-CD2 3.4Å; T66-F70 VanDerWaalsContact CG2-CD2 3.4Å; T66-F70 HydrophobicContact CG2-CE2 3.24Å; T66-F70 WeakPolarHBondContact O-CB 3.13Å; T66-F70 WeakPolarHBondContact O-CD2 3.42Å; T66-F70 WeakPolarHBondContact O-CG 3.24Å; T66-F70 PolarHBondContact O-N 2.96Å; F70-G74 WeakPolarHBondContact O-CA 3.34Å; F70-G74 PolarHBondContact O-N 2.97Å; F70-F107 AromaticContact CD1-CD1 3.76Å; F70-F107 HydrophobicContact CD1-CD1 3.76Å; F70-F107 AromaticContact CD1-CE1 3.92Å; F70-F107 HydrophobicContact CD1-CE1 3.92Å; F70-F107 HydrophobicContact CE1-CD1 4.15Å; F70-F107 AromaticContact CE1-CE1 3.85Å; F70-F107 HydrophobicContact CE1-CE1 3.85Å; F70-C111 WeakPolarHBondContact CB-SG 3.31Å; F70-L114 HydrophobicContact CD2-CD1 4.36Å |
| 71 | L | 89.1 | Confident | 87.6 | Confident | 68 Ų | 68 | 64.4 Ų | 64.4 | 36% | 0.356 | 38% | 0.378 | S | S | . | . | H | α-helix | trans | -68.6 | -43.3 | 175.3 | -84.4 | -172.1 | 0 | 0 | 0 | 112.1 | V67 G68 G69 G74 L75 C111 | V67-L71 HydrophobicContact CG1-CD1 4.49Å; V67-L71 WeakPolarHBondContact O-CB 3.41Å; V67-L71 WeakPolarHBondContact O-CG 3.29Å; V67-L71 PolarHBondContact O-N 3.39Å; G68-L71 PolarHBondContact O-N 3.48Å; G69-L71 VanDerWaalsContact C-N 3.33Å; G69-L71 PolarHBondContact O-N 3.41Å; L71-G74 PolarHBondContact O-N 3.26Å; L71-L75 WeakPolarHBondContact O-CB 3.26Å; L71-L75 PolarHBondContact O-N 2.86Å; L71-C111 HydrophobicContact CD2-CB 3.37Å; L71-C111 HydrophobicContact CG-CB 3.72Å; L71-C111 PolarHBondContact N-SG 3.28Å; L71-C111 VanDerWaalsContact N-SG 3.41Å |
| 72 | I | 92 | Very high | 88.5 | Confident | 116 Ų | 116 | 60.3 Ų | 60.3 | 60% | 0.595 | 37% | 0.366 | S | S | * | . | H | α-helix | trans | -61.5 | -51.2 | 176.5 | -66.6 | 163.6 | 0 | 0 | 0 | 109 | G68 G69 G74 L75 T76 | G68-I72 VanDerWaalsContact O-CG1 3.29Å; G68-I72 WeakPolarHBondContact O-CG1 3.2Å; G68-I72 PolarHBondContact O-N 3.39Å; G69-I72 PolarHBondContact O-N 2.93Å; I72-G74 PolarHBondContact O-N 3.38Å; I72-L75 PolarHBondContact O-N 3.41Å; I72-T76 WeakPolarHBondContact O-CB 3.31Å; I72-T76 PolarHBondContact O-N 2.81Å; I72-T76 PolarHBondContact O-OG1 3.49Å |
| 73 | V | 92.3 | Very high | 89.1 | Confident | 77 Ų | 77 | 62.1 Ų | 62.1 | 47% | 0.467 | 38% | 0.375 | S | S | . | . | H | α-helix | trans | -60 | -48.3 | 178.6 | 173.2 | 0 | 0 | 0 | 0 | 111.3 | G69 T76 L77 | G69-V73 WeakPolarHBondContact O-CB 3.46Å; G69-V73 VanDerWaalsContact O-CG2 3.26Å; G69-V73 WeakPolarHBondContact O-CG2 3.2Å; G69-V73 PolarHBondContact O-N 3.27Å; V73-T76 PolarHBondContact O-N 3.47Å; V73-L77 HydrophobicContact CG1-CD1 4.2Å; V73-L77 VanDerWaalsContact O-CG 3.29Å; V73-L77 WeakPolarHBondContact O-CG 3.45Å; V73-L77 PolarHBondContact O-N 3.45Å |
| 74 | G | 91.9 | Very high | 89.2 | Confident | 0 Ų | 0 | 61.2 Ų | 61.2 | 0% | 0 | 37% | 0.369 | C | S | . | . | H | α-helix | trans | -61.6 | -46.3 | 179.4 | 0 | 0 | 0 | 0 | 0 | 112.5 | F70 L71 I72 L77 V78 | F70-G74 WeakPolarHBondContact O-CA 3.34Å; F70-G74 PolarHBondContact O-N 2.97Å; L71-G74 PolarHBondContact O-N 3.26Å; I72-G74 PolarHBondContact O-N 3.38Å; G74-L77 PolarHBondContact O-N 2.78Å; G74-V78 VanDerWaalsContact O-CG2 3.31Å; G74-V78 WeakPolarHBondContact O-CG2 3.38Å; G74-V78 PolarHBondContact O-N 2.87Å |
| 75 | L | 91.5 | Very high | 89.2 | Confident | 113 Ų | 113 | 61.8 Ų | 61.8 | 59% | 0.592 | 36% | 0.363 | S | S | * | . | H | α-helix | trans | -65.6 | -41.8 | 177.7 | -174.7 | 64.5 | 0 | 0 | 0 | 111.3 | L71 I72 L77 V78 C79 | L71-L75 WeakPolarHBondContact O-CB 3.26Å; L71-L75 PolarHBondContact O-N 2.86Å; I72-L75 PolarHBondContact O-N 3.41Å; L75-L77 VanDerWaalsContact C-N 3.33Å; L75-L77 PolarHBondContact O-N 2.93Å; L75-V78 PolarHBondContact O-N 3.28Å; L75-C79 VanDerWaalsContact O-CB 3.3Å; L75-C79 WeakPolarHBondContact O-CB 3.5Å; L75-C79 PolarHBondContact O-N 3.29Å; L75-C79 PolarHBondContact O-SG 3.45Å |
| 76 | T | 93.1 | Very high | 89 | Confident | 87 Ų | 87 | 60.2 Ų | 60.2 | 53% | 0.534 | 36% | 0.363 | S | S | . | . | H | α-helix | trans | -59.6 | -43.5 | 174.1 | -60.1 | 0 | 0 | 0 | 0 | 111.3 | I72 V73 S80 | I72-T76 WeakPolarHBondContact O-CB 3.31Å; I72-T76 PolarHBondContact O-N 2.81Å; I72-T76 PolarHBondContact O-OG1 3.49Å; V73-T76 PolarHBondContact O-N 3.47Å; T76-S80 WeakPolarHBondContact O-CB 3.09Å; T76-S80 PolarHBondContact O-N 3.32Å |
| 77 | L | 90.8 | Very high | 88.8 | Confident | 37 Ų | 37 | 62.5 Ų | 62.5 | 19% | 0.194 | 38% | 0.377 | C | S | . | . | H | α-helix | trans | -63.9 | -44.8 | 175.4 | -69.7 | 175.3 | 0 | 0 | 0 | 111.9 | V73 G74 L75 S80 S81 F100 V103 F107 | V73-L77 HydrophobicContact CG1-CD1 4.2Å; V73-L77 VanDerWaalsContact O-CG 3.29Å; V73-L77 WeakPolarHBondContact O-CG 3.45Å; V73-L77 PolarHBondContact O-N 3.45Å; G74-L77 PolarHBondContact O-N 2.78Å; L75-L77 VanDerWaalsContact C-N 3.33Å; L75-L77 PolarHBondContact O-N 2.93Å; L77-S80 PolarHBondContact O-N 2.83Å; L77-S81 VanDerWaalsContact O-CB 3.26Å; L77-S81 WeakPolarHBondContact O-CB 3.04Å; L77-S81 PolarHBondContact O-N 2.87Å; L77-S81 PolarHBondContact O-OG 3.28Å; L77-F100 HydrophobicContact CD2-CD1 4Å; L77-F100 HydrophobicContact CD2-CE1 3.28Å; L77-F100 HydrophobicContact CD2-CZ 3.67Å; L77-V103 HydrophobicContact CD1-CG1 4.47Å; L77-F107 HydrophobicContact CD1-CD2 4.13Å; L77-F107 HydrophobicContact CD1-CE2 4.39Å |
