| Site | Residue | pLDDT | pLDDT confidence | pLDDT10 | pLDDT10 confidence | SASA | SASA [Ų] | SASA10 | SASA10 [Ų] | RSA | RSA unformatted | RSA10 | RSA10 unformatted | Surface | Surface10 (not used) | Disorder (not used) | Disorder | Sec. str. | Secondary structure | Isomer | Phi (φ) | Psi (ψ) | Omega (ω) | Chi 1 (χ1) | Chi 2 (χ2) | Chi 3 (χ3) | Chi 4 (χ4) | Chi 5 (χ5) | Tau (τ) | Contacts (colored by PAE) | Contact details |
|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|
| 1 | M | 45.4 | Very low | 47.7 | Very low | 240 Ų | 240 | 141.1 Ų | 141.1 | 100% | 1.182 | 88% | 0.877 | S | S | * | * | 0 | 114.4 | 0 | -67.1 | -159.9 | 83.7 | 0 | 0 | 109.4 | |||||
| 2 | P | 51.8 | Low | 46.8 | Very low | 137 Ų | 137 | 135.7 Ų | 135.7 | 89% | 0.89 | 87% | 0.87 | S | S | * | * | trans | -101.2 | 115.8 | 165.8 | 31.5 | -20.2 | 0 | 0 | 0 | 109.5 | ||||
| 3 | G | 41.7 | Very low | 46.6 | Very low | 77 Ų | 77 | 132.9 Ų | 132.9 | 79% | 0.794 | 87% | 0.866 | S | S | * | * | trans | -126.1 | 74.2 | 177.3 | 0 | 0 | 0 | 0 | 0 | 110.6 | ||||
| 4 | C | 49.6 | Very low | 46.2 | Very low | 129 Ų | 129 | 138 Ų | 138 | 87% | 0.872 | 87% | 0.873 | S | S | * | * | trans | -114.5 | 102.4 | 164.5 | -63.4 | 0 | 0 | 0 | 0 | 107.7 | ||||
| 5 | R | 55 | Low | 45.7 | Very low | 241 Ų | 241 | 141.5 Ų | 141.5 | 91% | 0.909 | 87% | 0.874 | S | S | * | * | trans | -137.1 | 100.1 | 164.3 | -71.9 | -164.6 | 178 | -169.6 | 0.9 | 107.9 | ||||
| 6 | I | 49.8 | Very low | 45.4 | Very low | 180 Ų | 180 | 136.9 Ų | 136.9 | 92% | 0.923 | 86% | 0.863 | S | S | * | * | trans | -114.8 | 101 | 153.2 | -58.4 | 177.1 | 0 | 0 | 0 | 104.7 | ||||
| 7 | S | 52.5 | Low | 44.7 | Very low | 112 Ų | 112 | 137.9 Ų | 137.9 | 78% | 0.783 | 87% | 0.868 | S | S | * | * | trans | -79.1 | 142.1 | 176.4 | -170.6 | 0 | 0 | 0 | 0 | 109.1 | ||||
| 8 | A | 49.3 | Very low | 44.7 | Very low | 87 Ų | 87 | 135.7 Ų | 135.7 | 72% | 0.719 | 86% | 0.864 | S | S | * | * | trans | -55.7 | 148.2 | 173.1 | 0 | 0 | 0 | 0 | 0 | 113.1 | ||||
| 9 | C | 43.3 | Very low | 44.5 | Very low | 135 Ų | 135 | 138.1 Ų | 138.1 | 91% | 0.912 | 86% | 0.864 | S | S | * | * | trans | -151.3 | 130.4 | 144.1 | -92.4 | 0 | 0 | 0 | 0 | 108.6 | ||||
| 10 | G | 38 | Very low | 44.9 | Very low | 73 Ų | 73 | 136.9 Ų | 136.9 | 75% | 0.753 | 86% | 0.857 | S | S | * | * | trans | -86.6 | -166.7 | -172.2 | 0 | 0 | 0 | 0 | 0 | 114.7 | ||||
| 11 | P | 48.7 | Very low | 44.7 | Very low | 141 Ų | 141 | 133.5 Ų | 133.5 | 92% | 0.916 | 85% | 0.849 | S | S | * | * | trans | -88.4 | 132.6 | -170.7 | 34.6 | -30.7 | 0 | 0 | 0 | 111.5 | ||||
| 12 | G | 36.3 | Very low | 45 | Very low | 76 Ų | 76 | 127.6 Ų | 127.6 | 78% | 0.784 | 83% | 0.832 | S | S | * | * | trans | -126.1 | 115.3 | 169.8 | 0 | 0 | 0 | 0 | 0 | 109.6 | ||||
| 13 | A | 44.9 | Very low | 45.6 | Very low | 100 Ų | 100 | 126.8 Ų | 126.8 | 83% | 0.826 | 83% | 0.826 | S | S | * | * | trans | -73.8 | 139.4 | 166.1 | 0 | 0 | 0 | 0 | 0 | 109.5 | ||||
| 14 | Q | 40.1 | Very low | 46.6 | Very low | 204 Ų | 204 | 128.7 Ų | 128.7 | 95% | 0.953 | 83% | 0.825 | S | S | * | * | trans | -158.4 | 150.6 | 148.7 | -112.5 | -169.4 | 93.4 | 0 | 0 | 111.9 | ||||
| 15 | E | 38.5 | Very low | 47.5 | Very low | 191 Ų | 191 | 127.9 Ų | 127.9 | 89% | 0.893 | 82% | 0.818 | S | S | * | * | trans | -105.8 | 141.6 | -158 | -169.9 | 165.7 | 130.2 | 0 | 0 | 110.4 | ||||
| 16 | G | 41 | Very low | 47.6 | Very low | 68 Ų | 68 | 122.5 Ų | 122.5 | 70% | 0.701 | 81% | 0.814 | S | S | * | * | trans | 68.5 | 106.4 | 148.7 | 0 | 0 | 0 | 0 | 0 | 120.5 | ||||
| 17 | T | 34.8 | Very low | 47.9 | Very low | 153 Ų | 153 | 125.5 Ų | 125.5 | 94% | 0.939 | 81% | 0.814 | S | S | * | * | trans | -157.1 | 134 | 137 | -46.7 | 0 | 0 | 0 | 0 | 109.2 | ||||
| 18 | A | 43.3 | Very low | 48 | Very low | 98 Ų | 98 | 128.8 Ų | 128.8 | 81% | 0.81 | 82% | 0.817 | S | S | * | * | trans | -85.5 | 141.6 | -175 | 0 | 0 | 0 | 0 | 0 | 113.3 | ||||
| 19 | E | 41.9 | Very low | 48 | Very low | 182 Ų | 182 | 130.6 Ų | 130.6 | 85% | 0.85 | 82% | 0.821 | S | S | * | * | trans | -154.5 | 144.3 | 156.3 | -115.2 | -84.5 | 112.2 | 0 | 0 | 108 | G21 | E19-G21 PolarHBondContact O-N 3.09Š| ||
| 20 | P | 52 | Low | 48.2 | Very low | 113 Ų | 113 | 132.1 Ų | 132.1 | 73% | 0.734 | 82% | 0.817 | S | S | * | * | trans | -91.8 | 104.5 | -160.7 | 34 | -26.7 | 0 | 0 | 0 | 111.3 | ||||
| 21 | G | 40.3 | Very low | 48.5 | Very low | 67 Ų | 67 | 134.7 Ų | 134.7 | 69% | 0.691 | 82% | 0.82 | S | S | * | * | trans | -125.8 | 108.9 | 178.4 | 0 | 0 | 0 | 0 | 0 | 112.9 | E19 | E19-G21 PolarHBondContact O-N 3.09Š| ||
| 22 | S | 52.4 | Low | 48.1 | Very low | 116 Ų | 116 | 137.7 Ų | 137.7 | 81% | 0.811 | 82% | 0.819 | S | S | * | * | trans | 62.8 | 137.3 | 158 | -61.9 | 0 | 0 | 0 | 0 | 119.8 | ||||
| 23 | P | 63.4 | Low | 48.6 | Very low | 119 Ų | 119 | 139.9 Ų | 139.9 | 77% | 0.773 | 82% | 0.822 | S | S | * | * | P | Polyproline II helix | trans | -69 | 150.8 | 174 | 30.2 | -33.8 | 0 | 0 | 0 | 111.4 | ||
| 24 | P | 64.1 | Low | 48.9 | Very low | 118 Ų | 118 | 143.8 Ų | 143.8 | 77% | 0.766 | 82% | 0.823 | S | S | * | * | P | Polyproline II helix | trans | -69.9 | 152.4 | -179 | 30 | -34.7 | 0 | 0 | 0 | 111.6 | ||
| 25 | P | 67.9 | Low | 49.8 | Very low | 112 Ų | 112 | 139.1 Ų | 139.1 | 73% | 0.727 | 81% | 0.811 | S | S | * | * | P | Polyproline II helix | trans | -66 | 156 | 174.2 | 29.1 | -34.4 | 0 | 0 | 0 | 111.2 | R27 | P25-R27 PolarHBondContact O-N 3.08Š|
| 26 | P | 56.8 | Low | 51.1 | Low | 128 Ų | 128 | 135.8 Ų | 135.8 | 83% | 0.831 | 81% | 0.806 | S | S | * | * | P | Polyproline II helix | trans | -59.5 | 127.8 | 176.5 | -16.5 | 28.7 | 0 | 0 | 0 | 110.2 | E28 | P26-E28 PolarHBondContact O-N 3.21Š|
| 27 | R | 56.6 | Low | 52.1 | Low | 243 Ų | 243 | 138 Ų | 138 | 92% | 0.917 | 81% | 0.808 | S | S | * | * | P | Polyproline II helix | trans | -65.1 | 119.3 | 171 | -70.9 | -177.1 | 170 | -166.9 | -3 | 108.6 | P25 | P25-R27 PolarHBondContact O-N 3.08Š|
| 28 | E | 53.7 | Low | 52.9 | Low | 181 Ų | 181 | 136.7 Ų | 136.7 | 85% | 0.846 | 80% | 0.802 | S | S | * | * | P | Polyproline II helix | trans | -59.9 | 130.7 | 164.7 | -72.3 | -178.1 | 133.5 | 0 | 0 | 108.9 | P26 M30 | P26-E28 PolarHBondContact O-N 3.21Å; E28-M30 PolarHBondContact O-N 3.17Å |
| 29 | P | 51.2 | Low | 53.2 | Low | 125 Ų | 125 | 138.2 Ų | 138.2 | 81% | 0.812 | 80% | 0.801 | S | S | * | * | P | Polyproline II helix | trans | -64.9 | 122.1 | 173.2 | 24.1 | -29.3 | 0 | 0 | 0 | 109 | ||
| 30 | M | 47.4 | Very low | 53.7 | Low | 167 Ų | 167 | 134.8 Ų | 134.8 | 82% | 0.823 | 80% | 0.795 | S | S | * | * | P | Polyproline II helix | trans | -51.4 | 140.9 | 171.3 | -67.3 | -137.4 | -86.3 | 0 | 0 | 110.5 | E28 F32 | E28-M30 PolarHBondContact O-N 3.17Å; M30-F32 PolarHBondContact O-N 2.96Å |
| 31 | P | 43.1 | Very low | 53.2 | Low | 126 Ų | 126 | 135.5 Ų | 135.5 | 82% | 0.818 | 80% | 0.797 | S | S | * | * | trans | -66.5 | 110.3 | 174.9 | 26.8 | -30.8 | 0 | 0 | 0 | 108.5 | S33 | P31-S33 PolarHBondContact O-N 2.84Š| ||
| 32 | F | 39.7 | Very low | 53.1 | Low | 205 Ų | 205 | 139.8 Ų | 139.8 | 90% | 0.899 | 80% | 0.803 | S | S | * | * | trans | -50.9 | 131.6 | 167.6 | -100.7 | -98.4 | 0 | 0 | 0 | 109.6 | M30 Q34 | M30-F32 PolarHBondContact O-N 2.96Å; F32-Q34 PolarHBondContact O-N 3.45Å | ||
| 33 | S | 48.7 | Very low | 52.3 | Low | 121 Ų | 121 | 140 Ų | 140 | 85% | 0.846 | 80% | 0.8 | S | S | * | * | trans | -54.8 | 105.3 | 172.1 | -52 | 0 | 0 | 0 | 0 | 110.1 | P31 | P31-S33 PolarHBondContact O-N 2.84Š| ||
| 34 | Q | 51 | Low | 51.3 | Low | 182 Ų | 182 | 139.6 Ų | 139.6 | 85% | 0.85 | 80% | 0.8 | S | S | * | * | P | Polyproline II helix | trans | -85.5 | 128.7 | 173.4 | -167 | 175.7 | -4.1 | 0 | 0 | 109.3 | F32 | F32-Q34 PolarHBondContact O-N 3.45Š|
| 35 | P | 58.6 | Low | 49.9 | Very low | 107 Ų | 107 | 140 Ų | 140 | 70% | 0.695 | 80% | 0.801 | S | S | * | * | P | Polyproline II helix | trans | -72.4 | 153.3 | 178.2 | 28.9 | -32.5 | 0 | 0 | 0 | 111.7 | ||
| 36 | P | 65.9 | Low | 49 | Very low | 120 Ų | 120 | 139.9 Ų | 139.9 | 78% | 0.779 | 80% | 0.8 | S | S | * | * | P | Polyproline II helix | trans | -72.5 | 148.1 | -176.2 | 30 | -34.5 | 0 | 0 | 0 | 112.3 | ||
| 37 | P | 61.6 | Low | 48 | Very low | 116 Ų | 116 | 140.5 Ų | 140.5 | 75% | 0.753 | 80% | 0.801 | S | S | * | * | P | Polyproline II helix | trans | -72.8 | 153.6 | 175.6 | 30 | -33.9 | 0 | 0 | 0 | 112.4 | ||
| 38 | P | 52.3 | Low | 47.5 | Very low | 125 Ų | 125 | 134.4 Ų | 134.4 | 81% | 0.812 | 79% | 0.793 | S | S | * | * | P | Polyproline II helix | trans | -73.8 | 141.7 | -172.9 | 30.4 | -34.2 | 0 | 0 | 0 | 112.6 | ||
| 39 | T | 49.6 | Very low | 47 | Very low | 129 Ų | 129 | 128.9 Ų | 128.9 | 79% | 0.791 | 79% | 0.785 | S | S | * | * | P | Polyproline II helix | trans | -71.8 | 128.1 | 176.8 | -35.9 | 0 | 0 | 0 | 0 | 110.6 | T41 | T39-T41 PolarHBondContact O-N 2.89Š|
| 40 | P | 51.5 | Low | 46.3 | Very low | 110 Ų | 110 | 132.1 Ų | 132.1 | 71% | 0.714 | 79% | 0.789 | S | S | * | * | P | Polyproline II helix | trans | -77.3 | 116.8 | 168 | 28.7 | -30.2 | 0 | 0 | 0 | 110.1 | L42 | P40-L42 PolarHBondContact O-N 3.01Š|
| 41 | T | 40.7 | Very low | 46.1 | Very low | 128 Ų | 128 | 129.9 Ų | 129.9 | 79% | 0.785 | 79% | 0.79 | S | S | * | * | trans | -58.3 | 111.8 | 167.1 | -57.5 | 0 | 0 | 0 | 0 | 109.7 | T39 T43 | T39-T41 PolarHBondContact O-N 2.89Å; T41-T43 PolarHBondContact O-N 3.2Å | ||
| 42 | L | 39.4 | Very low | 46.2 | Very low | 157 Ų | 157 | 129.4 Ų | 129.4 | 82% | 0.822 | 79% | 0.787 | S | S | * | * | trans | -79.3 | 98.2 | 169.2 | -70.7 | 173.7 | 0 | 0 | 0 | 109.1 | P40 S44 | P40-L42 PolarHBondContact O-N 3.01Å; L42-S44 PolarHBondContact O-N 3.19Å | ||
| 43 | T | 35.8 | Very low | 46.4 | Very low | 122 Ų | 122 | 125.3 Ų | 125.3 | 75% | 0.748 | 78% | 0.781 | S | S | * | * | trans | -61.2 | 112.4 | 161.8 | -61.9 | 0 | 0 | 0 | 0 | 108.3 | T41 | T41-T43 PolarHBondContact O-N 3.2Š| ||
| 44 | S | 41.6 | Very low | 46.2 | Very low | 109 Ų | 109 | 126.6 Ų | 126.6 | 76% | 0.762 | 78% | 0.778 | S | S | * | * | trans | -79.4 | 120.5 | 173 | -60.9 | 0 | 0 | 0 | 0 | 109.3 | L42 | L42-S44 PolarHBondContact O-N 3.19Š| ||
| 45 | T | 34 | Very low | 45.8 | Very low | 127 Ų | 127 | 123.8 Ų | 123.8 | 78% | 0.779 | 78% | 0.775 | S | S | * | * | trans | -113.9 | 119.8 | 163.1 | -52.1 | 0 | 0 | 0 | 0 | 107.9 | ||||
| 46 | P | 50.9 | Low | 45.2 | Very low | 110 Ų | 110 | 125.6 Ų | 125.6 | 71% | 0.714 | 78% | 0.779 | S | S | * | * | trans | -86.7 | 147.7 | 173.4 | 34.5 | -30.2 | 0 | 0 | 0 | 109.6 | ||||
| 47 | T | 35.2 | Very low | 44.2 | Very low | 140 Ų | 140 | 124.5 Ų | 124.5 | 86% | 0.859 | 78% | 0.78 | S | S | * | * | trans | 178.5 | 147.4 | 137.3 | -79.4 | 0 | 0 | 0 | 0 | 110.6 | ||||
| 48 | P | 46 | Very low | 43.2 | Very low | 115 Ų | 115 | 122.9 Ų | 122.9 | 75% | 0.747 | 78% | 0.777 | S | S | * | * | trans | -107.1 | 167.2 | -141.9 | 38.5 | -30.2 | 0 | 0 | 0 | 114.1 | ||||
| 49 | G | 43.4 | Very low | 42.7 | Very low | 66 Ų | 66 | 121.2 Ų | 121.2 | 68% | 0.68 | 78% | 0.782 | S | S | * | * | trans | 71 | 105.8 | 141.4 | 0 | 0 | 0 | 0 | 0 | 116.4 | ||||