| 78 | V | 92.6 | Very high | 88 | Confident | 33 Ų | 33 | 64.8 Ų | 64.8 | 20% | 0.2 | 39% | 0.386 | C | S | . | . | H | α-helix | trans | -63.1 | -49.1 | 177.6 | 172.6 | 0 | 0 | 0 | 0 | 110.6 | G74 L75 S80 S81 A82 F101 G104 | G74-V78 VanDerWaalsContact O-CG2 3.31Å; G74-V78 WeakPolarHBondContact O-CG2 3.38Å; G74-V78 PolarHBondContact O-N 2.87Å; L75-V78 PolarHBondContact O-N 3.28Å; V78-S80 PolarHBondContact O-N 2.91Å; V78-S81 WeakPolarHBondContact CA-OG 3.46Å; V78-S81 PolarHBondContact O-N 3.43Å; V78-S81 PolarHBondContact O-OG 2.88Å; V78-A82 WeakPolarHBondContact O-CB 3.32Å; V78-A82 PolarHBondContact O-N 2.67Å; V78-F101 HydrophobicContact CG1-CD2 4.31Å; V78-F101 HydrophobicContact CG1-CE2 4.06Å; V78-G104 VanDerWaalsContact CG2-C 3.45Å |
| 79 | C | 92.5 | Very high | 87 | Confident | 67 Ų | 67 | 74.7 Ų | 74.7 | 45% | 0.453 | 42% | 0.415 | S | S | . | . | H | α-helix | trans | -59.6 | -46.9 | 176.7 | -71 | 0 | 0 | 0 | 0 | 111.5 | L75 S81 A82 V83 | L75-C79 VanDerWaalsContact O-CB 3.3Å; L75-C79 WeakPolarHBondContact O-CB 3.5Å; L75-C79 PolarHBondContact O-N 3.29Å; L75-C79 PolarHBondContact O-SG 3.45Å; C79-S81 VanDerWaalsContact C-N 3.33Å; C79-S81 PolarHBondContact O-N 3.49Å; C79-A82 PolarHBondContact O-N 2.77Å; C79-V83 WeakPolarHBondContact O-CG2 3.21Å; C79-V83 PolarHBondContact O-N 3.48Å |
| 80 | S | 90.3 | Very high | 86.3 | Confident | 57 Ų | 57 | 79.2 Ų | 79.2 | 40% | 0.399 | 43% | 0.427 | S | S | . | . | H | α-helix | trans | -59.6 | -44.7 | 176.2 | -172.6 | 0 | 0 | 0 | 0 | 111.2 | T76 L77 V78 V83 V84 | T76-S80 WeakPolarHBondContact O-CB 3.09Å; T76-S80 PolarHBondContact O-N 3.32Å; L77-S80 PolarHBondContact O-N 2.83Å; V78-S80 PolarHBondContact O-N 2.91Å; S80-V83 PolarHBondContact O-N 3.22Å; S80-V84 VanDerWaalsContact O-CG2 3.29Å; S80-V84 WeakPolarHBondContact O-CG2 3.41Å; S80-V84 PolarHBondContact O-N 2.71Å |
| 81 | S | 87.9 | Confident | 85.5 | Confident | 2 Ų | 2 | 82.6 Ų | 82.6 | 1% | 0.014 | 44% | 0.444 | C | S | . | . | H | α-helix | trans | -66.1 | -38.3 | 178.3 | 72.6 | 0 | 0 | 0 | 0 | 112.4 | L77 V78 C79 V84 F85 F101 | L77-S81 VanDerWaalsContact O-CB 3.26Å; L77-S81 WeakPolarHBondContact O-CB 3.04Å; L77-S81 PolarHBondContact O-N 2.87Å; L77-S81 PolarHBondContact O-OG 3.28Å; V78-S81 WeakPolarHBondContact CA-OG 3.46Å; V78-S81 PolarHBondContact O-N 3.43Å; V78-S81 PolarHBondContact O-OG 2.88Å; C79-S81 VanDerWaalsContact C-N 3.33Å; C79-S81 PolarHBondContact O-N 3.49Å; S81-V84 PolarHBondContact O-N 3.49Å; S81-F85 WeakPolarHBondContact O-CB 3.33Å; S81-F85 PolarHBondContact O-N 3.43Å; S81-F101 WeakPolarHBondContact OG-CA 3.26Å |
| 82 | A | 88.5 | Confident | 85.1 | Confident | 43 Ų | 43 | 86.8 Ų | 86.8 | 36% | 0.355 | 46% | 0.461 | S | S | . | . | H | α-helix | trans | -65.7 | -40.3 | 178.6 | 0 | 0 | 0 | 0 | 0 | 111.3 | V78 C79 F85 S86 | V78-A82 WeakPolarHBondContact O-CB 3.32Å; V78-A82 PolarHBondContact O-N 2.67Å; C79-A82 PolarHBondContact O-N 2.77Å; A82-F85 PolarHBondContact O-N 2.91Å; A82-S86 WeakPolarHBondContact O-CB 3.25Å; A82-S86 PolarHBondContact O-N 3.15Å; A82-S86 PolarHBondContact O-OG 3.36Å |
| 83 | V | 89.8 | Confident | 84.4 | Confident | 99 Ų | 99 | 85.2 Ų | 85.2 | 60% | 0.6 | 45% | 0.45 | S | S | * | . | H | α-helix | trans | -65.2 | -47.2 | 174.5 | 174.6 | 0 | 0 | 0 | 0 | 110.8 | C79 S80 F85 S86 T87 | C79-V83 WeakPolarHBondContact O-CG2 3.21Å; C79-V83 PolarHBondContact O-N 3.48Å; S80-V83 PolarHBondContact O-N 3.22Å; V83-F85 VanDerWaalsContact C-N 3.32Å; V83-F85 PolarHBondContact O-N 2.79Å; V83-S86 PolarHBondContact O-N 2.84Å; V83-S86 VanDerWaalsContact O-N 3.13Å; V83-T87 WeakPolarHBondContact O-CG2 3.37Å; V83-T87 PolarHBondContact O-N 3.46Å |
| 84 | V | 84.7 | Confident | 83.9 | Confident | 47 Ų | 47 | 85.5 Ų | 85.5 | 29% | 0.285 | 45% | 0.446 | S | S | . | . | H | α-helix | trans | -61.4 | -41.5 | 177.1 | 172.1 | 0 | 0 | 0 | 0 | 111.4 | S80 S81 S86 T87 Q88 | S80-V84 VanDerWaalsContact O-CG2 3.29Å; S80-V84 WeakPolarHBondContact O-CG2 3.41Å; S80-V84 PolarHBondContact O-N 2.71Å; S81-V84 PolarHBondContact O-N 3.49Å; V84-S86 VanDerWaalsContact C-N 3.29Å; V84-S86 PolarHBondContact O-N 3.42Å; V84-T87 PolarHBondContact O-N 2.79Å; V84-Q88 PolarHBondContact O-N 3.47Å |
| 85 | F | 84.1 | Confident | 83.6 | Confident | 118 Ų | 118 | 90.3 Ų | 90.3 | 52% | 0.518 | 47% | 0.47 | S | S | . | . | H | α-helix | trans | -65.3 | -33.5 | 176.4 | -167.8 | -95.3 | 0 | 0 | 0 | 112.2 | S81 A82 V83 | S81-F85 WeakPolarHBondContact O-CB 3.33Å; S81-F85 PolarHBondContact O-N 3.43Å; A82-F85 PolarHBondContact O-N 2.91Å; V83-F85 VanDerWaalsContact C-N 3.32Å; V83-F85 PolarHBondContact O-N 2.79Å |
| 86 | S | 82.3 | Confident | 83.3 | Confident | 98 Ų | 98 | 89 Ų | 89 | 69% | 0.685 | 47% | 0.467 | S | S | * | . | H | α-helix | trans | -76.5 | -34 | 177.5 | -57.8 | 0 | 0 | 0 | 0 | 112.8 | A82 V83 V84 | A82-S86 WeakPolarHBondContact O-CB 3.25Å; A82-S86 PolarHBondContact O-N 3.15Å; A82-S86 PolarHBondContact O-OG 3.36Å; V83-S86 PolarHBondContact O-N 2.84Å; V83-S86 VanDerWaalsContact O-N 3.13Å; V84-S86 VanDerWaalsContact C-N 3.29Å; V84-S86 PolarHBondContact O-N 3.42Å |
| 87 | T | 80.4 | Confident | 82.9 | Confident | 101 Ų | 101 | 84.9 Ų | 84.9 | 62% | 0.62 | 44% | 0.442 | S | S | * | . | H | α-helix | trans | -84.3 | -30.1 | -172.5 | -166.6 | 0 | 0 | 0 | 0 | 113.7 | V83 V84 | V83-T87 WeakPolarHBondContact O-CG2 3.37Å; V83-T87 PolarHBondContact O-N 3.46Å; V84-T87 PolarHBondContact O-N 2.79Å |
| 88 | Q | 66.3 | Low | 82.8 | Confident | 62 Ų | 62 | 86.1 Ų | 86.1 | 29% | 0.29 | 45% | 0.453 | S | S | . | . | trans | -117.3 | 118.9 | -172 | -55.9 | -140.6 | 40.9 | 0 | 0 | 113.1 | V84 F93 | V84-Q88 PolarHBondContact O-N 3.47Å; Q88-F93 HydrophobicContact CB-CB 3.58Å; Q88-F93 HydrophobicContact CB-CD2 4.34Å; Q88-F93 HydrophobicContact CB-CG 3.92Å; Q88-F93 VanDerWaalsContact CD-CD1 3.43Å; Q88-F93 VanDerWaalsContact CD-CG 3.45Å; Q88-F93 HydrophobicContact CG-CB 4.27Å; Q88-F93 HydrophobicContact CG-CD1 4.35Å; Q88-F93 HydrophobicContact CG-CG 4.17Å; Q88-F93 VanDerWaalsContact NE2-CD1 3.26Å; Q88-F93 VanDerWaalsContact OE1-CG 3.24Å | ||
| 89 | R | 67.4 | Low | 82.7 | Confident | 235 Ų | 235 | 89 Ų | 89 | 89% | 0.887 | 47% | 0.467 | S | S | * | . | trans | -86.4 | -6 | 176.1 | -69.7 | -87.6 | -179.2 | 102.1 | -0.9 | 113.6 | ||||
| 90 | H | 74.4 | Confident | 82.6 | Confident | 131 Ų | 131 | 90 Ų | 90 | 61% | 0.606 | 46% | 0.464 | S | S | * | . | S | Bend | trans | -75.5 | 136.9 | -178.1 | -70.2 | -81.8 | 0 | 0 | 0 | 111.4 | E92 F93 K94 | H90-E92 PolarHBondContact O-N 3.41Å; H90-F93 HydrophobicContact CB-CD2 3.8Å; H90-F93 HydrophobicContact CB-CE2 4.44Å; H90-F93 PolarHBondContact O-N 2.82Å; H90-F93 VanDerWaalsContact O-N 3.09Å; H90-K94 PolarHBondContact O-N 2.89Å |
| 91 | Q | 74.4 | Confident | 82.6 | Confident | 143 Ų | 143 | 91.8 Ų | 91.8 | 67% | 0.668 | 46% | 0.464 | S | S | * | . | H | α-helix | trans | -56.8 | -35.9 | -174.2 | -67.3 | -69 | -6.8 | 0 | 0 | 113.1 | F93 K94 I95 | Q91-F93 VanDerWaalsContact C-N 3.33Å; Q91-F93 PolarHBondContact O-N 3.1Å; Q91-K94 WeakPolarHBondContact O-CB 3.31Å; Q91-K94 PolarHBondContact O-N 3.24Å; Q91-I95 PolarHBondContact O-N 2.86Å |
| 92 | E | 79.6 | Confident | 82.8 | Confident | 156 Ų | 156 | 94 Ų | 94 | 73% | 0.729 | 48% | 0.482 | S | S | * | . | H | α-helix | trans | -66.3 | -35 | -179.4 | -53.1 | -158.6 | 118.8 | 0 | 0 | 112.4 | H90 I95 V96 | H90-E92 PolarHBondContact O-N 3.41Å; E92-I95 WeakPolarHBondContact O-CG2 3.22Å; E92-V96 WeakPolarHBondContact O-CG2 2.99Å |
| 93 | F | 78.4 | Confident | 82.9 | Confident | 83 Ų | 83 | 95 Ų | 95 | 36% | 0.364 | 48% | 0.484 | S | S | . | . | H | α-helix | trans | -78.8 | -27.4 | 176.1 | -67.1 | -85.2 | 0 | 0 | 0 | 112 | Q88 H90 Q91 G97 | Q88-F93 HydrophobicContact CB-CB 3.58Å; Q88-F93 HydrophobicContact CB-CD2 4.34Å; Q88-F93 HydrophobicContact CB-CG 3.92Å; Q88-F93 VanDerWaalsContact CD-CD1 3.43Å; Q88-F93 VanDerWaalsContact CD-CG 3.45Å; Q88-F93 HydrophobicContact CG-CB 4.27Å; Q88-F93 HydrophobicContact CG-CD1 4.35Å; Q88-F93 HydrophobicContact CG-CG 4.17Å; Q88-F93 VanDerWaalsContact NE2-CD1 3.26Å; Q88-F93 VanDerWaalsContact OE1-CG 3.24Å; H90-F93 HydrophobicContact CB-CD2 3.8Å; H90-F93 HydrophobicContact CB-CE2 4.44Å; H90-F93 PolarHBondContact O-N 2.82Å; H90-F93 VanDerWaalsContact O-N 3.09Å; Q91-F93 VanDerWaalsContact C-N 3.33Å; Q91-F93 PolarHBondContact O-N 3.1Å; F93-G97 PolarHBondContact O-N 3.32Å |
| 94 | K | 81.3 | Confident | 83 | Confident | 84 Ų | 84 | 90.2 Ų | 90.2 | 37% | 0.365 | 46% | 0.455 | S | S | . | . | H | α-helix | trans | -64.8 | -41.2 | 174.8 | -68.5 | 179.6 | 67.1 | -178.7 | 0 | 112.2 | H90 Q91 S98 | H90-K94 PolarHBondContact O-N 2.89Å; Q91-K94 WeakPolarHBondContact O-CB 3.31Å; Q91-K94 PolarHBondContact O-N 3.24Å; K94-S98 WeakPolarHBondContact O-CB 3.48Å; K94-S98 PolarHBondContact O-N 3.49Å |
| 95 | I | 85.4 | Confident | 83.2 | Confident | 101 Ų | 101 | 91.7 Ų | 91.7 | 52% | 0.518 | 46% | 0.461 | S | S | . | . | H | α-helix | trans | -66 | -46.2 | 178.6 | -176.9 | 62.3 | 0 | 0 | 0 | 110.8 | Q91 E92 S98 I99 | Q91-I95 PolarHBondContact O-N 2.86Å; E92-I95 WeakPolarHBondContact O-CG2 3.22Å; I95-S98 PolarHBondContact O-N 2.95Å; I95-I99 HydrophobicContact CD1-CD1 4.17Å; I95-I99 HydrophobicContact CD1-CG1 4.38Å; I95-I99 HydrophobicContact CG1-CD1 3.96Å; I95-I99 VanDerWaalsContact O-CG1 3.3Å; I95-I99 WeakPolarHBondContact O-CG1 2.94Å; I95-I99 PolarHBondContact O-N 2.88Å |
| 96 | V | 85 | Confident | 83.5 | Confident | 85 Ų | 85 | 89.4 Ų | 89.4 | 52% | 0.515 | 46% | 0.46 | S | S | . | . | H | α-helix | trans | -62.6 | -47.6 | 177.9 | 178.3 | 0 | 0 | 0 | 0 | 110.5 | E92 S98 I99 F100 | E92-V96 WeakPolarHBondContact O-CG2 2.99Å; V96-S98 VanDerWaalsContact C-N 3.31Å; V96-S98 PolarHBondContact O-N 3.19Å; V96-I99 PolarHBondContact O-N 2.79Å; V96-F100 WeakPolarHBondContact O-CB 3.4Å; V96-F100 PolarHBondContact O-N 2.84Å |
| 97 | G | 85.1 | Confident | 83.9 | Confident | 1 Ų | 1 | 87.9 Ų | 87.9 | 1% | 0.01 | 44% | 0.441 | C | S | . | . | H | α-helix | trans | -59.5 | -40.6 | 176.9 | 0 | 0 | 0 | 0 | 0 | 112.6 | F93 F100 F101 | F93-G97 PolarHBondContact O-N 3.32Å; G97-F100 PolarHBondContact O-N 3.04Å; G97-F101 VanDerWaalsContact O-CB 3.24Å; G97-F101 WeakPolarHBondContact O-CB 3.22Å; G97-F101 PolarHBondContact O-N 3.5Å |