| 50 | Q | 35.2 | Very low | 42.3 | Very low | 192 Ų | 192 | 119.7 Ų | 119.7 | 90% | 0.897 | 78% | 0.783 | S | S | * | * | 173.9 | 121.9 | 121.9 | -93.1 | 164.2 | 20.5 | 0 | 0 | 109.1 | |||||
| 51 | S | 43.8 | Very low | 42.1 | Very low | 120 Ų | 120 | 118.9 Ų | 118.9 | 84% | 0.839 | 78% | 0.779 | S | S | * | * | trans | -69.7 | 140.1 | 160.7 | 42.7 | 0 | 0 | 0 | 0 | 110.3 | ||||
| 52 | P | 44.8 | Very low | 42.4 | Very low | 116 Ų | 116 | 116 Ų | 116 | 75% | 0.753 | 77% | 0.769 | S | S | * | * | trans | -127.2 | 163.2 | 142.6 | 11.3 | 11.5 | 0 | 0 | 0 | 112.3 | ||||
| 53 | P | 44.9 | Very low | 42.7 | Very low | 120 Ų | 120 | 111.2 Ų | 111.2 | 78% | 0.779 | 76% | 0.757 | S | S | * | * | trans | -86 | 158.3 | -149.3 | 34.1 | -35.2 | 0 | 0 | 0 | 114.2 | P55 | P53-P55 WeakPolarHBondContact O-CD 3.32Š| ||
| 54 | L | 44.7 | Very low | 43.5 | Very low | 148 Ų | 148 | 108.2 Ų | 108.2 | 78% | 0.775 | 75% | 0.745 | S | S | * | * | trans | -49.4 | 131.3 | 161.4 | -138.7 | 84.8 | 0 | 0 | 0 | 110.9 | ||||
| 55 | P | 42.3 | Very low | 44.2 | Very low | 123 Ų | 123 | 105.7 Ų | 105.7 | 80% | 0.799 | 73% | 0.731 | S | S | * | * | trans | -100.5 | 100.2 | 152.7 | 30.5 | -21 | 0 | 0 | 0 | 108.9 | P53 | P53-P55 WeakPolarHBondContact O-CD 3.32Š| ||
| 56 | D | 44.8 | Very low | 45.3 | Very low | 145 Ų | 145 | 106.1 Ų | 106.1 | 78% | 0.775 | 72% | 0.724 | S | S | * | * | trans | -71.1 | 148.9 | 152.3 | -119.6 | -34.2 | 0 | 0 | 0 | 108.6 | ||||
| 57 | A | 45.4 | Very low | 46 | Very low | 96 Ų | 96 | 102.4 Ų | 102.4 | 79% | 0.793 | 71% | 0.706 | S | S | * | * | trans | 81.8 | 72.9 | 177.3 | 0 | 0 | 0 | 0 | 0 | 118.3 | ||||
| 58 | A | 40.1 | Very low | 47.6 | Very low | 83 Ų | 83 | 102 Ų | 102 | 69% | 0.686 | 69% | 0.694 | S | S | * | * | trans | -154 | 41.8 | 147.8 | 0 | 0 | 0 | 0 | 0 | 112.8 | A60 | A58-A60 PolarHBondContact O-N 3.38Š| ||
| 59 | G | 41.8 | Very low | 48.8 | Very low | 89 Ų | 89 | 102.3 Ų | 102.3 | 92% | 0.918 | 69% | 0.685 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -72.8 | 1.9 | -177.1 | 0 | 0 | 0 | 0 | 0 | 116.5 | ||
| 60 | A | 42.4 | Very low | 50 | Low | 98 Ų | 98 | 104.5 Ų | 104.5 | 81% | 0.81 | 68% | 0.681 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -111.4 | -6.4 | -175.5 | 0 | 0 | 0 | 0 | 0 | 114.6 | A58 | A58-A60 PolarHBondContact O-N 3.38Š|
| 61 | S | 47.4 | Very low | 51.8 | Low | 92 Ų | 92 | 100.9 Ų | 100.9 | 64% | 0.643 | 66% | 0.664 | S | S | * | * | S | Bend | trans | -105.6 | -14.4 | -175.7 | -170.7 | 0 | 0 | 0 | 0 | 114.6 | ||
| 62 | A | 45.9 | Very low | 53.5 | Low | 69 Ų | 69 | 103.6 Ų | 103.6 | 57% | 0.57 | 66% | 0.656 | S | S | * | * | H | α-helix | trans | -77.4 | -33.7 | -178.2 | 0 | 0 | 0 | 0 | 0 | 113.1 | A64 A65 E66 | A62-A64 VanDerWaalsContact C-N 3.29Å; A62-A64 PolarHBondContact O-N 2.92Å; A62-A65 PolarHBondContact O-N 2.84Å; A62-E66 PolarHBondContact O-N 3.32Å |
| 63 | G | 46.1 | Very low | 54.5 | Low | 56 Ų | 56 | 107.8 Ų | 107.8 | 58% | 0.577 | 66% | 0.657 | S | S | * | * | H | α-helix | trans | -69.3 | -23.7 | 179.4 | 0 | 0 | 0 | 0 | 0 | 114.4 | G67 | G63-G67 PolarHBondContact O-N 3.17Å; G63-G67 VanDerWaalsContact O-N 3.16Å |
| 64 | A | 52.8 | Low | 55.7 | Low | 58 Ų | 58 | 110.9 Ų | 110.9 | 48% | 0.479 | 65% | 0.653 | S | S | . | * | H | α-helix | trans | -77 | -26.8 | 177.3 | 0 | 0 | 0 | 0 | 0 | 112.9 | A62 Q68 | A62-A64 VanDerWaalsContact C-N 3.29Å; A62-A64 PolarHBondContact O-N 2.92Å; A64-Q68 WeakPolarHBondContact O-CB 3.39Å; A64-Q68 WeakPolarHBondContact O-CG 3.38Å; A64-Q68 PolarHBondContact O-N 3.43Å; A64-Q68 PolarHBondContact O-NE2 2.76Å; A64-Q68 VanDerWaalsContact O-NE2 3.09Å |
| 65 | A | 56.5 | Low | 56.9 | Low | 57 Ų | 57 | 108.7 Ų | 108.7 | 47% | 0.471 | 64% | 0.639 | S | S | . | * | H | α-helix | trans | -79.1 | -42.5 | 177.8 | 0 | 0 | 0 | 0 | 0 | 111 | A62 G67 Q68 E69 | A62-A65 PolarHBondContact O-N 2.84Å; A65-G67 VanDerWaalsContact C-N 3.35Å; A65-G67 PolarHBondContact O-N 3.24Å; A65-Q68 PolarHBondContact O-N 3.04Å; A65-E69 PolarHBondContact O-N 3.16Å; A65-E69 VanDerWaalsContact O-N 3.09Å |
| 66 | E | 57.6 | Low | 57.7 | Low | 135 Ų | 135 | 105.7 Ų | 105.7 | 63% | 0.631 | 63% | 0.631 | S | S | * | * | H | α-helix | trans | -65.5 | -39 | 176.7 | -148.3 | 177.3 | 166.6 | 0 | 0 | 111.4 | A62 Q68 E69 L70 | A62-E66 PolarHBondContact O-N 3.32Å; E66-Q68 PolarHBondContact O-N 3.45Å; E66-E69 PolarHBondContact O-N 2.98Å; E66-L70 PolarHBondContact O-N 2.96Å |
| 67 | G | 64.1 | Low | 58.3 | Low | 33 Ų | 33 | 102.7 Ų | 102.7 | 34% | 0.34 | 63% | 0.626 | S | S | . | * | H | α-helix | trans | -64.3 | -35 | 171.9 | 0 | 0 | 0 | 0 | 0 | 113.7 | G63 A65 Q71 | G63-G67 PolarHBondContact O-N 3.17Å; G63-G67 VanDerWaalsContact O-N 3.16Å; A65-G67 VanDerWaalsContact C-N 3.35Å; A65-G67 PolarHBondContact O-N 3.24Å; G67-Q71 WeakPolarHBondContact O-CB 3.15Å; G67-Q71 WeakPolarHBondContact O-CG 3.43Å; G67-Q71 PolarHBondContact O-N 3.49Å |
| 68 | Q | 69.7 | Low | 58.5 | Low | 130 Ų | 130 | 101.8 Ų | 101.8 | 61% | 0.607 | 61% | 0.614 | S | S | * | * | H | α-helix | trans | -71.5 | -36 | 177.1 | -88.5 | 174.7 | 75.2 | 0 | 0 | 112.9 | A64 A65 E66 Q71 R72 | A64-Q68 WeakPolarHBondContact O-CB 3.39Å; A64-Q68 WeakPolarHBondContact O-CG 3.38Å; A64-Q68 PolarHBondContact O-N 3.43Å; A64-Q68 PolarHBondContact O-NE2 2.76Å; A64-Q68 VanDerWaalsContact O-NE2 3.09Å; A65-Q68 PolarHBondContact O-N 3.04Å; E66-Q68 PolarHBondContact O-N 3.45Å; Q68-Q71 PolarHBondContact O-N 2.97Å; Q68-R72 WeakPolarHBondContact O-CB 3.29Å; Q68-R72 PolarHBondContact O-N 2.97Å |
| 69 | E | 71.3 | Confident | 59 | Low | 122 Ų | 122 | 100.6 Ų | 100.6 | 57% | 0.57 | 61% | 0.61 | S | S | * | * | H | α-helix | trans | -66.3 | -44.8 | 172.9 | -82.4 | -163.3 | 127.7 | 0 | 0 | 111.7 | A65 E66 Q71 R72 W73 | A65-E69 PolarHBondContact O-N 3.16Å; A65-E69 VanDerWaalsContact O-N 3.09Å; E66-E69 PolarHBondContact O-N 2.98Å; E69-Q71 VanDerWaalsContact C-N 3.26Å; E69-Q71 PolarHBondContact O-N 2.83Å; E69-R72 WeakPolarHBondContact O-CB 3.43Å; E69-R72 PolarHBondContact O-N 3.3Å; E69-R72 VanDerWaalsContact O-N 3.15Å; E69-W73 PolarHBondContact O-N 3.36Å |
| 70 | L | 68.3 | Low | 59.4 | Low | 112 Ų | 112 | 102.7 Ų | 102.7 | 59% | 0.586 | 60% | 0.604 | S | S | * | * | H | α-helix | trans | -60.4 | -35.9 | 175.5 | -78.3 | 159.3 | 0 | 0 | 0 | 112.4 | E66 R74 | E66-L70 PolarHBondContact O-N 2.96Å; L70-R74 PolarHBondContact O-N 3.46Å |
| 71 | Q | 72.8 | Confident | 59.8 | Low | 116 Ų | 116 | 102.9 Ų | 102.9 | 54% | 0.542 | 61% | 0.606 | S | S | . | * | H | α-helix | trans | -69.7 | -42.3 | 173.4 | -77.2 | -144.8 | 12 | 0 | 0 | 112.7 | G67 Q68 E69 W73 R74 Q75 | G67-Q71 WeakPolarHBondContact O-CB 3.15Å; G67-Q71 WeakPolarHBondContact O-CG 3.43Å; G67-Q71 PolarHBondContact O-N 3.49Å; Q68-Q71 PolarHBondContact O-N 2.97Å; E69-Q71 VanDerWaalsContact C-N 3.26Å; E69-Q71 PolarHBondContact O-N 2.83Å; Q71-W73 VanDerWaalsContact C-N 3.32Å; Q71-W73 PolarHBondContact O-N 3.38Å; Q71-R74 PolarHBondContact O-N 3.1Å; Q71-R74 VanDerWaalsContact O-N 3.1Å; Q71-Q75 PolarHBondContact O-N 3.37Å; Q71-Q75 PolarHBondContact O-NE2 2.93Å; Q71-Q75 PolarHBondContact O-OE1 3.37Å |
| 72 | R | 79.6 | Confident | 59.9 | Low | 178 Ų | 178 | 101.6 Ų | 101.6 | 67% | 0.672 | 61% | 0.607 | S | S | * | * | H | α-helix | trans | -57.1 | -43.9 | 175.6 | -174.8 | -169 | -62.6 | -97.5 | 0.3 | 112 | Q68 E69 Q75 G76 | Q68-R72 WeakPolarHBondContact O-CB 3.29Å; Q68-R72 PolarHBondContact O-N 2.97Å; E69-R72 WeakPolarHBondContact O-CB 3.43Å; E69-R72 PolarHBondContact O-N 3.3Å; E69-R72 VanDerWaalsContact O-N 3.15Å; R72-Q75 PolarHBondContact O-N 2.67Å; R72-G76 PolarHBondContact O-N 3.07Å |
| 73 | W | 65.3 | Low | 59.9 | Low | 203 Ų | 203 | 106.6 Ų | 106.6 | 77% | 0.769 | 62% | 0.623 | S | S | * | * | H | α-helix | trans | -65.2 | -38.2 | 175.9 | -78.6 | 105.8 | 0 | 0 | 0 | 112.7 | E69 Q71 A77 | E69-W73 PolarHBondContact O-N 3.36Å; Q71-W73 VanDerWaalsContact C-N 3.32Å; Q71-W73 PolarHBondContact O-N 3.38Å; W73-A77 PolarHBondContact O-N 2.89Å |
| 74 | R | 70.8 | Confident | 59.8 | Low | 186 Ų | 186 | 108.8 Ų | 108.8 | 70% | 0.702 | 64% | 0.636 | S | S | * | * | H | α-helix | trans | -69.7 | -38.1 | 178 | -166.4 | -179.9 | -62.5 | -86.9 | 0.1 | 112.4 | L70 Q71 A77 S78 | L70-R74 PolarHBondContact O-N 3.46Å; Q71-R74 PolarHBondContact O-N 3.1Å; Q71-R74 VanDerWaalsContact O-N 3.1Å; R74-A77 PolarHBondContact O-N 3.42Å; R74-S78 PolarHBondContact O-N 3.05Å |
| 75 | Q | 70.2 | Confident | 59.2 | Low | 101 Ų | 101 | 109.1 Ų | 109.1 | 47% | 0.472 | 65% | 0.645 | S | S | . | * | H | α-helix | trans | -73.3 | -32.8 | 177.6 | -77.6 | 124.9 | 43.8 | 0 | 0 | 113 | Q71 R72 A77 S78 G79 | Q71-Q75 PolarHBondContact O-N 3.37Å; Q71-Q75 PolarHBondContact O-NE2 2.93Å; Q71-Q75 PolarHBondContact O-OE1 3.37Å; R72-Q75 PolarHBondContact O-N 2.67Å; Q75-A77 PolarHBondContact O-N 3.25Å; Q75-S78 WeakPolarHBondContact CA-OG 3.48Å; Q75-S78 PolarHBondContact O-N 3.42Å; Q75-S78 PolarHBondContact O-OG 3.34Å; Q75-S78 VanDerWaalsContact O-OG 3.08Å; Q75-G79 PolarHBondContact O-N 3.34Å |
| 76 | G | 60 | Low | 59.1 | Low | 61 Ų | 61 | 113.2 Ų | 113.2 | 63% | 0.629 | 67% | 0.667 | S | S | * | * | H | α-helix | trans | -62.9 | -26.8 | 171.7 | 0 | 0 | 0 | 0 | 0 | 113.7 | R72 | R72-G76 PolarHBondContact O-N 3.07Å |
| 77 | A | 55.4 | Low | 58.5 | Low | 81 Ų | 81 | 110.5 Ų | 110.5 | 67% | 0.669 | 68% | 0.675 | S | S | * | * | H | α-helix | trans | -83.5 | -26.6 | 176.2 | 0 | 0 | 0 | 0 | 0 | 113.6 | W73 R74 Q75 | W73-A77 PolarHBondContact O-N 2.89Å; R74-A77 PolarHBondContact O-N 3.42Å; Q75-A77 PolarHBondContact O-N 3.25Å |
| 78 | S | 51 | Low | 57.3 | Low | 78 Ų | 78 | 112.7 Ų | 112.7 | 55% | 0.545 | 70% | 0.697 | S | S | . | * | H | α-helix | trans | -87.4 | -13.2 | -179.8 | 54.9 | 0 | 0 | 0 | 0 | 114.6 | R74 Q75 V80 | R74-S78 PolarHBondContact O-N 3.05Å; Q75-S78 WeakPolarHBondContact CA-OG 3.48Å; Q75-S78 PolarHBondContact O-N 3.42Å; Q75-S78 PolarHBondContact O-OG 3.34Å; Q75-S78 VanDerWaalsContact O-OG 3.08Å; S78-V80 PolarHBondContact O-N 3.41Å |
| 79 | G | 50.3 | Low | 56.7 | Low | 58 Ų | 58 | 110.2 Ų | 110.2 | 60% | 0.598 | 71% | 0.706 | S | S | * | * | G | 310 helix | trans | -70.9 | -7.5 | -177.4 | 0 | 0 | 0 | 0 | 0 | 116.2 | Q75 | Q75-G79 PolarHBondContact O-N 3.34Š|
| 80 | V | 50.7 | Low | 55.7 | Low | 133 Ų | 133 | 111 Ų | 111 | 81% | 0.806 | 73% | 0.726 | S | S | * | * | G | 310 helix | trans | -88.5 | -9.3 | -179 | 171.7 | 0 | 0 | 0 | 0 | 113 | S78 G82 | S78-V80 PolarHBondContact O-N 3.41Å; V80-G82 PolarHBondContact O-N 3.21Å |
| 81 | A | 49.3 | Very low | 54.9 | Low | 102 Ų | 102 | 107.4 Ų | 107.4 | 84% | 0.843 | 72% | 0.715 | S | S | * | * | G | 310 helix | trans | -86.8 | 1.4 | -177.9 | 0 | 0 | 0 | 0 | 0 | 115 | ||
| 82 | G | 50.3 | Low | 53.7 | Low | 64 Ų | 64 | 106.3 Ų | 106.3 | 66% | 0.66 | 73% | 0.726 | S | S | * | * | S | Bend | trans | -118.8 | 6.3 | -166.8 | 0 | 0 | 0 | 0 | 0 | 117.9 | V80 | V80-G82 PolarHBondContact O-N 3.21Š|
| 83 | L | 46.9 | Very low | 52.3 | Low | 175 Ų | 175 | 102.1 Ų | 102.1 | 92% | 0.916 | 73% | 0.729 | S | S | * | * | trans | -119.6 | 76.4 | 177.1 | -104.8 | 83.6 | 0 | 0 | 0 | 111.4 | ||||