| 98 | S | 88.4 | Confident | 84.1 | Confident | 63 Ų | 63 | 85.6 Ų | 85.6 | 44% | 0.441 | 43% | 0.428 | S | S | . | . | H | α-helix | trans | -64.5 | -45 | 176.3 | -176.1 | 0 | 0 | 0 | 0 | 112.3 | K94 I95 V96 F100 F101 A102 | K94-S98 WeakPolarHBondContact O-CB 3.48Å; K94-S98 PolarHBondContact O-N 3.49Å; I95-S98 PolarHBondContact O-N 2.95Å; V96-S98 VanDerWaalsContact C-N 3.31Å; V96-S98 PolarHBondContact O-N 3.19Å; S98-F100 VanDerWaalsContact C-N 3.34Å; S98-F100 PolarHBondContact O-N 3.47Å; S98-F101 PolarHBondContact O-N 3.44Å; S98-A102 VanDerWaalsContact O-CB 3.31Å; S98-A102 WeakPolarHBondContact O-CB 3.36Å; S98-A102 PolarHBondContact O-N 3.37Å |
| 99 | I | 91 | Very high | 85 | Confident | 93 Ų | 93 | 87.5 Ų | 87.5 | 48% | 0.477 | 44% | 0.44 | S | S | . | . | H | α-helix | trans | -61.9 | -45.6 | 176.3 | -65.5 | 162.4 | 0 | 0 | 0 | 109.9 | I95 V96 F101 A102 V103 | I95-I99 HydrophobicContact CD1-CD1 4.17Å; I95-I99 HydrophobicContact CD1-CG1 4.38Å; I95-I99 HydrophobicContact CG1-CD1 3.96Å; I95-I99 VanDerWaalsContact O-CG1 3.3Å; I95-I99 WeakPolarHBondContact O-CG1 2.94Å; I95-I99 PolarHBondContact O-N 2.88Å; V96-I99 PolarHBondContact O-N 2.79Å; I99-F101 VanDerWaalsContact C-N 3.33Å; I99-F101 PolarHBondContact O-N 3.33Å; I99-A102 PolarHBondContact O-N 2.8Å; I99-V103 HydrophobicContact CG2-CG2 4.44Å; I99-V103 WeakPolarHBondContact O-CB 3.11Å; I99-V103 VanDerWaalsContact O-CG2 3.28Å; I99-V103 WeakPolarHBondContact O-CG2 3.05Å; I99-V103 PolarHBondContact O-N 3.48Å |
| 100 | F | 90.5 | Very high | 85.9 | Confident | 89 Ų | 89 | 80.3 Ų | 80.3 | 39% | 0.39 | 42% | 0.418 | S | S | . | . | H | α-helix | trans | -62.6 | -41.4 | 178.4 | -129.3 | -109.8 | 0 | 0 | 0 | 112 | L77 V96 G97 S98 G104 | L77-F100 HydrophobicContact CD2-CD1 4Å; L77-F100 HydrophobicContact CD2-CE1 3.28Å; L77-F100 HydrophobicContact CD2-CZ 3.67Å; V96-F100 WeakPolarHBondContact O-CB 3.4Å; V96-F100 PolarHBondContact O-N 2.84Å; G97-F100 PolarHBondContact O-N 3.04Å; S98-F100 VanDerWaalsContact C-N 3.34Å; S98-F100 PolarHBondContact O-N 3.47Å; F100-G104 PolarHBondContact O-N 2.73Å |
| 101 | F | 90.2 | Very high | 86.3 | Confident | 94 Ų | 94 | 74 Ų | 74 | 41% | 0.412 | 39% | 0.39 | S | S | . | . | H | α-helix | trans | -64.2 | -45.6 | 174.6 | -176.9 | -98.1 | 0 | 0 | 0 | 111.5 | V78 S81 G97 S98 I99 V103 G104 L105 | V78-F101 HydrophobicContact CG1-CD2 4.31Å; V78-F101 HydrophobicContact CG1-CE2 4.06Å; S81-F101 WeakPolarHBondContact OG-CA 3.26Å; G97-F101 VanDerWaalsContact O-CB 3.24Å; G97-F101 WeakPolarHBondContact O-CB 3.22Å; G97-F101 PolarHBondContact O-N 3.5Å; S98-F101 PolarHBondContact O-N 3.44Å; I99-F101 VanDerWaalsContact C-N 3.33Å; I99-F101 PolarHBondContact O-N 3.33Å; F101-V103 PolarHBondContact O-N 2.61Å; F101-G104 PolarHBondContact O-N 3.39Å; F101-L105 HydrophobicContact CE1-CD1 3.99Å; F101-L105 HydrophobicContact CZ-CD1 3.96Å; F101-L105 WeakPolarHBondContact O-CB 3.36Å; F101-L105 PolarHBondContact O-N 2.71Å |
| 102 | A | 91.5 | Very high | 86.5 | Confident | 47 Ų | 47 | 69.9 Ų | 69.9 | 39% | 0.388 | 37% | 0.374 | S | S | . | . | H | α-helix | trans | -62.7 | -41.4 | 178.7 | 0 | 0 | 0 | 0 | 0 | 111.9 | S98 I99 S106 | S98-A102 VanDerWaalsContact O-CB 3.31Å; S98-A102 WeakPolarHBondContact O-CB 3.36Å; S98-A102 PolarHBondContact O-N 3.37Å; I99-A102 PolarHBondContact O-N 2.8Å; A102-S106 VanDerWaalsContact O-CB 3.31Å; A102-S106 WeakPolarHBondContact O-CB 3.3Å; A102-S106 PolarHBondContact O-N 2.97Å; A102-S106 PolarHBondContact O-OG 3.16Å |
| 103 | V | 91.4 | Very high | 86.5 | Confident | 64 Ų | 64 | 68 Ų | 68 | 39% | 0.388 | 36% | 0.363 | S | S | . | . | H | α-helix | trans | -65.9 | -48.4 | 175.1 | 172.5 | 0 | 0 | 0 | 0 | 110.5 | L77 I99 F101 L105 S106 F107 | L77-V103 HydrophobicContact CD1-CG1 4.47Å; I99-V103 HydrophobicContact CG2-CG2 4.44Å; I99-V103 WeakPolarHBondContact O-CB 3.11Å; I99-V103 VanDerWaalsContact O-CG2 3.28Å; I99-V103 WeakPolarHBondContact O-CG2 3.05Å; I99-V103 PolarHBondContact O-N 3.48Å; F101-V103 PolarHBondContact O-N 2.61Å; V103-L105 VanDerWaalsContact C-N 3.34Å; V103-L105 PolarHBondContact O-N 2.97Å; V103-S106 WeakPolarHBondContact O-CB 3.31Å; V103-S106 PolarHBondContact O-N 3.26Å; V103-S106 VanDerWaalsContact O-N 3.15Å; V103-F107 HydrophobicContact CG1-CD2 3.73Å; V103-F107 HydrophobicContact CG1-CE2 3.51Å; V103-F107 WeakPolarHBondContact O-CD2 3.4Å; V103-F107 PolarHBondContact O-N 3.48Å |
| 104 | G | 90.6 | Very high | 86.3 | Confident | 0 Ų | 0 | 67.8 Ų | 67.8 | 0% | 0 | 37% | 0.366 | C | S | . | . | H | α-helix | trans | -59.9 | -42.3 | 177.1 | 0 | 0 | 0 | 0 | 0 | 112.8 | V78 F100 F101 F107 C108 | V78-G104 VanDerWaalsContact CG2-C 3.45Å; F100-G104 PolarHBondContact O-N 2.73Å; F101-G104 PolarHBondContact O-N 3.39Å; G104-F107 PolarHBondContact O-N 3.33Å; G104-C108 PolarHBondContact O-N 3.17Å |
| 105 | L | 90.3 | Very high | 86 | Confident | 78 Ų | 78 | 67.1 Ų | 67.1 | 41% | 0.408 | 36% | 0.364 | S | S | . | . | H | α-helix | trans | -63.8 | -41.4 | 174.6 | -165.7 | 111.3 | 0 | 0 | 0 | 111.1 | F101 V103 F107 C108 L109 | F101-L105 HydrophobicContact CE1-CD1 3.99Å; F101-L105 HydrophobicContact CZ-CD1 3.96Å; F101-L105 WeakPolarHBondContact O-CB 3.36Å; F101-L105 PolarHBondContact O-N 2.71Å; V103-L105 VanDerWaalsContact C-N 3.34Å; V103-L105 PolarHBondContact O-N 2.97Å; L105-F107 PolarHBondContact O-N 3.5Å; L105-C108 WeakPolarHBondContact O-CB 3.17Å; L105-C108 PolarHBondContact O-N 3.19Å; L105-L109 HydrophobicContact CD2-CD1 3.97Å; L105-L109 WeakPolarHBondContact O-CB 3.35Å; L105-L109 WeakPolarHBondContact O-CG 3.35Å; L105-L109 PolarHBondContact O-N 2.76Å |