| 84 | A | 43.1 | Very low | 51.7 | Low | 102 Ų | 102 | 95.9 Ų | 95.9 | 84% | 0.843 | 72% | 0.721 | S | S | * | * | trans | -135.2 | 73.7 | 161.9 | 0 | 0 | 0 | 0 | 0 | 108.9 | ||||
| 85 | G | 40 | Very low | 51.3 | Low | 65 Ų | 65 | 88.7 Ų | 88.7 | 67% | 0.67 | 71% | 0.705 | S | S | * | * | trans | -79.6 | 146.7 | 163.3 | 0 | 0 | 0 | 0 | 0 | 110.4 | G87 | G85-G87 PolarHBondContact O-N 3.04Š| ||
| 86 | P | 54.7 | Low | 51.3 | Low | 143 Ų | 143 | 88.4 Ų | 88.4 | 93% | 0.929 | 71% | 0.71 | S | S | * | * | S | Bend | trans | -83.5 | 100.2 | -179.3 | 33 | -29 | 0 | 0 | 0 | 109 | ||
| 87 | G | 45.3 | Very low | 52 | Low | 78 Ų | 78 | 87.1 Ų | 87.1 | 80% | 0.804 | 70% | 0.698 | S | S | * | * | trans | -177.2 | 116.2 | 175.2 | 0 | 0 | 0 | 0 | 0 | 112.1 | G85 | G85-G87 PolarHBondContact O-N 3.04Š| ||
| 88 | G | 39.3 | Very low | 53.3 | Low | 78 Ų | 78 | 84.7 Ų | 84.7 | 80% | 0.804 | 68% | 0.68 | S | S | * | * | trans | 127.3 | 77 | 171.2 | 0 | 0 | 0 | 0 | 0 | 113 | ||||
| 89 | G | 56.2 | Low | 55 | Low | 78 Ų | 78 | 89.8 Ų | 89.8 | 80% | 0.804 | 69% | 0.687 | S | S | * | * | trans | -63.6 | 159 | 161.6 | 0 | 0 | 0 | 0 | 0 | 111.5 | ||||
| 90 | S | 50.8 | Low | 56.9 | Low | 139 Ų | 139 | 89.7 Ų | 89.7 | 97% | 0.972 | 68% | 0.681 | S | S | * | * | trans | 80.7 | 73.2 | -179.4 | -152.2 | 0 | 0 | 0 | 0 | 115.6 | ||||
| 91 | G | 49.9 | Very low | 58.9 | Low | 36 Ų | 36 | 89.6 Ų | 89.6 | 37% | 0.371 | 68% | 0.675 | S | S | . | * | trans | -166.7 | 16.7 | 169.1 | 0 | 0 | 0 | 0 | 0 | 114.5 | A93 A94 G95 | G91-A93 PolarHBondContact O-N 2.9Å; G91-A94 PolarHBondContact O-N 3.36Å; G91-A94 VanDerWaalsContact O-N 3.09Å; G91-G95 PolarHBondContact O-N 3.2Å | ||
| 92 | A | 49.4 | Very low | 61 | Low | 94 Ų | 94 | 90.8 Ų | 90.8 | 78% | 0.777 | 66% | 0.663 | S | S | * | * | H | α-helix | trans | -62 | -30.7 | -175.4 | 0 | 0 | 0 | 0 | 0 | 112.9 | T96 | A92-T96 PolarHBondContact O-OG1 3.26Å |
| 93 | A | 49.7 | Very low | 63.2 | Low | 89 Ų | 89 | 92.5 Ų | 92.5 | 74% | 0.736 | 66% | 0.657 | S | S | * | * | H | α-helix | trans | -87 | -26 | 173.6 | 0 | 0 | 0 | 0 | 0 | 113.7 | G91 T96 | G91-A93 PolarHBondContact O-N 2.9Å; A93-T96 PolarHBondContact O-OG1 3.26Å |
| 94 | A | 53.2 | Low | 65.5 | Low | 72 Ų | 72 | 86.7 Ų | 86.7 | 60% | 0.595 | 63% | 0.634 | S | S | * | * | H | α-helix | trans | -85.8 | -33.7 | 179.9 | 0 | 0 | 0 | 0 | 0 | 112.9 | G91 G97 G98 | G91-A94 PolarHBondContact O-N 3.36Å; G91-A94 VanDerWaalsContact O-N 3.09Å; A94-G97 PolarHBondContact O-N 3.48Å; A94-G98 PolarHBondContact O-N 3.38Å |
| 95 | G | 61.3 | Low | 68.1 | Low | 36 Ų | 36 | 86 Ų | 86 | 37% | 0.371 | 61% | 0.613 | S | S | . | * | H | α-helix | trans | -74.6 | -26.1 | 178.6 | 0 | 0 | 0 | 0 | 0 | 113.4 | G91 R99 | G91-G95 PolarHBondContact O-N 3.2Å; G95-R99 VanDerWaalsContact O-CB 3.29Å; G95-R99 WeakPolarHBondContact O-CB 3.48Å; G95-R99 WeakPolarHBondContact O-CD 3.44Å; G95-R99 WeakPolarHBondContact O-CG 3.24Å; G95-R99 PolarHBondContact O-N 3.23Å |
| 96 | T | 69.9 | Low | 70.8 | Confident | 94 Ų | 94 | 85.4 Ų | 85.4 | 58% | 0.577 | 60% | 0.602 | S | S | * | * | H | α-helix | trans | -73.5 | -41.6 | 170 | 37.3 | 0 | 0 | 0 | 0 | 111.2 | A92 A93 A100 | A92-T96 PolarHBondContact O-OG1 3.26Å; A93-T96 PolarHBondContact O-OG1 3.26Å; T96-A100 WeakPolarHBondContact O-CB 3.41Å; T96-A100 PolarHBondContact O-N 3.48Å; T96-A100 VanDerWaalsContact O-N 3.08Å |
| 97 | G | 74.8 | Confident | 72.8 | Confident | 35 Ų | 35 | 86.6 Ų | 86.6 | 36% | 0.361 | 59% | 0.588 | S | S | . | * | H | α-helix | trans | -67.1 | -43 | 173.9 | 0 | 0 | 0 | 0 | 0 | 114.1 | A94 A100 L101 | A94-G97 PolarHBondContact O-N 3.48Å; G97-A100 PolarHBondContact O-N 3.44Å; G97-L101 WeakPolarHBondContact O-CG 3.3Å; G97-L101 PolarHBondContact O-N 3.26Å |
| 98 | G | 83.6 | Confident | 75.3 | Confident | 29 Ų | 29 | 90.3 Ų | 90.3 | 30% | 0.299 | 58% | 0.578 | S | S | . | * | H | α-helix | trans | -63.1 | -46.8 | 176.3 | 0 | 0 | 0 | 0 | 0 | 112.7 | A94 A100 L101 E102 | A94-G98 PolarHBondContact O-N 3.38Å; G98-A100 VanDerWaalsContact C-N 3.3Å; G98-A100 PolarHBondContact O-N 2.99Å; G98-L101 PolarHBondContact O-N 2.87Å; G98-E102 WeakPolarHBondContact O-CG 3.4Å; G98-E102 PolarHBondContact O-N 3.04Å |
| 99 | R | 85.7 | Confident | 78.1 | Confident | 186 Ų | 186 | 93.5 Ų | 93.5 | 70% | 0.702 | 57% | 0.566 | S | S | * | * | H | α-helix | trans | -63.8 | -33.5 | 174.8 | -73 | 175 | 177.4 | 178.2 | -0.4 | 113 | G95 L103 | G95-R99 VanDerWaalsContact O-CB 3.29Å; G95-R99 WeakPolarHBondContact O-CB 3.48Å; G95-R99 WeakPolarHBondContact O-CD 3.44Å; G95-R99 WeakPolarHBondContact O-CG 3.24Å; G95-R99 PolarHBondContact O-N 3.23Å; R99-L103 WeakPolarHBondContact O-CB 3.39Å; R99-L103 PolarHBondContact O-N 3.12Å |
| 100 | A | 90.3 | Very high | 80.1 | Confident | 56 Ų | 56 | 94.6 Ų | 94.6 | 46% | 0.463 | 55% | 0.553 | S | S | . | * | H | α-helix | trans | -68 | -38.7 | 174.9 | 0 | 0 | 0 | 0 | 0 | 112.1 | T96 G97 G98 L103 A104 | T96-A100 WeakPolarHBondContact O-CB 3.41Å; T96-A100 PolarHBondContact O-N 3.48Å; T96-A100 VanDerWaalsContact O-N 3.08Å; G97-A100 PolarHBondContact O-N 3.44Å; G98-A100 VanDerWaalsContact C-N 3.3Å; G98-A100 PolarHBondContact O-N 2.99Å; A100-L103 PolarHBondContact O-N 3.49Å; A100-A104 WeakPolarHBondContact O-CB 3.47Å; A100-A104 PolarHBondContact O-N 3.39Å |
| 101 | L | 92.9 | Very high | 82.3 | Confident | 130 Ų | 130 | 93.3 Ų | 93.3 | 68% | 0.681 | 53% | 0.534 | S | S | * | . | H | α-helix | trans | -67.5 | -42.8 | 173.8 | -72.4 | 171.7 | 0 | 0 | 0 | 112 | G97 G98 L103 A104 E105 | G97-L101 WeakPolarHBondContact O-CG 3.3Å; G97-L101 PolarHBondContact O-N 3.26Å; G98-L101 PolarHBondContact O-N 2.87Å; L101-L103 VanDerWaalsContact C-N 3.33Å; L101-L103 PolarHBondContact O-N 3.48Å; L101-A104 WeakPolarHBondContact O-CB 3.42Å; L101-A104 PolarHBondContact O-N 3.33Å; L101-E105 PolarHBondContact O-N 2.83Å |
| 102 | E | 94.3 | Very high | 84.6 | Confident | 128 Ų | 128 | 95.4 Ų | 95.4 | 60% | 0.598 | 53% | 0.534 | S | S | * | . | H | α-helix | trans | -61.2 | -40.6 | 174.4 | -72.3 | 172.2 | -179.2 | 0 | 0 | 112 | G98 E105 A106 | G98-E102 WeakPolarHBondContact O-CG 3.4Å; G98-E102 PolarHBondContact O-N 3.04Å; E102-E105 PolarHBondContact O-N 3.41Å; E102-A106 VanDerWaalsContact O-CB 3.3Å; E102-A106 WeakPolarHBondContact O-CB 3.42Å; E102-A106 PolarHBondContact O-N 3.04Å |
| 103 | L | 96.6 | Very high | 86.9 | Confident | 100 Ų | 100 | 95.1 Ų | 95.1 | 52% | 0.524 | 52% | 0.523 | S | S | . | . | H | α-helix | trans | -64.8 | -39.8 | 173.4 | -90.5 | 168.8 | 0 | 0 | 0 | 112.4 | R99 A100 L101 E105 A106 R107 | R99-L103 WeakPolarHBondContact O-CB 3.39Å; R99-L103 PolarHBondContact O-N 3.12Å; A100-L103 PolarHBondContact O-N 3.49Å; L101-L103 VanDerWaalsContact C-N 3.33Å; L101-L103 PolarHBondContact O-N 3.48Å; L103-E105 VanDerWaalsContact C-N 3.34Å; L103-A106 PolarHBondContact O-N 3.23Å; L103-R107 WeakPolarHBondContact O-CB 3.49Å; L103-R107 VanDerWaalsContact O-CG 3.24Å; L103-R107 WeakPolarHBondContact O-CG 3.44Å; L103-R107 PolarHBondContact O-N 3.46Å |
| 104 | A | 95.6 | Very high | 89.3 | Confident | 53 Ų | 53 | 94.3 Ų | 94.3 | 44% | 0.438 | 50% | 0.504 | S | S | . | . | H | α-helix | trans | -64.3 | -41.1 | 175.8 | 0 | 0 | 0 | 0 | 0 | 111.2 | A100 L101 R107 R108 | A100-A104 WeakPolarHBondContact O-CB 3.47Å; A100-A104 PolarHBondContact O-N 3.39Å; L101-A104 WeakPolarHBondContact O-CB 3.42Å; L101-A104 PolarHBondContact O-N 3.33Å; A104-R107 PolarHBondContact O-N 3.27Å; A104-R108 PolarHBondContact O-N 3.08Å |
| 105 | E | 96.3 | Very high | 91.4 | Very high | 86 Ų | 86 | 92.4 Ų | 92.4 | 40% | 0.402 | 49% | 0.491 | S | S | . | . | H | α-helix | trans | -67.6 | -42.9 | 175.7 | -168.8 | 179.9 | 175.8 | 0 | 0 | 112.1 | L101 E102 L103 R107 R108 R109 | L101-E105 PolarHBondContact O-N 2.83Å; E102-E105 PolarHBondContact O-N 3.41Å; L103-E105 VanDerWaalsContact C-N 3.34Å; E105-R107 VanDerWaalsContact C-N 3.31Å; E105-R107 PolarHBondContact O-N 3.49Å; E105-R108 WeakPolarHBondContact O-CB 3.37Å; E105-R108 PolarHBondContact O-N 2.99Å; E105-R108 VanDerWaalsContact O-N 3.16Å; E105-R109 WeakPolarHBondContact O-CG 3.5Å; E105-R109 PolarHBondContact O-N 3.25Å; E105-R109 IonicContact OE1-CZ 2.97Å; E105-R109 IonicContact OE1-NE 3.35Å; E105-R109 PolarHBondContact OE1-NE 2.96Å; E105-R109 IonicContact OE1-NH2 3.3Å; E105-R109 PolarHBondContact OE1-NH2 3.26Å |
| 106 | A | 96.9 | Very high | 93.1 | Very high | 54 Ų | 54 | 98.9 Ų | 98.9 | 45% | 0.446 | 51% | 0.505 | S | S | . | . | H | α-helix | trans | -60.3 | -41 | 175.6 | 0 | 0 | 0 | 0 | 0 | 111.7 | E102 L103 R109 L110 | E102-A106 VanDerWaalsContact O-CB 3.3Å; E102-A106 WeakPolarHBondContact O-CB 3.42Å; E102-A106 PolarHBondContact O-N 3.04Å; L103-A106 PolarHBondContact O-N 3.23Å; A106-R109 PolarHBondContact O-N 3.13Å; A106-L110 WeakPolarHBondContact O-CB 3.42Å; A106-L110 PolarHBondContact O-N 2.99Å |
| 107 | R | 96.9 | Very high | 94.5 | Very high | 168 Ų | 168 | 103.4 Ų | 103.4 | 63% | 0.634 | 51% | 0.511 | S | S | * | . | H | α-helix | trans | -62.6 | -42.6 | 173.9 | -75.4 | 169.9 | 179.2 | 174 | 0.6 | 112 | L103 A104 E105 L110 L111 | L103-R107 WeakPolarHBondContact O-CB 3.49Å; L103-R107 VanDerWaalsContact O-CG 3.24Å; L103-R107 WeakPolarHBondContact O-CG 3.44Å; L103-R107 PolarHBondContact O-N 3.46Å; A104-R107 PolarHBondContact O-N 3.27Å; E105-R107 VanDerWaalsContact C-N 3.31Å; E105-R107 PolarHBondContact O-N 3.49Å; R107-L110 WeakPolarHBondContact O-CB 3.42Å; R107-L110 PolarHBondContact O-N 3.31Å; R107-L111 WeakPolarHBondContact O-CG 3.44Å; R107-L111 PolarHBondContact O-N 3.32Å |
| 108 | R | 97.2 | Very high | 95.6 | Very high | 156 Ų | 156 | 109.7 Ų | 109.7 | 59% | 0.589 | 52% | 0.524 | S | S | * | . | H | α-helix | trans | -59.9 | -48.4 | 175.3 | -177.6 | -171.7 | 152 | -144.2 | -11.2 | 111.1 | A104 E105 L110 L111 E112 | A104-R108 PolarHBondContact O-N 3.08Å; E105-R108 WeakPolarHBondContact O-CB 3.37Å; E105-R108 PolarHBondContact O-N 2.99Å; E105-R108 VanDerWaalsContact O-N 3.16Å; R108-L110 VanDerWaalsContact C-N 3.31Å; R108-L110 PolarHBondContact O-N 3Å; R108-L111 PolarHBondContact O-N 2.91Å; R108-E112 IonicContact CZ-OE1 3.29Å; R108-E112 VanDerWaalsContact CZ-OE1 3.29Å; R108-E112 IonicContact NE-OE1 3.69Å; R108-E112 PolarHBondContact NE-OE1 3.37Å; R108-E112 IonicContact NH2-OE1 2.84Å; R108-E112 PolarHBondContact NH2-OE1 3.39Å; R108-E112 WeakPolarHBondContact O-CG 3.43Å; R108-E112 PolarHBondContact O-N 3.25Å; R108-E112 VanDerWaalsContact O-N 3.07Å |
| 109 | R | 97.8 | Very high | 96.3 | Very high | 145 Ų | 145 | 113.3 Ų | 113.3 | 55% | 0.547 | 54% | 0.536 | S | S | . | . | H | α-helix | trans | -62.4 | -38.1 | 178.2 | -67.7 | 177.2 | -175.9 | -164.3 | 2.5 | 112.1 | E105 A106 E112 V113 | E105-R109 WeakPolarHBondContact O-CG 3.5Å; E105-R109 PolarHBondContact O-N 3.25Å; E105-R109 IonicContact OE1-CZ 2.97Å; E105-R109 IonicContact OE1-NE 3.35Å; E105-R109 PolarHBondContact OE1-NE 2.96Å; E105-R109 IonicContact OE1-NH2 3.3Å; E105-R109 PolarHBondContact OE1-NH2 3.26Å; A106-R109 PolarHBondContact O-N 3.13Å; R109-E112 PolarHBondContact O-N 2.98Å; R109-V113 WeakPolarHBondContact O-CG2 3.42Å; R109-V113 PolarHBondContact O-N 3.15Å |
| 110 | L | 98.3 | Very high | 97 | Very high | 100 Ų | 100 | 108.1 Ų | 108.1 | 52% | 0.524 | 53% | 0.525 | S | S | . | . | H | α-helix | trans | -60.2 | -48.4 | 174.9 | -171.7 | 84.6 | 0 | 0 | 0 | 111.1 | A106 R107 R108 E112 V113 E114 | A106-L110 WeakPolarHBondContact O-CB 3.42Å; A106-L110 PolarHBondContact O-N 2.99Å; R107-L110 WeakPolarHBondContact O-CB 3.42Å; R107-L110 PolarHBondContact O-N 3.31Å; R108-L110 VanDerWaalsContact C-N 3.31Å; R108-L110 PolarHBondContact O-N 3Å; L110-E112 VanDerWaalsContact C-N 3.29Å; L110-E112 PolarHBondContact O-N 3.44Å; L110-V113 PolarHBondContact O-N 3.37Å; L110-V113 VanDerWaalsContact O-N 3.12Å; L110-E114 WeakPolarHBondContact O-CG 3.47Å; L110-E114 PolarHBondContact O-N 2.92Å |
| 111 | L | 98.2 | Very high | 97.4 | Very high | 113 Ų | 113 | 108.1 Ų | 108.1 | 59% | 0.592 | 52% | 0.521 | S | S | * | . | H | α-helix | trans | -61.9 | -37.1 | 178.7 | -69.1 | 173.1 | 0 | 0 | 0 | 112.1 | R107 R108 E114 G115 | R107-L111 WeakPolarHBondContact O-CG 3.44Å; R107-L111 PolarHBondContact O-N 3.32Å; R108-L111 PolarHBondContact O-N 2.91Å; L111-E114 PolarHBondContact O-N 2.86Å; L111-G115 PolarHBondContact O-N 3.23Å |
| 112 | E | 98.1 | Very high | 97.6 | Very high | 79 Ų | 79 | 106.3 Ų | 106.3 | 37% | 0.369 | 51% | 0.509 | S | S | . | . | H | α-helix | trans | -62.6 | -43.1 | 173.7 | -70.1 | 174.3 | -172.7 | 0 | 0 | 111.6 | R108 R109 L110 G115 R116 | R108-E112 IonicContact CZ-OE1 3.29Å; R108-E112 VanDerWaalsContact CZ-OE1 3.29Å; R108-E112 IonicContact NE-OE1 3.69Å; R108-E112 PolarHBondContact NE-OE1 3.37Å; R108-E112 IonicContact NH2-OE1 2.84Å; R108-E112 PolarHBondContact NH2-OE1 3.39Å; R108-E112 WeakPolarHBondContact O-CG 3.43Å; R108-E112 PolarHBondContact O-N 3.25Å; R108-E112 VanDerWaalsContact O-N 3.07Å; R109-E112 PolarHBondContact O-N 2.98Å; L110-E112 VanDerWaalsContact C-N 3.29Å; L110-E112 PolarHBondContact O-N 3.44Å; E112-G115 PolarHBondContact O-N 3.26Å; E112-R116 WeakPolarHBondContact O-CG 3.38Å; E112-R116 PolarHBondContact O-N 3.03Å; E112-R116 VanDerWaalsContact O-N 3.1Å |
| 113 | V | 98.6 | Very high | 97.9 | Very high | 89 Ų | 89 | 105.2 Ų | 105.2 | 54% | 0.539 | 51% | 0.507 | S | S | . | . | H | α-helix | trans | -67.5 | -40 | 176.2 | 172.8 | 0 | 0 | 0 | 0 | 111.7 | R109 L110 G115 R116 R117 | R109-V113 WeakPolarHBondContact O-CG2 3.42Å; R109-V113 PolarHBondContact O-N 3.15Å; L110-V113 PolarHBondContact O-N 3.37Å; L110-V113 VanDerWaalsContact O-N 3.12Å; V113-G115 VanDerWaalsContact C-N 3.32Å; V113-G115 PolarHBondContact O-N 3.32Å; V113-R116 WeakPolarHBondContact O-CB 3.39Å; V113-R116 PolarHBondContact O-N 3.04Å; V113-R117 PolarHBondContact O-N 3.17Å |
| 114 | E | 98.1 | Very high | 97.9 | Very high | 72 Ų | 72 | 105.7 Ų | 105.7 | 34% | 0.336 | 51% | 0.507 | S | S | . | . | H | α-helix | trans | -63.1 | -39.1 | 174.2 | -73.4 | -179.2 | -179.4 | 0 | 0 | 111.9 | L110 L111 R116 R117 R118 | L110-E114 WeakPolarHBondContact O-CG 3.47Å; L110-E114 PolarHBondContact O-N 2.92Å; L111-E114 PolarHBondContact O-N 2.86Å; E114-R116 VanDerWaalsContact C-N 3.34Å; E114-R116 PolarHBondContact O-N 3.44Å; E114-R117 PolarHBondContact O-N 2.88Å; E114-R118 WeakPolarHBondContact O-CG 3.35Å; E114-R118 PolarHBondContact O-N 3.1Å |
| 115 | G | 97.9 | Very high | 98.1 | Very high | 32 Ų | 32 | 106.4 Ų | 106.4 | 33% | 0.33 | 51% | 0.508 | S | S | . | . | H | α-helix | trans | -58.5 | -45.5 | 172.3 | 0 | 0 | 0 | 0 | 0 | 111.9 | L111 E112 V113 R118 L119 | L111-G115 PolarHBondContact O-N 3.23Å; E112-G115 PolarHBondContact O-N 3.26Å; V113-G115 VanDerWaalsContact C-N 3.32Å; V113-G115 PolarHBondContact O-N 3.32Å; G115-R118 PolarHBondContact O-N 3.22Å; G115-L119 PolarHBondContact O-N 3.5Å |
| 116 | R | 98.3 | Very high | 98.2 | Very high | 172 Ų | 172 | 109 Ų | 109 | 65% | 0.649 | 52% | 0.515 | S | S | * | . | H | α-helix | trans | -63.5 | -41.7 | 174.9 | -66.8 | 174.3 | -173 | -173.9 | 2.9 | 112.2 | E112 V113 E114 R118 L119 V120 | E112-R116 WeakPolarHBondContact O-CG 3.38Å; E112-R116 PolarHBondContact O-N 3.03Å; E112-R116 VanDerWaalsContact O-N 3.1Å; V113-R116 WeakPolarHBondContact O-CB 3.39Å; V113-R116 PolarHBondContact O-N 3.04Å; E114-R116 VanDerWaalsContact C-N 3.34Å; E114-R116 PolarHBondContact O-N 3.44Å; R116-R118 VanDerWaalsContact C-N 3.34Å; R116-R118 PolarHBondContact O-N 3.22Å; R116-L119 PolarHBondContact O-N 3.18Å; R116-V120 WeakPolarHBondContact O-CG2 3.49Å; R116-V120 PolarHBondContact O-N 3.21Å |
| 117 | R | 98.4 | Very high | 98.3 | Very high | 188 Ų | 188 | 111 Ų | 111 | 71% | 0.709 | 52% | 0.521 | S | S | * | . | H | α-helix | trans | -60 | -42.9 | 177.4 | -177.3 | -178.7 | 174.2 | -164.4 | -0.7 | 111.7 | V113 E114 L119 V120 S121 | V113-R117 PolarHBondContact O-N 3.17Å; E114-R117 PolarHBondContact O-N 2.88Å; R117-L119 VanDerWaalsContact C-N 3.35Å; R117-L119 PolarHBondContact O-N 3.09Å; R117-V120 PolarHBondContact O-N 3.29Å; R117-S121 PolarHBondContact O-N 2.97Å; R117-S121 PolarHBondContact O-OG 2.67Å |
| 118 | R | 98.6 | Very high | 98.4 | Very high | 167 Ų | 167 | 107.7 Ų | 107.7 | 63% | 0.63 | 52% | 0.515 | S | S | * | . | H | α-helix | trans | -60.5 | -44.3 | 177 | -69.3 | 173.8 | -168.3 | -165.9 | 4.5 | 111.6 | E114 G115 R116 V120 S121 E122 | E114-R118 WeakPolarHBondContact O-CG 3.35Å; E114-R118 PolarHBondContact O-N 3.1Å; G115-R118 PolarHBondContact O-N 3.22Å; R116-R118 VanDerWaalsContact C-N 3.34Å; R116-R118 PolarHBondContact O-N 3.22Å; R118-V120 VanDerWaalsContact C-N 3.34Å; R118-V120 PolarHBondContact O-N 3.27Å; R118-S121 PolarHBondContact O-N 3.5Å; R118-E122 WeakPolarHBondContact O-CG 3.48Å; R118-E122 PolarHBondContact O-N 3.32Å |
| 119 | L | 98.6 | Very high | 98.5 | Very high | 106 Ų | 106 | 106.2 Ų | 106.2 | 56% | 0.555 | 52% | 0.515 | S | S | * | . | H | α-helix | trans | -61.3 | -41.4 | 176.5 | -67.6 | 172.7 | 0 | 0 | 0 | 112.3 | G115 R116 R117 E122 L123 | G115-L119 PolarHBondContact O-N 3.5Å; R116-L119 PolarHBondContact O-N 3.18Å; R117-L119 VanDerWaalsContact C-N 3.35Å; R117-L119 PolarHBondContact O-N 3.09Å; L119-E122 PolarHBondContact O-N 2.83Å; L119-L123 WeakPolarHBondContact O-CG 3.46Å; L119-L123 PolarHBondContact O-N 3.37Å |
| 120 | V | 98.7 | Very high | 98.5 | Very high | 76 Ų | 76 | 104 Ų | 104 | 46% | 0.461 | 51% | 0.513 | S | S | . | . | H | α-helix | trans | -62.9 | -45.7 | 176 | 174 | 0 | 0 | 0 | 0 | 110.6 | R116 R117 R118 E122 L123 E124 | R116-V120 WeakPolarHBondContact O-CG2 3.49Å; R116-V120 PolarHBondContact O-N 3.21Å; R117-V120 PolarHBondContact O-N 3.29Å; R118-V120 VanDerWaalsContact C-N 3.34Å; R118-V120 PolarHBondContact O-N 3.27Å; V120-E122 VanDerWaalsContact C-N 3.31Å; V120-E122 PolarHBondContact O-N 2.85Å; V120-L123 WeakPolarHBondContact O-CB 3.46Å; V120-L123 PolarHBondContact O-N 2.97Å; V120-L123 VanDerWaalsContact O-N 3.13Å; V120-E124 HydrophobicContact CG1-CG 4.4Å; V120-E124 WeakPolarHBondContact O-CG 3.38Å; V120-E124 PolarHBondContact O-N 3.21Å |
| 121 | S | 98.5 | Very high | 98.5 | Very high | 57 Ų | 57 | 104.2 Ų | 104.2 | 40% | 0.399 | 51% | 0.512 | S | S | . | . | H | α-helix | trans | -63.1 | -35.1 | 176.6 | -60.9 | 0 | 0 | 0 | 0 | 113 | R117 R118 S125 | R117-S121 PolarHBondContact O-N 2.97Å; R117-S121 PolarHBondContact O-OG 2.67Å; R118-S121 PolarHBondContact O-N 3.5Å; S121-S125 WeakPolarHBondContact O-CB 3.38Å; S121-S125 PolarHBondContact O-N 3.48Å |
| 122 | E | 98.8 | Very high | 98.6 | Very high | 91 Ų | 91 | 107.6 Ų | 107.6 | 43% | 0.425 | 52% | 0.516 | S | S | . | . | H | α-helix | trans | -64.7 | -43.8 | 171.8 | -75.3 | -178.2 | -159.5 | 0 | 0 | 111.8 | R118 L119 V120 S125 R126 | R118-E122 WeakPolarHBondContact O-CG 3.48Å; R118-E122 PolarHBondContact O-N 3.32Å; L119-E122 PolarHBondContact O-N 2.83Å; V120-E122 VanDerWaalsContact C-N 3.31Å; V120-E122 PolarHBondContact O-N 2.85Å; E122-S125 PolarHBondContact O-N 3.42Å; E122-S125 PolarHBondContact O-OG 3.35Å; E122-R126 WeakPolarHBondContact O-CG 3.32Å; E122-R126 PolarHBondContact O-N 3.15Å; E122-R126 IonicContact OE2-NH2 2.67Å |
| 123 | L | 98.9 | Very high | 98.6 | Very high | 105 Ų | 105 | 107.9 Ų | 107.9 | 55% | 0.55 | 52% | 0.523 | S | S | . | . | H | α-helix | trans | -62.6 | -45.4 | 176.4 | -72.2 | 172.8 | 0 | 0 | 0 | 111.3 | L119 V120 S125 R126 V127 | L119-L123 WeakPolarHBondContact O-CG 3.46Å; L119-L123 PolarHBondContact O-N 3.37Å; V120-L123 WeakPolarHBondContact O-CB 3.46Å; V120-L123 PolarHBondContact O-N 2.97Å; V120-L123 VanDerWaalsContact O-N 3.13Å; L123-S125 VanDerWaalsContact C-N 3.29Å; L123-S125 PolarHBondContact O-N 3.44Å; L123-R126 PolarHBondContact O-N 3.16Å; L123-R126 VanDerWaalsContact O-N 3.15Å; L123-V127 VanDerWaalsContact O-CG2 3.29Å; L123-V127 WeakPolarHBondContact O-CG2 3.45Å; L123-V127 PolarHBondContact O-N 3.41Å |
| 124 | E | 98.6 | Very high | 98.6 | Very high | 111 Ų | 111 | 109.6 Ų | 109.6 | 52% | 0.519 | 52% | 0.524 | S | S | . | . | H | α-helix | trans | -56.1 | -45 | 174.2 | -72 | 170.2 | 175.1 | 0 | 0 | 111.1 | V120 R126 V127 L128 | V120-E124 HydrophobicContact CG1-CG 4.4Å; V120-E124 WeakPolarHBondContact O-CG 3.38Å; V120-E124 PolarHBondContact O-N 3.21Å; E124-R126 VanDerWaalsContact C-N 3.35Å; E124-R126 PolarHBondContact O-N 3.09Å; E124-V127 PolarHBondContact O-N 3.13Å; E124-L128 WeakPolarHBondContact O-CG 3.47Å; E124-L128 PolarHBondContact O-N 2.95Å |
| 125 | S | 98.6 | Very high | 98.6 | Very high | 67 Ų | 67 | 110 Ų | 110 | 47% | 0.469 | 53% | 0.528 | S | S | . | . | H | α-helix | trans | -61.6 | -41.3 | 177.4 | 79.3 | 0 | 0 | 0 | 0 | 112.5 | S121 E122 L123 L128 Q129 | S121-S125 WeakPolarHBondContact O-CB 3.38Å; S121-S125 PolarHBondContact O-N 3.48Å; E122-S125 PolarHBondContact O-N 3.42Å; E122-S125 PolarHBondContact O-OG 3.35Å; L123-S125 VanDerWaalsContact C-N 3.29Å; L123-S125 PolarHBondContact O-N 3.44Å; S125-L128 PolarHBondContact O-N 3.36Å; S125-Q129 WeakPolarHBondContact O-CB 3.29Å; S125-Q129 PolarHBondContact O-N 3.31Å |
| 126 | R | 98.8 | Very high | 98.7 | Very high | 142 Ų | 142 | 110 Ų | 110 | 54% | 0.536 | 53% | 0.525 | S | S | . | . | H | α-helix | trans | -70.2 | -38.2 | 177.9 | -69 | 175.2 | -169.2 | -175.4 | 7.8 | 111.9 | E122 L123 E124 Q129 L130 | E122-R126 WeakPolarHBondContact O-CG 3.32Å; E122-R126 PolarHBondContact O-N 3.15Å; E122-R126 IonicContact OE2-NH2 2.67Å; L123-R126 PolarHBondContact O-N 3.16Å; L123-R126 VanDerWaalsContact O-N 3.15Å; E124-R126 VanDerWaalsContact C-N 3.35Å; E124-R126 PolarHBondContact O-N 3.09Å; R126-Q129 WeakPolarHBondContact O-CB 3.33Å; R126-Q129 PolarHBondContact O-N 3.43Å; R126-L130 WeakPolarHBondContact O-CG 3.49Å; R126-L130 PolarHBondContact O-N 3.26Å |
| 127 | V | 98.8 | Very high | 98.7 | Very high | 94 Ų | 94 | 103.5 Ų | 103.5 | 57% | 0.57 | 51% | 0.508 | S | S | * | . | H | α-helix | trans | -63.4 | -45.6 | 175.6 | 169.9 | 0 | 0 | 0 | 0 | 110.3 | L123 E124 Q129 L130 H131 | L123-V127 VanDerWaalsContact O-CG2 3.29Å; L123-V127 WeakPolarHBondContact O-CG2 3.45Å; L123-V127 PolarHBondContact O-N 3.41Å; E124-V127 PolarHBondContact O-N 3.13Å; V127-Q129 VanDerWaalsContact C-N 3.3Å; V127-Q129 PolarHBondContact O-N 3.02Å; V127-L130 PolarHBondContact O-N 3.42Å; V127-H131 WeakPolarHBondContact O-CB 3.43Å; V127-H131 PolarHBondContact O-N 3.27Å |