| 106 | S | 90 | Very high | 85.4 | Confident | 70 Ų | 70 | 68.7 Ų | 68.7 | 49% | 0.49 | 36% | 0.363 | S | S | . | . | H | α-helix | trans | -62.3 | -41.6 | 175.6 | -60.8 | 0 | 0 | 0 | 0 | 111.9 | A102 V103 L109 L110 | A102-S106 VanDerWaalsContact O-CB 3.31Å; A102-S106 WeakPolarHBondContact O-CB 3.3Å; A102-S106 PolarHBondContact O-N 2.97Å; A102-S106 PolarHBondContact O-OG 3.16Å; V103-S106 WeakPolarHBondContact O-CB 3.31Å; V103-S106 PolarHBondContact O-N 3.26Å; V103-S106 VanDerWaalsContact O-N 3.15Å; S106-L109 PolarHBondContact O-N 3.4Å; S106-L110 WeakPolarHBondContact O-CB 3.34Å; S106-L110 PolarHBondContact O-N 2.76Å |
| 107 | F | 89.5 | Confident | 84.6 | Confident | 65 Ų | 65 | 74 Ų | 74 | 29% | 0.285 | 38% | 0.379 | S | S | . | . | H | α-helix | trans | -63.1 | -41.7 | 172.6 | -82.2 | -71.4 | 0 | 0 | 0 | 111.9 | F70 L77 V103 G104 L105 L110 C111 | F70-F107 AromaticContact CD1-CD1 3.76Å; F70-F107 HydrophobicContact CD1-CD1 3.76Å; F70-F107 AromaticContact CD1-CE1 3.92Å; F70-F107 HydrophobicContact CD1-CE1 3.92Å; F70-F107 HydrophobicContact CE1-CD1 4.15Å; F70-F107 AromaticContact CE1-CE1 3.85Å; F70-F107 HydrophobicContact CE1-CE1 3.85Å; L77-F107 HydrophobicContact CD1-CD2 4.13Å; L77-F107 HydrophobicContact CD1-CE2 4.39Å; V103-F107 HydrophobicContact CG1-CD2 3.73Å; V103-F107 HydrophobicContact CG1-CE2 3.51Å; V103-F107 WeakPolarHBondContact O-CD2 3.4Å; V103-F107 PolarHBondContact O-N 3.48Å; G104-F107 PolarHBondContact O-N 3.33Å; L105-F107 PolarHBondContact O-N 3.5Å; F107-L110 PolarHBondContact O-N 3.33Å; F107-C111 PolarHBondContact O-N 2.99Å; F107-C111 PolarHBondContact O-SG 3.47Å |
| 108 | C | 86 | Confident | 83.8 | Confident | 53 Ų | 53 | 79.6 Ų | 79.6 | 36% | 0.358 | 41% | 0.409 | S | S | . | . | H | α-helix | trans | -61.1 | -46.7 | 175.1 | -171.1 | 0 | 0 | 0 | 0 | 111.5 | G104 L105 L110 C111 V112 | G104-C108 PolarHBondContact O-N 3.17Å; L105-C108 WeakPolarHBondContact O-CB 3.17Å; L105-C108 PolarHBondContact O-N 3.19Å; C108-L110 VanDerWaalsContact C-N 3.31Å; C108-L110 PolarHBondContact O-N 3.38Å; C108-C111 WeakPolarHBondContact O-CB 3.5Å; C108-C111 PolarHBondContact O-N 3.44Å; C108-C111 VanDerWaalsContact O-N 3.17Å; C108-V112 WeakPolarHBondContact O-CG2 3.35Å; C108-V112 PolarHBondContact O-N 2.86Å |
| 109 | L | 85.6 | Confident | 82.7 | Confident | 103 Ų | 103 | 79.2 Ų | 79.2 | 54% | 0.539 | 40% | 0.402 | S | S | . | . | H | α-helix | trans | -61.7 | -38.5 | 174.8 | -71.4 | 175.9 | 0 | 0 | 0 | 111.8 | L105 S106 V112 F113 | L105-L109 HydrophobicContact CD2-CD1 3.97Å; L105-L109 WeakPolarHBondContact O-CB 3.35Å; L105-L109 WeakPolarHBondContact O-CG 3.35Å; L105-L109 PolarHBondContact O-N 2.76Å; S106-L109 PolarHBondContact O-N 3.4Å; L109-V112 WeakPolarHBondContact O-CB 3.24Å; L109-V112 PolarHBondContact O-N 3Å; L109-F113 VanDerWaalsContact O-CB 3.24Å; L109-F113 WeakPolarHBondContact O-CB 3.49Å; L109-F113 PolarHBondContact O-N 2.84Å |
| 110 | L | 84.4 | Confident | 81.7 | Confident | 83 Ų | 83 | 79.1 Ų | 79.1 | 44% | 0.435 | 41% | 0.405 | S | S | . | . | H | α-helix | trans | -66.7 | -38.4 | 176.3 | -161.3 | 68.1 | 0 | 0 | 0 | 111 | S106 F107 C108 V112 F113 L114 | S106-L110 WeakPolarHBondContact O-CB 3.34Å; S106-L110 PolarHBondContact O-N 2.76Å; F107-L110 PolarHBondContact O-N 3.33Å; C108-L110 VanDerWaalsContact C-N 3.31Å; C108-L110 PolarHBondContact O-N 3.38Å; L110-V112 PolarHBondContact O-N 3.4Å; L110-F113 CarbonylContact O-C 3.58Å; L110-F113 PolarHBondContact O-N 2.82Å; L110-L114 WeakPolarHBondContact O-CB 3.47Å; L110-L114 WeakPolarHBondContact O-CG 2.91Å; L110-L114 PolarHBondContact O-N 3.33Å |
| 111 | C | 83.4 | Confident | 80.9 | Confident | 0 Ų | 0 | 82.2 Ų | 82.2 | 0% | 0 | 42% | 0.419 | C | S | . | . | H | α-helix | trans | -61.5 | -43.5 | 173 | -64.7 | 0 | 0 | 0 | 0 | 112.1 | F70 L71 F107 C108 F113 Q115 | F70-C111 WeakPolarHBondContact CB-SG 3.31Å; L71-C111 HydrophobicContact CD2-CB 3.37Å; L71-C111 HydrophobicContact CG-CB 3.72Å; L71-C111 PolarHBondContact N-SG 3.28Å; L71-C111 VanDerWaalsContact N-SG 3.41Å; F107-C111 PolarHBondContact O-N 2.99Å; F107-C111 PolarHBondContact O-SG 3.47Å; C108-C111 WeakPolarHBondContact O-CB 3.5Å; C108-C111 PolarHBondContact O-N 3.44Å; C108-C111 VanDerWaalsContact O-N 3.17Å; C111-F113 VanDerWaalsContact C-N 3.32Å; C111-Q115 WeakPolarHBondContact O-CG 3.4Å; C111-Q115 PolarHBondContact O-N 3.26Å; C111-Q115 VanDerWaalsContact O-N 3.16Å; C111-Q115 PolarHBondContact O-NE2 2.96Å |
| 112 | V | 78.8 | Confident | 79.7 | Confident | 56 Ų | 56 | 82.5 Ų | 82.5 | 34% | 0.339 | 42% | 0.424 | S | S | . | . | H | α-helix | trans | -63.6 | -39.8 | 173.8 | 170 | 0 | 0 | 0 | 0 | 110.4 | C108 L109 L110 Q115 R116 L119 | C108-V112 WeakPolarHBondContact O-CG2 3.35Å; C108-V112 PolarHBondContact O-N 2.86Å; L109-V112 WeakPolarHBondContact O-CB 3.24Å; L109-V112 PolarHBondContact O-N 3Å; L110-V112 PolarHBondContact O-N 3.4Å; V112-Q115 CarbonylContact O-C 3.57Å; V112-Q115 WeakPolarHBondContact O-CA 3.4Å; V112-Q115 WeakPolarHBondContact O-CB 3.27Å; V112-Q115 PolarHBondContact O-N 3.3Å; V112-R116 PolarHBondContact O-N 2.9Å; V112-L119 HydrophobicContact CB-CD1 4.43Å; V112-L119 HydrophobicContact CG1-CD1 3.64Å; V112-L119 HydrophobicContact CG1-CD2 4.22Å |