| 128 | L | 98.8 | Very high | 98.7 | Very high | 100 Ų | 100 | 100.2 Ų | 100.2 | 52% | 0.524 | 50% | 0.5 | S | S | . | . | H | α-helix | trans | -63.2 | -37.5 | 175.3 | -69.3 | 174.4 | 0 | 0 | 0 | 111.9 | E124 S125 H131 R132 | E124-L128 WeakPolarHBondContact O-CG 3.47Å; E124-L128 PolarHBondContact O-N 2.95Å; S125-L128 PolarHBondContact O-N 3.36Å; L128-H131 PolarHBondContact O-N 3.3Å; L128-R132 WeakPolarHBondContact O-CG 3.49Å; L128-R132 PolarHBondContact O-N 2.81Å; L128-R132 VanDerWaalsContact O-N 3.15Å |
| 129 | Q | 98.7 | Very high | 98.7 | Very high | 124 Ų | 124 | 98.4 Ų | 98.4 | 58% | 0.579 | 50% | 0.503 | S | S | * | . | H | α-helix | trans | -63.5 | -46.4 | 174 | -175.1 | 176.4 | 7.2 | 0 | 0 | 111.6 | S125 R126 V127 H131 R132 V133 | S125-Q129 WeakPolarHBondContact O-CB 3.29Å; S125-Q129 PolarHBondContact O-N 3.31Å; R126-Q129 WeakPolarHBondContact O-CB 3.33Å; R126-Q129 PolarHBondContact O-N 3.43Å; V127-Q129 VanDerWaalsContact C-N 3.3Å; V127-Q129 PolarHBondContact O-N 3.02Å; Q129-H131 VanDerWaalsContact C-N 3.34Å; Q129-H131 PolarHBondContact O-N 3.29Å; Q129-R132 PolarHBondContact O-N 3.47Å; Q129-V133 WeakPolarHBondContact O-CG2 3.47Å; Q129-V133 PolarHBondContact O-N 3.32Å; Q129-V133 VanDerWaalsContact O-N 3.13Å |
| 130 | L | 98.8 | Very high | 98.7 | Very high | 99 Ų | 99 | 100.9 Ų | 100.9 | 52% | 0.518 | 51% | 0.505 | S | S | . | . | H | α-helix | trans | -60.3 | -44.9 | 176 | -74.9 | 173.4 | 0 | 0 | 0 | 111.1 | R126 V127 R132 V133 F134 | R126-L130 WeakPolarHBondContact O-CG 3.49Å; R126-L130 PolarHBondContact O-N 3.26Å; V127-L130 PolarHBondContact O-N 3.42Å; L130-R132 VanDerWaalsContact C-N 3.3Å; L130-R132 PolarHBondContact O-N 2.87Å; L130-V133 CarbonylContact O-C 3.58Å; L130-V133 WeakPolarHBondContact O-CA 3.49Å; L130-V133 WeakPolarHBondContact O-CB 3.4Å; L130-V133 PolarHBondContact O-N 3.15Å; L130-F134 HydrophobicContact CB-CD2 4.3Å; L130-F134 HydrophobicContact CB-CE2 4.32Å; L130-F134 WeakPolarHBondContact O-CD2 3.25Å; L130-F134 PolarHBondContact O-N 3.25Å |
| 131 | H | 98.8 | Very high | 98.7 | Very high | 105 Ų | 105 | 102.6 Ų | 102.6 | 49% | 0.486 | 51% | 0.511 | S | S | . | . | H | α-helix | trans | -55.6 | -44.2 | 177.5 | 178.9 | 62.4 | 0 | 0 | 0 | 112.1 | V127 L128 Q129 V133 F134 L135 | V127-H131 WeakPolarHBondContact O-CB 3.43Å; V127-H131 PolarHBondContact O-N 3.27Å; L128-H131 PolarHBondContact O-N 3.3Å; Q129-H131 VanDerWaalsContact C-N 3.34Å; Q129-H131 PolarHBondContact O-N 3.29Å; H131-V133 VanDerWaalsContact C-N 3.33Å; H131-V133 PolarHBondContact O-N 3.45Å; H131-F134 PolarHBondContact O-N 3.18Å; H131-L135 WeakPolarHBondContact NE2-CD1 3.36Å; H131-L135 WeakPolarHBondContact O-CG 3.41Å; H131-L135 PolarHBondContact O-N 3.24Å |
| 132 | R | 98.7 | Very high | 98.6 | Very high | 183 Ų | 183 | 102.2 Ų | 102.2 | 69% | 0.691 | 51% | 0.511 | S | S | * | . | H | α-helix | trans | -62.1 | -39.9 | 175.1 | -68.2 | 172.6 | -174.1 | 171.1 | 2.6 | 112.4 | L128 Q129 L130 A136 | L128-R132 WeakPolarHBondContact O-CG 3.49Å; L128-R132 PolarHBondContact O-N 2.81Å; L128-R132 VanDerWaalsContact O-N 3.15Å; Q129-R132 PolarHBondContact O-N 3.47Å; L130-R132 VanDerWaalsContact C-N 3.3Å; L130-R132 PolarHBondContact O-N 2.87Å; R132-A136 WeakPolarHBondContact O-CB 3.46Å; R132-A136 PolarHBondContact O-N 3.32Å; R132-A136 VanDerWaalsContact O-N 3.09Å |
| 133 | V | 98.8 | Very high | 98.6 | Very high | 85 Ų | 85 | 104.1 Ų | 104.1 | 52% | 0.515 | 52% | 0.52 | S | S | . | . | H | α-helix | trans | -67.8 | -41.6 | 177.2 | 176.3 | 0 | 0 | 0 | 0 | 111.1 | Q129 L130 H131 A136 A137 | Q129-V133 WeakPolarHBondContact O-CG2 3.47Å; Q129-V133 PolarHBondContact O-N 3.32Å; Q129-V133 VanDerWaalsContact O-N 3.13Å; L130-V133 CarbonylContact O-C 3.58Å; L130-V133 WeakPolarHBondContact O-CA 3.49Å; L130-V133 WeakPolarHBondContact O-CB 3.4Å; L130-V133 PolarHBondContact O-N 3.15Å; H131-V133 VanDerWaalsContact C-N 3.33Å; H131-V133 PolarHBondContact O-N 3.45Å; V133-A136 PolarHBondContact O-N 3.09Å; V133-A137 WeakPolarHBondContact O-CB 3.19Å; V133-A137 PolarHBondContact O-N 2.87Å |
| 134 | F | 98.8 | Very high | 98.6 | Very high | 125 Ų | 125 | 107 Ų | 107 | 55% | 0.548 | 52% | 0.523 | S | S | . | . | H | α-helix | trans | -61.7 | -48.4 | 176.2 | -84.5 | -69.6 | 0 | 0 | 0 | 111.5 | L130 H131 A136 A137 E138 | L130-F134 HydrophobicContact CB-CD2 4.3Å; L130-F134 HydrophobicContact CB-CE2 4.32Å; L130-F134 WeakPolarHBondContact O-CD2 3.25Å; L130-F134 PolarHBondContact O-N 3.25Å; H131-F134 PolarHBondContact O-N 3.18Å; F134-A136 VanDerWaalsContact C-N 3.3Å; F134-A136 PolarHBondContact O-N 2.9Å; F134-A137 CarbonylContact O-C 3.6Å; F134-A137 WeakPolarHBondContact O-CB 3.38Å; F134-A137 PolarHBondContact O-N 3.49Å; F134-E138 WeakPolarHBondContact O-CG 3.24Å; F134-E138 PolarHBondContact O-N 3.44Å |
| 135 | L | 98.8 | Very high | 98.6 | Very high | 80 Ų | 80 | 104 Ų | 104 | 42% | 0.419 | 52% | 0.518 | S | S | . | . | H | α-helix | trans | -57.5 | -43.8 | 175.5 | -72.8 | 176.9 | 0 | 0 | 0 | 112 | H131 A137 E138 L139 | H131-L135 WeakPolarHBondContact NE2-CD1 3.36Å; H131-L135 WeakPolarHBondContact O-CG 3.41Å; H131-L135 PolarHBondContact O-N 3.24Å; L135-A137 VanDerWaalsContact C-N 3.32Å; L135-A137 PolarHBondContact O-N 3.41Å; L135-E138 PolarHBondContact O-N 3.04Å; L135-L139 WeakPolarHBondContact O-CG 3.47Å; L135-L139 PolarHBondContact O-N 3.33Å; L135-L139 VanDerWaalsContact O-N 3.08Å |
| 136 | A | 98.6 | Very high | 98.5 | Very high | 34 Ų | 34 | 106.3 Ų | 106.3 | 28% | 0.281 | 52% | 0.521 | S | S | . | . | H | α-helix | trans | -64.6 | -36.5 | 176.3 | 0 | 0 | 0 | 0 | 0 | 112.4 | R132 V133 F134 R140 | R132-A136 WeakPolarHBondContact O-CB 3.46Å; R132-A136 PolarHBondContact O-N 3.32Å; R132-A136 VanDerWaalsContact O-N 3.09Å; V133-A136 PolarHBondContact O-N 3.09Å; F134-A136 VanDerWaalsContact C-N 3.3Å; F134-A136 PolarHBondContact O-N 2.9Å; A136-R140 VanDerWaalsContact O-CG 3.25Å; A136-R140 WeakPolarHBondContact O-CG 3.42Å; A136-R140 PolarHBondContact O-N 3.13Å |
| 137 | A | 98.6 | Very high | 98.5 | Very high | 34 Ų | 34 | 102 Ų | 102 | 28% | 0.281 | 51% | 0.512 | S | S | . | . | H | α-helix | trans | -69.1 | -42.7 | 176.7 | 0 | 0 | 0 | 0 | 0 | 111.8 | V133 F134 L135 L139 R140 L141 | V133-A137 WeakPolarHBondContact O-CB 3.19Å; V133-A137 PolarHBondContact O-N 2.87Å; F134-A137 CarbonylContact O-C 3.6Å; F134-A137 WeakPolarHBondContact O-CB 3.38Å; F134-A137 PolarHBondContact O-N 3.49Å; L135-A137 VanDerWaalsContact C-N 3.32Å; L135-A137 PolarHBondContact O-N 3.41Å; A137-L139 PolarHBondContact O-N 2.82Å; A137-R140 PolarHBondContact O-N 3.08Å; A137-L141 WeakPolarHBondContact O-CG 3.43Å; A137-L141 PolarHBondContact O-N 3.2Å |
| 138 | E | 98.5 | Very high | 98.4 | Very high | 119 Ų | 119 | 102.7 Ų | 102.7 | 56% | 0.556 | 51% | 0.513 | S | S | * | . | H | α-helix | trans | -59.5 | -46.6 | 176.6 | -75.5 | -179.4 | 179.9 | 0 | 0 | 111.6 | F134 L135 R140 L141 A142 | F134-E138 WeakPolarHBondContact O-CG 3.24Å; F134-E138 PolarHBondContact O-N 3.44Å; L135-E138 PolarHBondContact O-N 3.04Å; E138-R140 VanDerWaalsContact C-N 3.32Å; E138-R140 PolarHBondContact O-N 2.95Å; E138-L141 PolarHBondContact O-N 3.25Å; E138-L141 VanDerWaalsContact O-N 3.13Å; E138-A142 WeakPolarHBondContact O-CB 3.4Å; E138-A142 PolarHBondContact O-N 2.77Å |
| 139 | L | 98.3 | Very high | 98.4 | Very high | 129 Ų | 129 | 101.6 Ų | 101.6 | 68% | 0.675 | 51% | 0.513 | S | S | * | . | H | α-helix | trans | -61.2 | -40.7 | 176.8 | -69.9 | 174.1 | 0 | 0 | 0 | 112.3 | L135 A137 L141 A142 H143 | L135-L139 WeakPolarHBondContact O-CG 3.47Å; L135-L139 PolarHBondContact O-N 3.33Å; L135-L139 VanDerWaalsContact O-N 3.08Å; A137-L139 PolarHBondContact O-N 2.82Å; L139-L141 VanDerWaalsContact C-N 3.34Å; L139-A142 PolarHBondContact O-N 3.41Å; L139-H143 PolarHBondContact O-N 3.49Å |
| 140 | R | 98.4 | Very high | 98.3 | Very high | 159 Ų | 159 | 105.5 Ų | 105.5 | 60% | 0.6 | 52% | 0.523 | S | S | * | . | H | α-helix | trans | -65.3 | -38 | 175.3 | -69.6 | 171.6 | -158.8 | 151.7 | 3.5 | 111.8 | A136 A137 E138 R144 | A136-R140 VanDerWaalsContact O-CG 3.25Å; A136-R140 WeakPolarHBondContact O-CG 3.42Å; A136-R140 PolarHBondContact O-N 3.13Å; A137-R140 PolarHBondContact O-N 3.08Å; E138-R140 VanDerWaalsContact C-N 3.32Å; E138-R140 PolarHBondContact O-N 2.95Å; R140-R144 VanDerWaalsContact O-CG 3.3Å; R140-R144 WeakPolarHBondContact O-CG 3.38Å; R140-R144 PolarHBondContact O-N 3.14Å |
| 141 | L | 98.4 | Very high | 98.3 | Very high | 111 Ų | 111 | 106.2 Ų | 106.2 | 58% | 0.581 | 53% | 0.527 | S | S | * | . | H | α-helix | trans | -68.8 | -41.7 | 177.1 | -73.2 | 173.4 | 0 | 0 | 0 | 111.5 | A137 E138 L139 H143 R144 A145 | A137-L141 WeakPolarHBondContact O-CG 3.43Å; A137-L141 PolarHBondContact O-N 3.2Å; E138-L141 PolarHBondContact O-N 3.25Å; E138-L141 VanDerWaalsContact O-N 3.13Å; L139-L141 VanDerWaalsContact C-N 3.34Å; L141-H143 PolarHBondContact O-N 3.45Å; L141-R144 PolarHBondContact O-N 2.94Å; L141-A145 WeakPolarHBondContact O-CB 3.41Å; L141-A145 PolarHBondContact O-N 3.47Å |
| 142 | A | 98.4 | Very high | 98.2 | Very high | 50 Ų | 50 | 104.6 Ų | 104.6 | 41% | 0.413 | 53% | 0.527 | S | S | . | . | H | α-helix | trans | -58.1 | -48.6 | 174.6 | 0 | 0 | 0 | 0 | 0 | 111.1 | E138 L139 R144 A145 E146 | E138-A142 WeakPolarHBondContact O-CB 3.4Å; E138-A142 PolarHBondContact O-N 2.77Å; L139-A142 PolarHBondContact O-N 3.41Å; A142-R144 VanDerWaalsContact C-N 3.33Å; A142-R144 PolarHBondContact O-N 3.37Å; A142-A145 WeakPolarHBondContact O-CB 3.48Å; A142-A145 PolarHBondContact O-N 3.2Å; A142-A145 VanDerWaalsContact O-N 3.14Å; A142-E146 PolarHBondContact O-N 2.98Å; A142-E146 VanDerWaalsContact O-N 3.08Å |
| 143 | H | 98.4 | Very high | 98.2 | Very high | 131 Ų | 131 | 97.8 Ų | 97.8 | 61% | 0.606 | 51% | 0.514 | S | S | * | . | H | α-helix | trans | -60 | -41.9 | 176.3 | -176.5 | 63.2 | 0 | 0 | 0 | 112.8 | L139 L141 E146 S147 | L139-H143 PolarHBondContact O-N 3.49Å; L141-H143 PolarHBondContact O-N 3.45Å; H143-E146 PolarHBondContact O-N 2.66Å; H143-S147 PolarHBondContact O-N 3.04Å |
| 144 | R | 98.2 | Very high | 98.1 | Very high | 164 Ų | 164 | 95.7 Ų | 95.7 | 62% | 0.619 | 51% | 0.509 | S | S | * | . | H | α-helix | trans | -64.8 | -40.2 | 175.5 | -74.2 | 176.8 | -177.6 | -158.8 | 1.1 | 111.7 | R140 L141 A142 E146 S147 L148 | R140-R144 VanDerWaalsContact O-CG 3.3Å; R140-R144 WeakPolarHBondContact O-CG 3.38Å; R140-R144 PolarHBondContact O-N 3.14Å; L141-R144 PolarHBondContact O-N 2.94Å; A142-R144 VanDerWaalsContact C-N 3.33Å; A142-R144 PolarHBondContact O-N 3.37Å; R144-E146 VanDerWaalsContact C-N 3.31Å; R144-E146 PolarHBondContact O-N 3.33Å; R144-S147 PolarHBondContact O-N 2.9Å; R144-S147 PolarHBondContact O-OG 3.38Å; R144-L148 WeakPolarHBondContact O-CG 3.25Å; R144-L148 PolarHBondContact O-N 3Å |