| 113 | F | 79.8 | Confident | 78.8 | Confident | 116 Ų | 116 | 87.8 Ų | 87.8 | 51% | 0.509 | 44% | 0.435 | S | S | . | . | H | α-helix | trans | -73 | -37.3 | -179.2 | -167.7 | -85.5 | 0 | 0 | 0 | 113 | L109 L110 C111 Q115 R116 | L109-F113 VanDerWaalsContact O-CB 3.24Å; L109-F113 WeakPolarHBondContact O-CB 3.49Å; L109-F113 PolarHBondContact O-N 2.84Å; L110-F113 CarbonylContact O-C 3.58Å; L110-F113 PolarHBondContact O-N 2.82Å; C111-F113 VanDerWaalsContact C-N 3.32Å; F113-Q115 PolarHBondContact O-N 2.71Å; F113-R116 WeakPolarHBondContact O-CA 3.21Å; F113-R116 WeakPolarHBondContact O-CB 3.5Å; F113-R116 PolarHBondContact O-N 3.25Å |
| 114 | L | 75.1 | Confident | 78.1 | Confident | 79 Ų | 79 | 90.6 Ų | 90.6 | 41% | 0.414 | 44% | 0.444 | S | S | . | . | H | α-helix | trans | -63.4 | -34.7 | 172.2 | -72.7 | 171.8 | 0 | 0 | 0 | 110.3 | V67 F70 L110 R116 | V67-L114 HydrophobicContact CG2-CB 4.03Å; V67-L114 HydrophobicContact CG2-CD1 4.46Å; F70-L114 HydrophobicContact CD2-CD1 4.36Å; L110-L114 WeakPolarHBondContact O-CB 3.47Å; L110-L114 WeakPolarHBondContact O-CG 2.91Å; L110-L114 PolarHBondContact O-N 3.33Å; L114-R116 VanDerWaalsContact C-N 3.27Å; L114-R116 PolarHBondContact O-N 2.71Å |
| 115 | Q | 74.5 | Confident | 77.5 | Confident | 69 Ų | 69 | 95.4 Ų | 95.4 | 32% | 0.322 | 47% | 0.466 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -76.7 | -6.7 | 169.3 | -67.9 | 178.1 | 66.9 | 0 | 0 | 113.3 | V67 C111 V112 F113 K117 N118 L119 | V67-Q115 HydrophobicContact CG1-CG 3.94Å; V67-Q115 HydrophobicContact CG2-CG 4.24Å; C111-Q115 WeakPolarHBondContact O-CG 3.4Å; C111-Q115 PolarHBondContact O-N 3.26Å; C111-Q115 VanDerWaalsContact O-N 3.16Å; C111-Q115 PolarHBondContact O-NE2 2.96Å; V112-Q115 CarbonylContact O-C 3.57Å; V112-Q115 WeakPolarHBondContact O-CA 3.4Å; V112-Q115 WeakPolarHBondContact O-CB 3.27Å; V112-Q115 PolarHBondContact O-N 3.3Å; F113-Q115 PolarHBondContact O-N 2.71Å; Q115-K117 PolarHBondContact O-N 2.8Å; Q115-N118 CarbonylContact O-C 3.35Å; Q115-N118 VanDerWaalsContact O-CA 3.27Å; Q115-N118 WeakPolarHBondContact O-CA 3.47Å; Q115-N118 WeakPolarHBondContact O-CB 3.28Å; Q115-N118 PolarHBondContact O-N 3.36Å; Q115-L119 HydrophobicContact CB-CB 4.45Å; Q115-L119 PolarHBondContact O-N 2.84Å |
| 116 | R | 71.5 | Confident | 76.8 | Confident | 135 Ų | 135 | 96.6 Ų | 96.6 | 51% | 0.509 | 47% | 0.472 | S | S | . | . | H | α-helix | trans | -52.7 | -35 | -169.5 | -171.3 | 175.1 | -174.6 | -165.5 | 2.9 | 114.4 | V112 F113 L114 N118 L119 V120 | V112-R116 PolarHBondContact O-N 2.9Å; F113-R116 WeakPolarHBondContact O-CA 3.21Å; F113-R116 WeakPolarHBondContact O-CB 3.5Å; F113-R116 PolarHBondContact O-N 3.25Å; L114-R116 VanDerWaalsContact C-N 3.27Å; L114-R116 PolarHBondContact O-N 2.71Å; R116-N118 VanDerWaalsContact C-N 3.25Å; R116-N118 PolarHBondContact O-N 3.35Å; R116-L119 PolarHBondContact O-N 3.01Å; R116-V120 HydrophobicContact CG-CG2 3.94Å; R116-V120 WeakPolarHBondContact O-CB 3.4Å; R116-V120 VanDerWaalsContact O-CG2 3.23Å; R116-V120 WeakPolarHBondContact O-CG2 3.33Å; R116-V120 PolarHBondContact O-N 2.91Å |
| 117 | K | 68.9 | Low | 76.3 | Confident | 196 Ų | 196 | 96.1 Ų | 96.1 | 85% | 0.852 | 46% | 0.464 | S | S | * | . | H | α-helix | trans | -63.9 | -32.7 | 174.4 | -74.6 | -175.7 | 168.5 | 172.8 | 0 | 112.6 | Q115 | Q115-K117 PolarHBondContact O-N 2.8Å |
| 118 | N | 68.8 | Low | 75.7 | Confident | 119 Ų | 119 | 97 Ų | 97 | 64% | 0.636 | 47% | 0.472 | S | S | * | . | H | α-helix | trans | -89.7 | -31.3 | 172.7 | -62.7 | -66.3 | 0 | 0 | 0 | 112.7 | Q115 R116 K121 L122 | Q115-N118 CarbonylContact O-C 3.35Å; Q115-N118 VanDerWaalsContact O-CA 3.27Å; Q115-N118 WeakPolarHBondContact O-CA 3.47Å; Q115-N118 WeakPolarHBondContact O-CB 3.28Å; Q115-N118 PolarHBondContact O-N 3.36Å; R116-N118 VanDerWaalsContact C-N 3.25Å; R116-N118 PolarHBondContact O-N 3.35Å; N118-K121 WeakPolarHBondContact O-CB 3.22Å; N118-K121 PolarHBondContact O-N 2.94Å; N118-L122 PolarHBondContact O-N 2.75Å |
| 119 | L | 65.1 | Low | 75.4 | Confident | 55 Ų | 55 | 99.9 Ų | 99.9 | 29% | 0.288 | 48% | 0.48 | S | S | . | . | H | α-helix | trans | -79.3 | -29.8 | -175.9 | -166.3 | 138.3 | 0 | 0 | 0 | 112.8 | V112 Q115 R116 K121 L122 Y123 | V112-L119 HydrophobicContact CB-CD1 4.43Å; V112-L119 HydrophobicContact CG1-CD1 3.64Å; V112-L119 HydrophobicContact CG1-CD2 4.22Å; Q115-L119 HydrophobicContact CB-CB 4.45Å; Q115-L119 PolarHBondContact O-N 2.84Å; R116-L119 PolarHBondContact O-N 3.01Å; L119-K121 PolarHBondContact O-N 3.39Å; L119-L122 PolarHBondContact O-N 3.05Å; L119-Y123 VanDerWaalsContact O-CB 3.23Å; L119-Y123 WeakPolarHBondContact O-CB 3.36Å; L119-Y123 PolarHBondContact O-N 2.97Å |
| 120 | V | 69.3 | Low | 75 | Confident | 90 Ų | 90 | 98.8 Ų | 98.8 | 55% | 0.545 | 48% | 0.477 | S | S | . | . | H | α-helix | trans | -61.7 | -39.1 | 167.5 | 170.2 | 0 | 0 | 0 | 0 | 109.8 | R116 H124 | R116-V120 HydrophobicContact CG-CG2 3.94Å; R116-V120 WeakPolarHBondContact O-CB 3.4Å; R116-V120 VanDerWaalsContact O-CG2 3.23Å; R116-V120 WeakPolarHBondContact O-CG2 3.33Å; R116-V120 PolarHBondContact O-N 2.91Å; V120-H124 WeakPolarHBondContact O-CB 3.23Å; V120-H124 PolarHBondContact O-N 3.46Å |