| 145 | A | 98.3 | Very high | 98.1 | Very high | 49 Ų | 49 | 93.6 Ų | 93.6 | 41% | 0.405 | 51% | 0.507 | S | S | . | . | H | α-helix | trans | -61.4 | -40.4 | 178.6 | 0 | 0 | 0 | 0 | 0 | 111.7 | L141 A142 L148 S149 | L141-A145 WeakPolarHBondContact O-CB 3.41Å; L141-A145 PolarHBondContact O-N 3.47Å; A142-A145 WeakPolarHBondContact O-CB 3.48Å; A142-A145 PolarHBondContact O-N 3.2Å; A142-A145 VanDerWaalsContact O-N 3.14Å; A145-L148 PolarHBondContact O-N 3.23Å; A145-S149 WeakPolarHBondContact O-CB 3.2Å; A145-S149 PolarHBondContact O-N 3.42Å; A145-S149 PolarHBondContact O-OG 3.44Å |
| 146 | E | 97.5 | Very high | 98.1 | Very high | 116 Ų | 116 | 92 Ų | 92 | 54% | 0.542 | 51% | 0.505 | S | S | . | . | H | α-helix | trans | -62 | -44.3 | 173.6 | -68.7 | 174.9 | -169.6 | 0 | 0 | 112.1 | A142 H143 R144 L148 S149 R150 | A142-E146 PolarHBondContact O-N 2.98Å; A142-E146 VanDerWaalsContact O-N 3.08Å; H143-E146 PolarHBondContact O-N 2.66Å; R144-E146 VanDerWaalsContact C-N 3.31Å; R144-E146 PolarHBondContact O-N 3.33Å; E146-L148 VanDerWaalsContact C-N 3.33Å; E146-L148 PolarHBondContact O-N 2.91Å; E146-S149 WeakPolarHBondContact O-CB 3.32Å; E146-S149 PolarHBondContact O-N 3.14Å; E146-R150 PolarHBondContact O-N 3.37Å |
| 147 | S | 97.3 | Very high | 98 | Very high | 50 Ų | 50 | 97.3 Ų | 97.3 | 35% | 0.35 | 52% | 0.524 | S | S | . | . | H | α-helix | trans | -62.1 | -41.5 | 177 | 75.1 | 0 | 0 | 0 | 0 | 111.9 | H143 R144 S149 R150 L151 | H143-S147 PolarHBondContact O-N 3.04Å; R144-S147 PolarHBondContact O-N 2.9Å; R144-S147 PolarHBondContact O-OG 3.38Å; S147-S149 VanDerWaalsContact C-N 3.31Å; S147-S149 PolarHBondContact O-N 2.82Å; S147-R150 PolarHBondContact O-N 3.23Å; S147-L151 WeakPolarHBondContact O-CG 3.48Å; S147-L151 PolarHBondContact O-N 3.48Å |
| 148 | L | 98.4 | Very high | 97.9 | Very high | 110 Ų | 110 | 98 Ų | 98 | 58% | 0.576 | 53% | 0.529 | S | S | * | . | H | α-helix | trans | -65.7 | -35.1 | 175.4 | -71.3 | 174.3 | 0 | 0 | 0 | 111.7 | R144 A145 E146 L151 S152 | R144-L148 WeakPolarHBondContact O-CG 3.25Å; R144-L148 PolarHBondContact O-N 3Å; A145-L148 PolarHBondContact O-N 3.23Å; E146-L148 VanDerWaalsContact C-N 3.33Å; E146-L148 PolarHBondContact O-N 2.91Å; L148-L151 HydrophobicContact CD2-CD1 4.43Å; L148-L151 PolarHBondContact O-N 3.05Å; L148-S152 WeakPolarHBondContact O-CB 3.46Å; L148-S152 PolarHBondContact O-N 3.22Å; L148-S152 PolarHBondContact O-OG 3.18Å |
| 149 | S | 97.3 | Very high | 97.8 | Very high | 77 Ų | 77 | 98.3 Ų | 98.3 | 54% | 0.538 | 53% | 0.531 | S | S | . | . | H | α-helix | trans | -67.4 | -36.1 | 177.3 | -57.8 | 0 | 0 | 0 | 0 | 112 | A145 E146 S147 S152 G153 | A145-S149 WeakPolarHBondContact O-CB 3.2Å; A145-S149 PolarHBondContact O-N 3.42Å; A145-S149 PolarHBondContact O-OG 3.44Å; E146-S149 WeakPolarHBondContact O-CB 3.32Å; E146-S149 PolarHBondContact O-N 3.14Å; S147-S149 VanDerWaalsContact C-N 3.31Å; S147-S149 PolarHBondContact O-N 2.82Å; S149-S152 WeakPolarHBondContact CA-OG 3.38Å; S149-S152 PolarHBondContact O-OG 3.08Å; S149-G153 PolarHBondContact O-N 2.99Å; S149-G153 VanDerWaalsContact O-N 3.09Å |
| 150 | R | 97.3 | Very high | 97.8 | Very high | 205 Ų | 205 | 98.2 Ų | 98.2 | 77% | 0.774 | 53% | 0.53 | S | S | * | . | H | α-helix | trans | -68.4 | -42.2 | 172.7 | -67.7 | 174.6 | -177.9 | -101.6 | 1.1 | 111.6 | E146 S147 G153 G154 | E146-R150 PolarHBondContact O-N 3.37Å; S147-R150 PolarHBondContact O-N 3.23Å; R150-G153 PolarHBondContact O-N 3.08Å; R150-G154 PolarHBondContact O-N 3.04Å; R150-G154 VanDerWaalsContact O-N 3.14Å |
| 151 | L | 98.2 | Very high | 97.6 | Very high | 115 Ų | 115 | 97.2 Ų | 97.2 | 60% | 0.602 | 53% | 0.527 | S | S | * | . | H | α-helix | trans | -64.3 | -44.5 | 176.2 | -70.8 | 170.7 | 0 | 0 | 0 | 111.5 | S147 L148 G153 G154 V155 | S147-L151 WeakPolarHBondContact O-CG 3.48Å; S147-L151 PolarHBondContact O-N 3.48Å; L148-L151 HydrophobicContact CD2-CD1 4.43Å; L148-L151 PolarHBondContact O-N 3.05Å; L151-G153 VanDerWaalsContact C-N 3.32Å; L151-G153 PolarHBondContact O-N 3.44Å; L151-G154 WeakPolarHBondContact O-CA 3.47Å; L151-G154 PolarHBondContact O-N 2.83Å; L151-G154 VanDerWaalsContact O-N 3.1Å; L151-V155 WeakPolarHBondContact O-CG2 3.46Å; L151-V155 PolarHBondContact O-N 3.19Å |
| 152 | S | 98 | Very high | 97.4 | Very high | 70 Ų | 70 | 96.7 Ų | 96.7 | 49% | 0.49 | 53% | 0.525 | S | S | . | . | H | α-helix | trans | -64.3 | -37 | 178.9 | 67.2 | 0 | 0 | 0 | 0 | 112 | L148 S149 G154 V155 A156 | L148-S152 WeakPolarHBondContact O-CB 3.46Å; L148-S152 PolarHBondContact O-N 3.22Å; L148-S152 PolarHBondContact O-OG 3.18Å; S149-S152 WeakPolarHBondContact CA-OG 3.38Å; S149-S152 PolarHBondContact O-OG 3.08Å; S152-G154 VanDerWaalsContact C-N 3.35Å; S152-G154 PolarHBondContact O-N 3.12Å; S152-V155 PolarHBondContact O-N 3.29Å; S152-A156 WeakPolarHBondContact O-CB 3.3Å; S152-A156 PolarHBondContact O-N 3.5Å |
| 153 | G | 97.7 | Very high | 97.3 | Very high | 40 Ų | 40 | 98.3 Ų | 98.3 | 41% | 0.412 | 54% | 0.539 | S | S | . | . | H | α-helix | trans | -59.8 | -42.8 | 170.1 | 0 | 0 | 0 | 0 | 0 | 112.8 | S149 R150 L151 A156 Q157 | S149-G153 PolarHBondContact O-N 2.99Å; S149-G153 VanDerWaalsContact O-N 3.09Å; R150-G153 PolarHBondContact O-N 3.08Å; L151-G153 VanDerWaalsContact C-N 3.32Å; L151-G153 PolarHBondContact O-N 3.44Å; G153-A156 PolarHBondContact O-N 3.37Å; G153-Q157 WeakPolarHBondContact O-CB 3.5Å; G153-Q157 PolarHBondContact O-N 2.82Å |
| 154 | G | 97.8 | Very high | 97.1 | Very high | 41 Ų | 41 | 95.4 Ų | 95.4 | 42% | 0.423 | 54% | 0.537 | S | S | . | . | H | α-helix | trans | -64.9 | -39.9 | 174.4 | 0 | 0 | 0 | 0 | 0 | 113.3 | R150 L151 S152 Q157 A158 | R150-G154 PolarHBondContact O-N 3.04Å; R150-G154 VanDerWaalsContact O-N 3.14Å; L151-G154 WeakPolarHBondContact O-CA 3.47Å; L151-G154 PolarHBondContact O-N 2.83Å; L151-G154 VanDerWaalsContact O-N 3.1Å; S152-G154 VanDerWaalsContact C-N 3.35Å; S152-G154 PolarHBondContact O-N 3.12Å; G154-Q157 PolarHBondContact O-N 3.26Å; G154-A158 WeakPolarHBondContact O-CB 3.36Å; G154-A158 PolarHBondContact O-N 3.38Å |
| 155 | V | 98.3 | Very high | 96.8 | Very high | 82 Ų | 82 | 91.1 Ų | 91.1 | 50% | 0.497 | 52% | 0.524 | S | S | . | . | H | α-helix | trans | -63.8 | -48.5 | 174.4 | 173.2 | 0 | 0 | 0 | 0 | 110.5 | L151 S152 Q157 A158 E159 | L151-V155 WeakPolarHBondContact O-CG2 3.46Å; L151-V155 PolarHBondContact O-N 3.19Å; S152-V155 PolarHBondContact O-N 3.29Å; V155-Q157 VanDerWaalsContact C-N 3.29Å; V155-Q157 PolarHBondContact O-N 2.97Å; V155-A158 WeakPolarHBondContact O-CB 3.26Å; V155-A158 PolarHBondContact O-N 3.05Å; V155-A158 VanDerWaalsContact O-N 3.07Å; V155-E159 HydrophobicContact CG1-CG 4.46Å; V155-E159 WeakPolarHBondContact O-CG 3.39Å; V155-E159 PolarHBondContact O-N 3.4Å |
| 156 | A | 97.6 | Very high | 96.3 | Very high | 46 Ų | 46 | 90 Ų | 90 | 38% | 0.38 | 52% | 0.518 | S | S | . | . | H | α-helix | trans | -58.8 | -41 | 176.9 | 0 | 0 | 0 | 0 | 0 | 111.7 | S152 G153 E159 L160 | S152-A156 WeakPolarHBondContact O-CB 3.3Å; S152-A156 PolarHBondContact O-N 3.5Å; G153-A156 PolarHBondContact O-N 3.37Å; A156-E159 PolarHBondContact O-N 3.16Å; A156-L160 WeakPolarHBondContact O-CG 3.41Å; A156-L160 PolarHBondContact O-N 2.84Å |
| 157 | Q | 97.3 | Very high | 95.7 | Very high | 145 Ų | 145 | 89.1 Ų | 89.1 | 68% | 0.678 | 52% | 0.524 | S | S | * | . | H | α-helix | trans | -65.9 | -39.5 | 174.8 | -175 | 169.1 | -6 | 0 | 0 | 112.5 | G153 G154 V155 L160 Y161 | G153-Q157 WeakPolarHBondContact O-CB 3.5Å; G153-Q157 PolarHBondContact O-N 2.82Å; G154-Q157 PolarHBondContact O-N 3.26Å; V155-Q157 VanDerWaalsContact C-N 3.29Å; V155-Q157 PolarHBondContact O-N 2.97Å; Q157-L160 PolarHBondContact O-N 2.9Å; Q157-Y161 WeakPolarHBondContact O-CB 3.14Å; Q157-Y161 PolarHBondContact O-N 3.23Å |
| 158 | A | 96.8 | Very high | 94.9 | Very high | 48 Ų | 48 | 95.9 Ų | 95.9 | 40% | 0.397 | 54% | 0.542 | S | S | . | . | H | α-helix | trans | -65 | -39.7 | 175.3 | 0 | 0 | 0 | 0 | 0 | 111.8 | G154 V155 Y161 L162 | G154-A158 WeakPolarHBondContact O-CB 3.36Å; G154-A158 PolarHBondContact O-N 3.38Å; V155-A158 WeakPolarHBondContact O-CB 3.26Å; V155-A158 PolarHBondContact O-N 3.05Å; V155-A158 VanDerWaalsContact O-N 3.07Å; A158-Y161 PolarHBondContact O-N 3.37Å; A158-L162 WeakPolarHBondContact O-CB 3.3Å; A158-L162 VanDerWaalsContact O-CG 3.3Å; A158-L162 WeakPolarHBondContact O-CG 3.42Å; A158-L162 PolarHBondContact O-N 2.79Å |
| 159 | E | 96.6 | Very high | 94.1 | Very high | 126 Ų | 126 | 95 Ų | 95 | 59% | 0.589 | 54% | 0.537 | S | S | * | . | H | α-helix | trans | -60.8 | -46.6 | 174.1 | -73.7 | 178.1 | -175.6 | 0 | 0 | 111.4 | V155 A156 Y161 L162 A163 | V155-E159 HydrophobicContact CG1-CG 4.46Å; V155-E159 WeakPolarHBondContact O-CG 3.39Å; V155-E159 PolarHBondContact O-N 3.4Å; A156-E159 PolarHBondContact O-N 3.16Å; E159-Y161 VanDerWaalsContact C-N 3.34Å; E159-Y161 PolarHBondContact O-N 3.29Å; E159-L162 PolarHBondContact O-N 3.1Å; E159-A163 WeakPolarHBondContact O-CB 3.37Å; E159-A163 PolarHBondContact O-N 3.44Å |
| 160 | L | 96.8 | Very high | 93.3 | Very high | 127 Ų | 127 | 97.9 Ų | 97.9 | 67% | 0.665 | 54% | 0.54 | S | S | * | . | H | α-helix | trans | -61.2 | -42 | 174.8 | -70 | 172.6 | 0 | 0 | 0 | 111.9 | A156 Q157 A163 A164 | A156-L160 WeakPolarHBondContact O-CG 3.41Å; A156-L160 PolarHBondContact O-N 2.84Å; Q157-L160 PolarHBondContact O-N 2.9Å; L160-A163 PolarHBondContact O-N 3.32Å; L160-A164 WeakPolarHBondContact O-CB 3.37Å; L160-A164 PolarHBondContact O-N 3.05Å |
| 161 | Y | 95.8 | Very high | 92.5 | Very high | 138 Ų | 138 | 94 Ų | 94 | 54% | 0.541 | 53% | 0.529 | S | S | . | . | H | α-helix | trans | -62.9 | -43.1 | 176.3 | -175.8 | -93 | 0 | 0 | 0 | 111.8 | Q157 A158 E159 A164 H165 | Q157-Y161 WeakPolarHBondContact O-CB 3.14Å; Q157-Y161 PolarHBondContact O-N 3.23Å; A158-Y161 PolarHBondContact O-N 3.37Å; E159-Y161 VanDerWaalsContact C-N 3.34Å; E159-Y161 PolarHBondContact O-N 3.29Å; Y161-A164 PolarHBondContact O-N 3.26Å; Y161-H165 AromaticContact CD2-CD2 3.4Å; Y161-H165 VanDerWaalsContact CD2-CD2 3.4Å; Y161-H165 WeakPolarHBondContact CD2-CD2 3.35Å; Y161-H165 AromaticContact CD2-NE2 3.85Å; Y161-H165 HydrophobicContact CE1-CB 4.35Å; Y161-H165 AromaticContact CE2-CD2 3.23Å; Y161-H165 WeakPolarHBondContact CE2-CD2 3.4Å; Y161-H165 AromaticContact CE2-NE2 3.52Å; Y161-H165 AromaticContact CG-CD2 3.87Å; Y161-H165 AromaticContact CZ-CD2 3.57Å; Y161-H165 WeakPolarHBondContact O-CB 3.45Å; Y161-H165 PolarHBondContact O-CD2 2.86Å; Y161-H165 VanDerWaalsContact O-CD2 3.3Å; Y161-H165 PolarHBondContact O-N 3.32Å |
| 162 | L | 94.6 | Very high | 91.4 | Very high | 100 Ų | 100 | 90.5 Ų | 90.5 | 52% | 0.524 | 52% | 0.52 | S | S | . | . | H | α-helix | trans | -68.1 | -36.9 | 175.9 | -71.2 | 174.8 | 0 | 0 | 0 | 112.1 | A158 E159 G166 L169 | A158-L162 WeakPolarHBondContact O-CB 3.3Å; A158-L162 VanDerWaalsContact O-CG 3.3Å; A158-L162 WeakPolarHBondContact O-CG 3.42Å; A158-L162 PolarHBondContact O-N 2.79Å; E159-L162 PolarHBondContact O-N 3.1Å; L162-G166 WeakPolarHBondContact O-CA 3.49Å; L162-G166 PolarHBondContact O-N 3.06Å; L162-L169 HydrophobicContact CD2-CD1 3.86Å |
| 163 | A | 94.7 | Very high | 90.2 | Very high | 85 Ų | 85 | 92.4 Ų | 92.4 | 70% | 0.702 | 52% | 0.521 | S | S | * | . | H | α-helix | trans | -63.5 | -44.3 | 173.7 | 0 | 0 | 0 | 0 | 0 | 111 | E159 L160 | E159-A163 WeakPolarHBondContact O-CB 3.37Å; E159-A163 PolarHBondContact O-N 3.44Å; L160-A163 PolarHBondContact O-N 3.32Å |