| 121 | K | 73.6 | Confident | 74.5 | Confident | 154 Ų | 154 | 100.2 Ų | 100.2 | 67% | 0.67 | 48% | 0.48 | S | S | * | . | H | α-helix | trans | -66.6 | -43.7 | 175 | -166.1 | 172.9 | -177.9 | 175.5 | 0 | 111.4 | N118 L119 H124 E125 | N118-K121 WeakPolarHBondContact O-CB 3.22Å; N118-K121 PolarHBondContact O-N 2.94Å; L119-K121 PolarHBondContact O-N 3.39Å; K121-H124 PolarHBondContact O-N 3.42Å; K121-E125 WeakPolarHBondContact O-CB 3.4Å; K121-E125 PolarHBondContact O-N 3.47Å |
| 122 | L | 66.5 | Low | 73.9 | Confident | 100 Ų | 100 | 108.8 Ų | 108.8 | 52% | 0.524 | 51% | 0.512 | S | S | . | . | H | α-helix | trans | -66.3 | -39.8 | 176.7 | -172.7 | 67.4 | 0 | 0 | 0 | 112.9 | N118 L119 E125 L126 | N118-L122 PolarHBondContact O-N 2.75Å; L119-L122 PolarHBondContact O-N 3.05Å; L122-E125 PolarHBondContact O-N 2.73Å; L122-L126 VanDerWaalsContact O-CB 3.28Å; L122-L126 WeakPolarHBondContact O-CB 3.41Å; L122-L126 PolarHBondContact O-N 3.31Å |
| 123 | Y | 72.8 | Confident | 73.7 | Confident | 159 Ų | 159 | 114.6 Ų | 114.6 | 62% | 0.624 | 53% | 0.533 | S | S | * | . | H | α-helix | trans | -67 | -40.1 | 178.1 | -173.6 | -86 | 0 | 0 | 0 | 110.9 | L119 L126 D127 | L119-Y123 VanDerWaalsContact O-CB 3.23Å; L119-Y123 WeakPolarHBondContact O-CB 3.36Å; L119-Y123 PolarHBondContact O-N 2.97Å; Y123-L126 PolarHBondContact O-N 3.32Å; Y123-D127 VanDerWaalsContact O-CB 3.28Å; Y123-D127 WeakPolarHBondContact O-CB 3.28Å; Y123-D127 PolarHBondContact O-N 2.77Å |
| 124 | H | 76.5 | Confident | 73.3 | Confident | 123 Ų | 123 | 118.1 Ų | 118.1 | 57% | 0.569 | 55% | 0.545 | S | S | * | . | H | α-helix | trans | -62.7 | -46.7 | 172.8 | -167.1 | -64.4 | 0 | 0 | 0 | 110.9 | V120 K121 L126 D127 D128 | V120-H124 WeakPolarHBondContact O-CB 3.23Å; V120-H124 PolarHBondContact O-N 3.46Å; K121-H124 PolarHBondContact O-N 3.42Å; H124-L126 VanDerWaalsContact C-N 3.33Å; H124-L126 PolarHBondContact O-N 2.82Å; H124-D127 PolarHBondContact O-N 3.42Å; H124-D128 IonicContact CE1-OD2 3.04Å; H124-D128 PolarHBondContact CE1-OD2 2.87Å; H124-D128 IonicContact CG-OD2 4Å; H124-D128 IonicContact ND1-OD2 2.76Å; H124-D128 PolarHBondContact ND1-OD2 2.9Å; H124-D128 PolarHBondContact O-N 2.95Å; H124-D128 VanDerWaalsContact O-OD2 3.06Å |
| 125 | E | 76.2 | Confident | 73 | Confident | 100 Ų | 100 | 122.2 Ų | 122.2 | 47% | 0.467 | 56% | 0.556 | S | S | . | * | H | α-helix | trans | -61 | -41.3 | 176.9 | -165.4 | 176.8 | 97.1 | 0 | 0 | 111.6 | K121 L122 D128 H129 | K121-E125 WeakPolarHBondContact O-CB 3.4Å; K121-E125 PolarHBondContact O-N 3.47Å; L122-E125 PolarHBondContact O-N 2.73Å; E125-D128 PolarHBondContact O-N 3.46Å; E125-H129 PolarHBondContact O-CD2 2.95Å; E125-H129 PolarHBondContact O-N 2.96Å |
| 126 | L | 76.2 | Confident | 72.3 | Confident | 104 Ų | 104 | 124.6 Ų | 124.6 | 55% | 0.545 | 58% | 0.577 | S | S | . | * | H | α-helix | trans | -70.5 | -39.3 | 177.5 | -163 | 73.3 | 0 | 0 | 0 | 112.3 | L122 Y123 H124 D128 H129 V130 | L122-L126 VanDerWaalsContact O-CB 3.28Å; L122-L126 WeakPolarHBondContact O-CB 3.41Å; L122-L126 PolarHBondContact O-N 3.31Å; Y123-L126 PolarHBondContact O-N 3.32Å; H124-L126 VanDerWaalsContact C-N 3.33Å; H124-L126 PolarHBondContact O-N 2.82Å; L126-D128 VanDerWaalsContact C-N 3.34Å; L126-H129 PolarHBondContact O-N 2.87Å; L126-V130 HydrophobicContact CG-CG2 4.29Å; L126-V130 WeakPolarHBondContact O-CB 3.23Å; L126-V130 VanDerWaalsContact O-CG2 3.22Å; L126-V130 WeakPolarHBondContact O-CG2 3.36Å; L126-V130 PolarHBondContact O-N 3.37Å |
| 127 | D | 80.8 | Confident | 71.7 | Confident | 60 Ų | 60 | 121.3 Ų | 121.3 | 32% | 0.321 | 59% | 0.585 | S | S | . | * | H | α-helix | trans | -61.9 | -42.6 | 174.1 | -176.7 | -104.8 | 0 | 0 | 0 | 110.9 | Y123 H124 V130 K131 | Y123-D127 VanDerWaalsContact O-CB 3.28Å; Y123-D127 WeakPolarHBondContact O-CB 3.28Å; Y123-D127 PolarHBondContact O-N 2.77Å; H124-D127 PolarHBondContact O-N 3.42Å; D127-V130 PolarHBondContact O-N 3.23Å; D127-K131 VanDerWaalsContact O-CB 3.29Å; D127-K131 WeakPolarHBondContact O-CB 3.21Å; D127-K131 WeakPolarHBondContact O-CG 3.32Å; D127-K131 PolarHBondContact O-N 3.35Å; D127-K131 VanDerWaalsContact OD1-CE 3.3Å; D127-K131 WeakPolarHBondContact OD1-CE 3.37Å; D127-K131 IonicContact OD1-NZ 2.68Å; D127-K131 PolarHBondContact OD1-NZ 3.48Å; D127-K131 IonicContact OD2-NZ 3.82Å |
| 128 | D | 76.4 | Confident | 71.3 | Confident | 84 Ų | 84 | 117.1 Ų | 117.1 | 45% | 0.449 | 58% | 0.581 | S | S | . | * | H | α-helix | trans | -60.4 | -45.2 | 172.4 | -82.9 | -61.4 | 0 | 0 | 0 | 111.7 | H124 E125 L126 R132 | H124-D128 IonicContact CE1-OD2 3.04Å; H124-D128 PolarHBondContact CE1-OD2 2.87Å; H124-D128 IonicContact CG-OD2 4Å; H124-D128 IonicContact ND1-OD2 2.76Å; H124-D128 PolarHBondContact ND1-OD2 2.9Å; H124-D128 PolarHBondContact O-N 2.95Å; H124-D128 VanDerWaalsContact O-OD2 3.06Å; E125-D128 PolarHBondContact O-N 3.46Å; L126-D128 VanDerWaalsContact C-N 3.34Å; D128-R132 WeakPolarHBondContact O-CB 3.29Å; D128-R132 PolarHBondContact O-N 3.26Å |