| 164 | A | 94.9 | Very high | 88.8 | Confident | 70 Ų | 70 | 97.7 Ų | 97.7 | 58% | 0.579 | 53% | 0.529 | S | S | * | . | H | α-helix | trans | -69.7 | -39.5 | 179.1 | 0 | 0 | 0 | 0 | 0 | 113.2 | L160 Y161 | L160-A164 WeakPolarHBondContact O-CB 3.37Å; L160-A164 PolarHBondContact O-N 3.05Å; Y161-A164 PolarHBondContact O-N 3.26Å |
| 165 | H | 92.8 | Very high | 87.4 | Confident | 73 Ų | 73 | 103.9 Ų | 103.9 | 34% | 0.338 | 54% | 0.539 | S | S | . | . | H | α-helix | trans | -108.7 | -1.7 | -172.3 | -63.1 | -72.3 | 0 | 0 | 0 | 114.8 | Y161 S167 R168 L169 | Y161-H165 AromaticContact CD2-CD2 3.4Å; Y161-H165 VanDerWaalsContact CD2-CD2 3.4Å; Y161-H165 WeakPolarHBondContact CD2-CD2 3.35Å; Y161-H165 AromaticContact CD2-NE2 3.85Å; Y161-H165 HydrophobicContact CE1-CB 4.35Å; Y161-H165 AromaticContact CE2-CD2 3.23Å; Y161-H165 WeakPolarHBondContact CE2-CD2 3.4Å; Y161-H165 AromaticContact CE2-NE2 3.52Å; Y161-H165 AromaticContact CG-CD2 3.87Å; Y161-H165 AromaticContact CZ-CD2 3.57Å; Y161-H165 WeakPolarHBondContact O-CB 3.45Å; Y161-H165 PolarHBondContact O-CD2 2.86Å; Y161-H165 VanDerWaalsContact O-CD2 3.3Å; Y161-H165 PolarHBondContact O-N 3.32Å; H165-S167 PolarHBondContact O-N 3.46Å; H165-R168 WeakPolarHBondContact O-CB 3.38Å; H165-R168 PolarHBondContact O-N 3.18Å; H165-R168 VanDerWaalsContact O-N 3.07Å; H165-L169 WeakPolarHBondContact O-CG 3.38Å; H165-L169 PolarHBondContact O-N 3.46Å |
| 166 | G | 87.8 | Confident | 85.9 | Confident | 27 Ų | 27 | 102.2 Ų | 102.2 | 28% | 0.278 | 54% | 0.539 | S | S | . | . | H | α-helix | trans | -62.2 | -36.3 | -171.7 | 0 | 0 | 0 | 0 | 0 | 114.3 | L162 R168 L169 K170 | L162-G166 WeakPolarHBondContact O-CA 3.49Å; L162-G166 PolarHBondContact O-N 3.06Å; G166-R168 VanDerWaalsContact C-N 3.33Å; G166-R168 PolarHBondContact O-N 2.88Å; G166-L169 PolarHBondContact O-N 3.34Å; G166-K170 WeakPolarHBondContact O-CB 3.46Å; G166-K170 PolarHBondContact O-N 3.43Å |
| 167 | S | 83 | Confident | 84.1 | Confident | 96 Ų | 96 | 108.6 Ų | 108.6 | 67% | 0.671 | 55% | 0.553 | S | S | * | * | H | α-helix | trans | -65.4 | -37.5 | 175.9 | 66.3 | 0 | 0 | 0 | 0 | 112.1 | H165 K171 | H165-S167 PolarHBondContact O-N 3.46Å; S167-K171 WeakPolarHBondContact O-CB 3.43Å; S167-K171 PolarHBondContact O-N 3.39Å |
| 168 | R | 81.3 | Confident | 82.4 | Confident | 193 Ų | 193 | 112 Ų | 112 | 73% | 0.728 | 56% | 0.56 | S | S | * | * | H | α-helix | trans | -71.5 | -40.4 | 178 | -163.7 | -179.4 | -70.3 | -98 | 3.8 | 110.9 | H165 G166 K171 G172 | H165-R168 WeakPolarHBondContact O-CB 3.38Å; H165-R168 PolarHBondContact O-N 3.18Å; H165-R168 VanDerWaalsContact O-N 3.07Å; G166-R168 VanDerWaalsContact C-N 3.33Å; G166-R168 PolarHBondContact O-N 2.88Å; R168-K171 PolarHBondContact O-N 2.85Å; R168-G172 PolarHBondContact O-N 3.46Å |
| 169 | L | 81.4 | Confident | 80.7 | Confident | 92 Ų | 92 | 112.4 Ų | 112.4 | 48% | 0.482 | 57% | 0.569 | S | S | . | * | H | α-helix | trans | -62.4 | -46.3 | 172.5 | -67.9 | 172.1 | 0 | 0 | 0 | 111.6 | L162 H165 G166 K171 G172 Q173 | L162-L169 HydrophobicContact CD2-CD1 3.86Å; H165-L169 WeakPolarHBondContact O-CG 3.38Å; H165-L169 PolarHBondContact O-N 3.46Å; G166-L169 PolarHBondContact O-N 3.34Å; L169-K171 VanDerWaalsContact C-N 3.32Å; L169-K171 PolarHBondContact O-N 3.19Å; L169-G172 PolarHBondContact O-N 2.75Å; L169-Q173 WeakPolarHBondContact O-CB 3.35Å; L169-Q173 PolarHBondContact O-N 3.09Å |
| 170 | K | 80.7 | Confident | 79.1 | Confident | 136 Ų | 136 | 114.4 Ų | 114.4 | 59% | 0.591 | 57% | 0.571 | S | S | * | * | H | α-helix | trans | -60.7 | -40 | 176.6 | -168 | 172.4 | -174.2 | 174.9 | 0 | 112 | G166 R174 | G166-K170 WeakPolarHBondContact O-CB 3.46Å; G166-K170 PolarHBondContact O-N 3.43Å; K170-R174 WeakPolarHBondContact O-CG 3.44Å; K170-R174 PolarHBondContact O-N 3.04Å; K170-R174 VanDerWaalsContact O-N 3.16Å |
| 171 | K | 81.1 | Confident | 77.5 | Confident | 125 Ų | 125 | 111.7 Ų | 111.7 | 54% | 0.543 | 56% | 0.561 | S | S | . | * | H | α-helix | trans | -71 | -39.8 | 176 | -167.6 | 173.9 | -177.8 | 177.3 | 0 | 112.1 | S167 R168 L169 R174 R175 | S167-K171 WeakPolarHBondContact O-CB 3.43Å; S167-K171 PolarHBondContact O-N 3.39Å; R168-K171 PolarHBondContact O-N 2.85Å; L169-K171 VanDerWaalsContact C-N 3.32Å; L169-K171 PolarHBondContact O-N 3.19Å; K171-R174 PolarHBondContact O-N 3.46Å; K171-R175 WeakPolarHBondContact O-CG 3.42Å; K171-R175 PolarHBondContact O-N 3.16Å |
| 172 | G | 73.9 | Confident | 76 | Confident | 40 Ų | 40 | 107.9 Ų | 107.9 | 41% | 0.412 | 55% | 0.554 | S | S | . | * | H | α-helix | trans | -61.7 | -44.9 | 174.4 | 0 | 0 | 0 | 0 | 0 | 112.3 | R168 L169 R174 R175 G176 | R168-G172 PolarHBondContact O-N 3.46Å; L169-G172 PolarHBondContact O-N 2.75Å; G172-R174 PolarHBondContact O-N 2.83Å; G172-R175 PolarHBondContact O-N 3.34Å; G172-R175 VanDerWaalsContact O-N 3.16Å; G172-G176 PolarHBondContact O-N 3.47Å |
| 173 | Q | 73.4 | Confident | 74.6 | Confident | 111 Ų | 111 | 104.6 Ų | 104.6 | 52% | 0.519 | 54% | 0.54 | S | S | . | . | H | α-helix | trans | -58.6 | -47.2 | 174.5 | -176 | 87 | 61.6 | 0 | 0 | 111.8 | L169 R175 G176 R177 | L169-Q173 WeakPolarHBondContact O-CB 3.35Å; L169-Q173 PolarHBondContact O-N 3.09Å; Q173-R175 VanDerWaalsContact C-N 3.27Å; Q173-R175 PolarHBondContact O-N 2.97Å; Q173-G176 PolarHBondContact O-N 2.84Å; Q173-R177 WeakPolarHBondContact O-CG 3.42Å; Q173-R177 PolarHBondContact O-N 3.38Å |
| 174 | R | 68.7 | Low | 73.3 | Confident | 150 Ų | 150 | 105 Ų | 105 | 57% | 0.566 | 53% | 0.531 | S | S | * | . | H | α-helix | trans | -62.9 | -33.7 | 177.5 | -71.8 | -175.2 | -170.6 | -70.8 | 7.8 | 112.1 | K170 K171 G172 R178 | K170-R174 WeakPolarHBondContact O-CG 3.44Å; K170-R174 PolarHBondContact O-N 3.04Å; K170-R174 VanDerWaalsContact O-N 3.16Å; K171-R174 PolarHBondContact O-N 3.46Å; G172-R174 PolarHBondContact O-N 2.83Å; R174-R178 WeakPolarHBondContact O-CB 3.38Å; R174-R178 WeakPolarHBondContact O-CD 3.49Å; R174-R178 WeakPolarHBondContact O-CG 3.35Å; R174-R178 PolarHBondContact O-N 3.42Å |
| 175 | R | 68.3 | Low | 72.1 | Confident | 171 Ų | 171 | 107.2 Ų | 107.2 | 65% | 0.645 | 53% | 0.532 | S | S | * | . | H | α-helix | trans | -75.2 | -41.9 | 176.1 | -71.7 | 177.3 | 179 | -129.1 | -4.6 | 112.5 | K171 G172 Q173 R177 R178 G179 | K171-R175 WeakPolarHBondContact O-CG 3.42Å; K171-R175 PolarHBondContact O-N 3.16Å; G172-R175 PolarHBondContact O-N 3.34Å; G172-R175 VanDerWaalsContact O-N 3.16Å; Q173-R175 VanDerWaalsContact C-N 3.27Å; Q173-R175 PolarHBondContact O-N 2.97Å; R175-R177 PolarHBondContact O-N 3Å; R175-R178 PolarHBondContact O-N 3Å; R175-G179 PolarHBondContact O-N 3.07Å |
| 176 | G | 66.1 | Low | 71.1 | Confident | 48 Ų | 48 | 104.2 Ų | 104.2 | 50% | 0.495 | 52% | 0.52 | S | S | . | . | H | α-helix | trans | -64.5 | -37.7 | 176.5 | 0 | 0 | 0 | 0 | 0 | 113.3 | G172 Q173 | G172-G176 PolarHBondContact O-N 3.47Å; Q173-G176 PolarHBondContact O-N 2.84Å |
| 177 | R | 61.4 | Low | 70.2 | Confident | 180 Ų | 180 | 106.8 Ų | 106.8 | 68% | 0.679 | 53% | 0.534 | S | S | * | . | H | α-helix | trans | -73.4 | -23.6 | 173.5 | -69 | -166.1 | -174.2 | -81.5 | 1.3 | 113.6 | Q173 R175 P181 | Q173-R177 WeakPolarHBondContact O-CG 3.42Å; Q173-R177 PolarHBondContact O-N 3.38Å; R175-R177 PolarHBondContact O-N 3Å; R177-P181 VanDerWaalsContact O-CD 3.25Å; R177-P181 WeakPolarHBondContact O-CD 3.43Å; R177-P181 WeakPolarHBondContact O-CG 3.45Å |
| 178 | R | 60.3 | Low | 69.9 | Low | 215 Ų | 215 | 106.3 Ų | 106.3 | 81% | 0.811 | 54% | 0.535 | S | S | * | . | H | α-helix | trans | -81.7 | -21.1 | 178.4 | -79.9 | 174.8 | -177.3 | -118.9 | 0.6 | 114 | R174 R175 | R174-R178 WeakPolarHBondContact O-CB 3.38Å; R174-R178 WeakPolarHBondContact O-CD 3.49Å; R174-R178 WeakPolarHBondContact O-CG 3.35Å; R174-R178 PolarHBondContact O-N 3.42Å; R175-R178 PolarHBondContact O-N 3Å |
| 179 | G | 60.8 | Low | 69.6 | Low | 57 Ų | 57 | 103.3 Ų | 103.3 | 59% | 0.588 | 53% | 0.533 | S | S | * | . | S | Bend | trans | -105.3 | -3.9 | -171 | 0 | 0 | 0 | 0 | 0 | 117 | R175 | R175-G179 PolarHBondContact O-N 3.07Š|
| 180 | R | 62.4 | Low | 69.2 | Low | 168 Ų | 168 | 102.1 Ų | 102.1 | 63% | 0.634 | 54% | 0.543 | S | S | * | . | S | Bend | trans | -131.2 | -16.5 | -166.6 | -120.9 | 179.4 | 173.4 | 176.6 | -2.9 | 119.6 | L184 | R180-L184 HydrophobicContact CB-CD1 4.22Å; R180-L184 HydrophobicContact CG-CD1 4.04Å; R180-L184 HydrophobicContact CG-CG 4.05Å; R180-L184 WeakPolarHBondContact O-CB 3.05Å; R180-L184 VanDerWaalsContact O-CG 3.26Å; R180-L184 WeakPolarHBondContact O-CG 3.44Å; R180-L184 PolarHBondContact O-N 3.43Å; R180-L184 VanDerWaalsContact O-N 3.12Å |
| 181 | P | 63.6 | Low | 68.8 | Low | 70 Ų | 70 | 99.6 Ų | 99.6 | 46% | 0.455 | 54% | 0.535 | S | S | . | . | H | α-helix | trans | -63.7 | -49 | 179.5 | 12.2 | -15.2 | 0 | 0 | 0 | 114.1 | R177 A183 L185 | R177-P181 VanDerWaalsContact O-CD 3.25Å; R177-P181 WeakPolarHBondContact O-CD 3.43Å; R177-P181 WeakPolarHBondContact O-CG 3.45Å; P181-A183 VanDerWaalsContact C-N 3.35Å; P181-A183 PolarHBondContact O-N 2.91Å; P181-L185 VanDerWaalsContact O-CG 3.32Å; P181-L185 WeakPolarHBondContact O-CG 3.35Å; P181-L185 PolarHBondContact O-N 3.14Å |
| 182 | P | 64.1 | Low | 68 | Low | 59 Ų | 59 | 96.2 Ų | 96.2 | 38% | 0.383 | 54% | 0.536 | S | S | . | . | H | α-helix | trans | -75.5 | -24 | -178.2 | 30.3 | -35.6 | 0 | 0 | 0 | 112.9 | A186 W197 | P182-A186 WeakPolarHBondContact O-CB 3.34Å; P182-A186 PolarHBondContact O-N 3.48Å; P182-W197 HydrophobicContact CB-CH2 4.49Å; P182-W197 HydrophobicContact CB-CZ2 3.66Å; P182-W197 HydrophobicContact CG-CZ2 4.19Å |
| 183 | A | 65.2 | Low | 67.6 | Low | 30 Ų | 30 | 98 Ų | 98 | 25% | 0.248 | 56% | 0.555 | C | S | . | * | H | α-helix | trans | -72.7 | -41.1 | 176.1 | 0 | 0 | 0 | 0 | 0 | 112.3 | P181 A186 S187 | P181-A183 VanDerWaalsContact C-N 3.35Å; P181-A183 PolarHBondContact O-N 2.91Å; A183-A186 PolarHBondContact O-N 3.47Å; A183-S187 PolarHBondContact O-N 3.07Å; A183-S187 PolarHBondContact O-OG 3.4Å; A183-S187 VanDerWaalsContact O-OG 3.04Å |
| 184 | L | 68.1 | Low | 67.2 | Low | 95 Ų | 95 | 98 Ų | 98 | 50% | 0.497 | 57% | 0.565 | S | S | . | * | H | α-helix | trans | -71.1 | -38.1 | 177.5 | -67.3 | 171.5 | 0 | 0 | 0 | 112 | R180 S187 A188 | R180-L184 HydrophobicContact CB-CD1 4.22Å; R180-L184 HydrophobicContact CG-CD1 4.04Å; R180-L184 HydrophobicContact CG-CG 4.05Å; R180-L184 WeakPolarHBondContact O-CB 3.05Å; R180-L184 VanDerWaalsContact O-CG 3.26Å; R180-L184 WeakPolarHBondContact O-CG 3.44Å; R180-L184 PolarHBondContact O-N 3.43Å; R180-L184 VanDerWaalsContact O-N 3.12Å; L184-S187 PolarHBondContact O-N 3.3Å; L184-A188 WeakPolarHBondContact O-CB 3.43Å; L184-A188 PolarHBondContact O-N 2.89Å |
| 185 | L | 70.8 | Confident | 66.6 | Low | 116 Ų | 116 | 92.3 Ų | 92.3 | 61% | 0.607 | 55% | 0.548 | S | S | * | . | H | α-helix | trans | -65.1 | -41.7 | 172.9 | -68.1 | 172.9 | 0 | 0 | 0 | 111.4 | P181 S187 A188 L189 | P181-L185 VanDerWaalsContact O-CG 3.32Å; P181-L185 WeakPolarHBondContact O-CG 3.35Å; P181-L185 PolarHBondContact O-N 3.14Å; L185-S187 PolarHBondContact O-N 2.73Å; L185-A188 PolarHBondContact O-N 3.49Å; L185-L189 WeakPolarHBondContact O-CB 3.37Å; L185-L189 VanDerWaalsContact O-CG 3.24Å; L185-L189 WeakPolarHBondContact O-CG 3.23Å; L185-L189 PolarHBondContact O-N 3.33Å |