| 129 | H | 78.3 | Confident | 70.6 | Confident | 112 Ų | 112 | 116.8 Ų | 116.8 | 52% | 0.519 | 59% | 0.587 | S | S | . | * | H | α-helix | trans | -68.4 | -41.2 | 178.5 | -78.1 | -62.1 | 0 | 0 | 0 | 113.2 | E125 L126 R132 F133 | E125-H129 PolarHBondContact O-CD2 2.95Å; E125-H129 PolarHBondContact O-N 2.96Å; L126-H129 PolarHBondContact O-N 2.87Å; H129-R132 PolarHBondContact O-N 3.32Å; H129-F133 WeakPolarHBondContact O-CB 3.24Å; H129-F133 PolarHBondContact O-N 2.94Å |
| 130 | V | 77.2 | Confident | 70 | Confident | 80 Ų | 80 | 122.7 Ų | 122.7 | 49% | 0.485 | 62% | 0.615 | S | S | . | * | H | α-helix | trans | -67.2 | -43.7 | 177.7 | 169.6 | 0 | 0 | 0 | 0 | 110.1 | L126 D127 R132 F133 Y134 | L126-V130 HydrophobicContact CG-CG2 4.29Å; L126-V130 WeakPolarHBondContact O-CB 3.23Å; L126-V130 VanDerWaalsContact O-CG2 3.22Å; L126-V130 WeakPolarHBondContact O-CG2 3.36Å; L126-V130 PolarHBondContact O-N 3.37Å; D127-V130 PolarHBondContact O-N 3.23Å; V130-R132 VanDerWaalsContact C-N 3.35Å; V130-R132 PolarHBondContact O-N 2.84Å; V130-F133 PolarHBondContact O-N 3.26Å; V130-Y134 WeakPolarHBondContact O-CB 3.47Å; V130-Y134 PolarHBondContact O-N 2.76Å |
| 131 | K | 75.4 | Confident | 69 | Low | 113 Ų | 113 | 129.7 Ų | 129.7 | 49% | 0.491 | 65% | 0.647 | S | S | . | * | H | α-helix | trans | -60.4 | -44.3 | 172.4 | -80.7 | 173.5 | 178.5 | 157.1 | 0 | 111.6 | D127 F133 Y134 Y135 | D127-K131 VanDerWaalsContact O-CB 3.29Å; D127-K131 WeakPolarHBondContact O-CB 3.21Å; D127-K131 WeakPolarHBondContact O-CG 3.32Å; D127-K131 PolarHBondContact O-N 3.35Å; D127-K131 VanDerWaalsContact OD1-CE 3.3Å; D127-K131 WeakPolarHBondContact OD1-CE 3.37Å; D127-K131 IonicContact OD1-NZ 2.68Å; D127-K131 PolarHBondContact OD1-NZ 3.48Å; D127-K131 IonicContact OD2-NZ 3.82Å; K131-F133 VanDerWaalsContact C-N 3.27Å; K131-F133 PolarHBondContact O-N 3.04Å; K131-Y134 PolarHBondContact O-N 2.68Å; K131-Y135 WeakPolarHBondContact O-CD2 3.41Å; K131-Y135 PolarHBondContact O-N 3.48Å |
| 132 | R | 69.9 | Low | 68.8 | Low | 180 Ų | 180 | 128.5 Ų | 128.5 | 68% | 0.679 | 65% | 0.646 | S | S | * | * | H | α-helix | trans | -63.1 | -33.5 | 177.1 | -172 | 170.5 | -175.1 | 123.7 | 3.1 | 112.7 | D128 H129 V130 Y135 | D128-R132 WeakPolarHBondContact O-CB 3.29Å; D128-R132 PolarHBondContact O-N 3.26Å; H129-R132 PolarHBondContact O-N 3.32Å; V130-R132 VanDerWaalsContact C-N 3.35Å; V130-R132 PolarHBondContact O-N 2.84Å; R132-Y135 CarbonylContact O-C 3.39Å |
| 133 | F | 74.3 | Confident | 68.9 | Low | 178 Ų | 178 | 130 Ų | 130 | 78% | 0.781 | 65% | 0.652 | S | S | * | * | H | α-helix | trans | -77.8 | -36.5 | 176.5 | -168.4 | -97.3 | 0 | 0 | 0 | 112.8 | H129 V130 K131 Y135 P136 | H129-F133 WeakPolarHBondContact O-CB 3.24Å; H129-F133 PolarHBondContact O-N 2.94Å; V130-F133 PolarHBondContact O-N 3.26Å; K131-F133 VanDerWaalsContact C-N 3.27Å; K131-F133 PolarHBondContact O-N 3.04Å; F133-Y135 VanDerWaalsContact C-N 3.35Å; F133-P136 WeakPolarHBondContact O-CD 3.46Å |
| 134 | Y | 71.5 | Confident | 68.7 | Low | 190 Ų | 190 | 128.4 Ų | 128.4 | 75% | 0.745 | 65% | 0.654 | S | S | * | * | H | α-helix | trans | -76.4 | -22.1 | 178.4 | -144.2 | -93.6 | 0 | 0 | 0 | 112.8 | V130 K131 P136 | V130-Y134 WeakPolarHBondContact O-CB 3.47Å; V130-Y134 PolarHBondContact O-N 2.76Å; K131-Y134 PolarHBondContact O-N 2.68Å; Y134-P136 VanDerWaalsContact O-CD 3.24Å; Y134-P136 WeakPolarHBondContact O-CD 3.3Å |
| 135 | Y | 69.5 | Low | 68.2 | Low | 166 Ų | 166 | 128.7 Ų | 128.7 | 65% | 0.651 | 66% | 0.659 | S | S | * | * | trans | -113.6 | 68.5 | 171.6 | -68.7 | -86 | 0 | 0 | 0 | 111.9 | K131 R132 F133 G137 | K131-Y135 WeakPolarHBondContact O-CD2 3.41Å; K131-Y135 PolarHBondContact O-N 3.48Å; R132-Y135 CarbonylContact O-C 3.39Å; F133-Y135 VanDerWaalsContact C-N 3.35Å; Y135-G137 PolarHBondContact O-N 2.99Å | ||
| 136 | P | 59.7 | Low | 67.7 | Low | 119 Ų | 119 | 130.5 Ų | 130.5 | 77% | 0.773 | 67% | 0.67 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -70.4 | 3.2 | -179.1 | 30.3 | -34.9 | 0 | 0 | 0 | 114.1 | F133 Y134 | F133-P136 WeakPolarHBondContact O-CD 3.46Å; Y134-P136 VanDerWaalsContact O-CD 3.24Å; Y134-P136 WeakPolarHBondContact O-CD 3.3Å |
| 137 | G | 59.9 | Low | 67.2 | Low | 66 Ų | 66 | 132.3 Ų | 132.3 | 68% | 0.68 | 68% | 0.679 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -110.6 | 2.3 | -165.1 | 0 | 0 | 0 | 0 | 0 | 117.7 | Y135 | Y135-G137 PolarHBondContact O-N 2.99Š|
| 138 | S | 58.8 | Low | 66.2 | Low | 108 Ų | 108 | 137.4 Ų | 137.4 | 76% | 0.755 | 70% | 0.704 | S | S | * | * | S | Bend | trans | -102.1 | 7.2 | -175.4 | -59.1 | 0 | 0 | 0 | 0 | 115.2 | ||
| 139 | C | 55 | Low | 65.4 | Low | 112 Ų | 112 | 141.5 Ų | 141.5 | 76% | 0.757 | 72% | 0.724 | S | S | * | * | S | Bend | trans | -119.8 | 46.3 | -180 | -125.3 | 0 | 0 | 0 | 0 | 111.5 | ||
| 140 | M | 51.6 | Low | 64.3 | Low | 179 Ų | 179 | 144 Ų | 144 | 88% | 0.882 | 74% | 0.741 | S | S | * | * | trans | -143.3 | 56.4 | 173.7 | -144.8 | -176.9 | 99.9 | 0 | 0 | 110.1 | ||||
| 141 | I | 49 | Very low | 63.1 | Low | 237 Ų | 237 | 149.8 Ų | 149.8 | 100% | 1.215 | 77% | 0.765 | S | S | * | * | trans | -141.7 | 0 | 163.6 | -58.9 | 175.9 | 0 | 0 | 0 | 105.3 |
Retrieved 141 of 141 residues in 430.6 ms
(Link to these results)