| 186 | A | 70.4 | Confident | 66.3 | Low | 10 Ų | 10 | 89.2 Ų | 89.2 | 8% | 0.083 | 55% | 0.549 | C | S | . | . | H | α-helix | trans | -63.2 | -40 | 173.7 | 0 | 0 | 0 | 0 | 0 | 112.4 | P182 A183 L189 G190 L191 V195 | P182-A186 WeakPolarHBondContact O-CB 3.34Å; P182-A186 PolarHBondContact O-N 3.48Å; A183-A186 PolarHBondContact O-N 3.47Å; A186-L189 CarbonylContact O-C 3.58Å; A186-L189 PolarHBondContact O-N 2.8Å; A186-G190 PolarHBondContact O-N 2.85Å; A186-G190 VanDerWaalsContact O-N 3.14Å; A186-L191 HydrophobicContact CB-CB 4.2Å; A186-L191 WeakPolarHBondContact O-CA 3.37Å; A186-L191 PolarHBondContact O-N 3.29Å; A186-V195 HydrophobicContact CB-CG2 4.03Å |
| 187 | S | 69.3 | Low | 66.1 | Low | 81 Ų | 81 | 94.4 Ų | 94.4 | 57% | 0.566 | 55% | 0.554 | S | S | * | * | H | α-helix | trans | -66.6 | -39.5 | 174.4 | -61.2 | 0 | 0 | 0 | 0 | 112.9 | A183 L184 L185 L189 G190 | A183-S187 PolarHBondContact O-N 3.07Å; A183-S187 PolarHBondContact O-OG 3.4Å; A183-S187 VanDerWaalsContact O-OG 3.04Å; L184-S187 PolarHBondContact O-N 3.3Å; L185-S187 PolarHBondContact O-N 2.73Å; S187-L189 VanDerWaalsContact C-N 3.28Å; S187-L189 PolarHBondContact O-N 2.85Å; S187-G190 PolarHBondContact O-N 3.3Å |
| 188 | A | 76.3 | Confident | 65.8 | Low | 85 Ų | 85 | 88.9 Ų | 88.9 | 70% | 0.702 | 55% | 0.553 | S | S | * | * | H | α-helix | trans | -66.8 | -30.4 | 176.4 | 0 | 0 | 0 | 0 | 0 | 112.6 | L184 L185 G190 | L184-A188 WeakPolarHBondContact O-CB 3.43Å; L184-A188 PolarHBondContact O-N 2.89Å; L185-A188 PolarHBondContact O-N 3.49Å; A188-G190 VanDerWaalsContact C-N 3.35Å |
| 189 | L | 75.8 | Confident | 65.5 | Low | 130 Ų | 130 | 83.1 Ų | 83.1 | 68% | 0.681 | 55% | 0.552 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -89.4 | 4.6 | 175.5 | -63.5 | 171.2 | 0 | 0 | 0 | 113.3 | L185 A186 S187 L191 | L185-L189 WeakPolarHBondContact O-CB 3.37Å; L185-L189 VanDerWaalsContact O-CG 3.24Å; L185-L189 WeakPolarHBondContact O-CG 3.23Å; L185-L189 PolarHBondContact O-N 3.33Å; A186-L189 CarbonylContact O-C 3.58Å; A186-L189 PolarHBondContact O-N 2.8Å; S187-L189 VanDerWaalsContact C-N 3.28Å; S187-L189 PolarHBondContact O-N 2.85Å; L189-L191 HydrophobicContact CB-CD1 4.01Å; L189-L191 HydrophobicContact CB-CG 4.07Å; L189-L191 HydrophobicContact CD1-CD1 4.37Å; L189-L191 PolarHBondContact O-N 3.27Å |
| 190 | G | 72.9 | Confident | 65.1 | Low | 67 Ų | 67 | 83.8 Ų | 83.8 | 69% | 0.691 | 56% | 0.558 | S | S | * | * | T | Hydrogen-bonded Turn | trans | 71.2 | 8.6 | -179.3 | 0 | 0 | 0 | 0 | 0 | 115.2 | A186 S187 A188 G192 | A186-G190 PolarHBondContact O-N 2.85Å; A186-G190 VanDerWaalsContact O-N 3.14Å; S187-G190 PolarHBondContact O-N 3.3Å; A188-G190 VanDerWaalsContact C-N 3.35Å; G190-G192 PolarHBondContact O-N 3.45Å |
| 191 | L | 72.5 | Confident | 64.7 | Low | 83 Ų | 83 | 87 Ų | 87 | 44% | 0.435 | 57% | 0.57 | S | S | . | * | trans | -84 | 18.5 | -177.3 | -59.8 | 173.1 | 0 | 0 | 0 | 113.5 | A186 L189 G193 C194 V195 | A186-L191 HydrophobicContact CB-CB 4.2Å; A186-L191 WeakPolarHBondContact O-CA 3.37Å; A186-L191 PolarHBondContact O-N 3.29Å; L189-L191 HydrophobicContact CB-CD1 4.01Å; L189-L191 HydrophobicContact CB-CG 4.07Å; L189-L191 HydrophobicContact CD1-CD1 4.37Å; L189-L191 PolarHBondContact O-N 3.27Å; L191-G193 PolarHBondContact O-N 2.93Å; L191-C194 PolarHBondContact O-N 3.41Å; L191-C194 VanDerWaalsContact O-N 3.08Å; L191-V195 HydrophobicContact CB-CG2 4.25Å; L191-V195 WeakPolarHBondContact O-CG2 3.4Å | ||
| 192 | G | 64.5 | Low | 64.1 | Low | 55 Ų | 55 | 91.7 Ų | 91.7 | 57% | 0.567 | 59% | 0.591 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -59.9 | -15.5 | -171.1 | 0 | 0 | 0 | 0 | 0 | 116.1 | G190 | G190-G192 PolarHBondContact O-N 3.45Š|
| 193 | G | 65.9 | Low | 63.6 | Low | 77 Ų | 77 | 100.4 Ų | 100.4 | 79% | 0.794 | 62% | 0.616 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -101.7 | -12.5 | 177 | 0 | 0 | 0 | 0 | 0 | 115.6 | L191 | L191-G193 PolarHBondContact O-N 2.93Š|
| 194 | C | 62.9 | Low | 62.8 | Low | 110 Ų | 110 | 110.8 Ų | 110.8 | 74% | 0.743 | 65% | 0.649 | S | S | * | * | S | Bend | trans | -101.9 | 8.3 | -170 | -58.5 | 0 | 0 | 0 | 0 | 113.4 | L191 | L191-C194 PolarHBondContact O-N 3.41Å; L191-C194 VanDerWaalsContact O-N 3.08Å |
| 195 | V | 58.1 | Low | 61.6 | Low | 32 Ų | 32 | 109.9 Ų | 109.9 | 19% | 0.194 | 66% | 0.662 | C | S | . | * | trans | -128.1 | 121.8 | -162.2 | -174.5 | 0 | 0 | 0 | 0 | 111 | A186 L191 W197 G198 | A186-V195 HydrophobicContact CB-CG2 4.03Å; L191-V195 HydrophobicContact CB-CG2 4.25Å; L191-V195 WeakPolarHBondContact O-CG2 3.4Å; V195-W197 VanDerWaalsContact C-N 3.26Å; V195-W197 HydrophobicContact CB-CZ2 4.42Å; V195-W197 HydrophobicContact CG1-CD2 3.52Å; V195-W197 HydrophobicContact CG1-CE3 4.09Å; V195-W197 HydrophobicContact CG1-CG 4.08Å; V195-W197 HydrophobicContact CG1-CH2 3.6Å; V195-W197 HydrophobicContact CG1-CZ2 2.95Å; V195-W197 HydrophobicContact CG1-CZ3 4.12Å; V195-W197 PolarHBondContact O-N 2.96Å; V195-G198 PolarHBondContact O-N 3.02Å | ||
| 196 | P | 61.3 | Low | 60.6 | Low | 105 Ų | 105 | 114.2 Ų | 114.2 | 68% | 0.682 | 68% | 0.679 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -71.8 | -7.6 | -158.6 | 25.3 | -34.4 | 0 | 0 | 0 | 115.8 | ||
| 197 | W | 61.3 | Low | 59.1 | Low | 158 Ų | 158 | 116.3 Ų | 116.3 | 60% | 0.598 | 70% | 0.701 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -82.5 | -5.7 | 180 | 33.2 | 85.2 | 0 | 0 | 0 | 115.1 | P182 V195 | P182-W197 HydrophobicContact CB-CH2 4.49Å; P182-W197 HydrophobicContact CB-CZ2 3.66Å; P182-W197 HydrophobicContact CG-CZ2 4.19Å; V195-W197 VanDerWaalsContact C-N 3.26Å; V195-W197 HydrophobicContact CB-CZ2 4.42Å; V195-W197 HydrophobicContact CG1-CD2 3.52Å; V195-W197 HydrophobicContact CG1-CE3 4.09Å; V195-W197 HydrophobicContact CG1-CG 4.08Å; V195-W197 HydrophobicContact CG1-CH2 3.6Å; V195-W197 HydrophobicContact CG1-CZ2 2.95Å; V195-W197 HydrophobicContact CG1-CZ3 4.12Å; V195-W197 PolarHBondContact O-N 2.96Å |
| 198 | G | 55.6 | Low | 58.4 | Low | 64 Ų | 64 | 118.6 Ų | 118.6 | 66% | 0.66 | 71% | 0.714 | S | S | * | * | S | Bend | trans | -91.1 | -18.7 | 179.7 | 0 | 0 | 0 | 0 | 0 | 116.3 | V195 G200 | V195-G198 PolarHBondContact O-N 3.02Å; G198-G200 PolarHBondContact O-N 3.41Å |
| 199 | A | 52.8 | Low | 57.2 | Low | 94 Ų | 94 | 122 Ų | 122 | 78% | 0.777 | 72% | 0.716 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -90.5 | 6.3 | -165.6 | 0 | 0 | 0 | 0 | 0 | 115.5 | ||
| 200 | G | 53.5 | Low | 56.1 | Low | 70 Ų | 70 | 121.1 Ų | 121.1 | 72% | 0.722 | 72% | 0.717 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -96.9 | -1.5 | -170.9 | 0 | 0 | 0 | 0 | 0 | 117.1 | G198 | G198-G200 PolarHBondContact O-N 3.41Š|
| 201 | R | 54.8 | Low | 55 | Low | 236 Ų | 236 | 125.5 Ų | 125.5 | 89% | 0.891 | 73% | 0.725 | S | S | * | * | S | Bend | trans | -119.3 | 35.5 | -173.5 | -78.6 | -142.2 | -67.3 | -86.2 | 0.2 | 115.1 | ||
| 202 | L | 50.4 | Low | 54.1 | Low | 169 Ų | 169 | 124.3 Ų | 124.3 | 89% | 0.885 | 72% | 0.724 | S | S | * | * | S | Bend | trans | -118 | 7.7 | 168.8 | -72 | 168.3 | 0 | 0 | 0 | 114.1 | ||
| 203 | R | 53.4 | Low | 53.8 | Low | 241 Ų | 241 | 126.7 Ų | 126.7 | 91% | 0.909 | 73% | 0.729 | S | S | * | * | trans | -141.1 | 70.6 | 177.2 | -73.1 | -79.2 | -131.3 | -147.4 | -1.6 | 112.9 | ||||
| 204 | R | 47.4 | Very low | 53.2 | Low | 249 Ų | 249 | 131.9 Ų | 131.9 | 94% | 0.94 | 73% | 0.73 | S | S | * | * | trans | -143.8 | 104.2 | 141.8 | -75.5 | -166.7 | -161.3 | -131.6 | 1.3 | 103.9 | ||||
| 205 | G | 43.1 | Very low | 52.7 | Low | 75 Ų | 75 | 137.1 Ų | 137.1 | 77% | 0.773 | 73% | 0.734 | S | S | * | * | 82.3 | 99.3 | 61.5 | 0 | 0 | 0 | 0 | 0 | 106.8 | G207 | G205-G207 PolarHBondContact O-N 3.44Š| |||
| 206 | H | 50 | Low | 52.5 | Low | 207 Ų | 207 | 146.5 Ų | 146.5 | 96% | 0.958 | 77% | 0.766 | S | S | * | * | trans | -39 | 125.1 | 173.7 | -172.6 | 71.9 | 0 | 0 | 0 | 112.1 | ||||
| 207 | G | 40.2 | Very low | 52.5 | Low | 54 Ų | 54 | 146.4 Ų | 146.4 | 56% | 0.557 | 77% | 0.768 | S | S | * | * | trans | -142.5 | 146.2 | 172.2 | 0 | 0 | 0 | 0 | 0 | 108.6 | G205 | G205-G207 PolarHBondContact O-N 3.44Š| ||
| 208 | P | 53.8 | Low | 52.5 | Low | 129 Ų | 129 | 144.2 Ų | 144.2 | 84% | 0.838 | 77% | 0.774 | S | S | * | * | trans | -65.3 | 137.4 | -164.8 | 26.7 | -33.3 | 0 | 0 | 0 | 111.7 | ||||
| 209 | E | 50.5 | Low | 52.6 | Low | 158 Ų | 158 | 147.3 Ų | 147.3 | 74% | 0.738 | 78% | 0.782 | S | S | * | * | trans | -48.7 | 129.1 | 171.9 | -109.4 | -88.6 | 133.9 | 0 | 0 | 110.7 | D211 | E209-D211 PolarHBondContact O-N 2.96Š| ||
| 210 | P | 53.9 | Low | 52.8 | Low | 110 Ų | 110 | 154.7 Ų | 154.7 | 71% | 0.714 | 79% | 0.79 | S | S | * | * | trans | -73.2 | 111.2 | 164.3 | 28.8 | -29 | 0 | 0 | 0 | 108.3 | S212 | P210-S212 PolarHBondContact O-N 3.26Š| ||
| 211 | D | 49.7 | Very low | 53.1 | Low | 159 Ų | 159 | 154.1 Ų | 154.1 | 85% | 0.85 | 79% | 0.785 | S | S | * | * | trans | -43.2 | 109.9 | 175.1 | -85 | -42.8 | 0 | 0 | 0 | 111.5 | E209 | E209-D211 PolarHBondContact O-N 2.96Š| ||
| 212 | S | 52.5 | Low | 53.3 | Low | 58 Ų | 58 | 149.4 Ų | 149.4 | 41% | 0.406 | 78% | 0.784 | S | S | . | * | trans | -69.1 | 123.2 | 170.6 | 176.3 | 0 | 0 | 0 | 0 | 109.2 | P210 F214 R215 | P210-S212 PolarHBondContact O-N 3.26Å; S212-F214 PolarHBondContact O-N 3.19Å; S212-R215 PolarHBondContact O-N 2.94Å | ||
| 213 | P | 58.4 | Low | 53.5 | Low | 105 Ų | 105 | 145.9 Ų | 145.9 | 68% | 0.682 | 78% | 0.78 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -66.7 | -3.8 | -177.4 | 25.7 | -33.1 | 0 | 0 | 0 | 114 | ||
| 214 | F | 54.3 | Low | 53.4 | Low | 187 Ų | 187 | 139.6 Ų | 139.6 | 82% | 0.82 | 77% | 0.773 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -99.8 | 3.9 | 179.4 | -64.8 | -78.9 | 0 | 0 | 0 | 114.2 | S212 | S212-F214 PolarHBondContact O-N 3.19Š|
| 215 | R | 51 | Low | 53.8 | Low | 220 Ų | 220 | 133.6 Ų | 133.6 | 83% | 0.83 | 77% | 0.766 | S | S | * | * | trans | -105.2 | 38.2 | 173.9 | -74.2 | -76.6 | -166.9 | -123.2 | 0.2 | 112.3 | S212 S217 | S212-R215 PolarHBondContact O-N 2.94Å; R215-S217 PolarHBondContact O-N 3.39Å | ||
| 216 | R | 55.2 | Low | 53.9 | Low | 229 Ų | 229 | 139 Ų | 139 | 86% | 0.864 | 77% | 0.772 | S | S | * | * | trans | -88.4 | 90.4 | 160.3 | -72.1 | -172.2 | -175 | -160.5 | 1.6 | 108.7 | ||||
| 217 | S | 60.3 | Low | 53.6 | Low | 102 Ų | 102 | 141.6 Ų | 141.6 | 71% | 0.713 | 78% | 0.783 | S | S | * | * | P | Polyproline II helix | trans | -56.9 | 134.1 | 158.7 | -49.6 | 0 | 0 | 0 | 0 | 108 | R215 | R215-S217 PolarHBondContact O-N 3.39Š|
| 218 | P | 61.4 | Low | 54.3 | Low | 113 Ų | 113 | 146 Ų | 146 | 73% | 0.734 | 80% | 0.795 | S | S | * | * | P | Polyproline II helix | trans | -62.1 | 147.9 | 172.7 | 25.7 | -31.2 | 0 | 0 | 0 | 109.5 | R220 | P218-R220 PolarHBondContact O-N 3.19Š|
| 219 | P | 57.6 | Low | 54.3 | Low | 128 Ų | 128 | 146.8 Ų | 146.8 | 83% | 0.831 | 79% | 0.792 | S | S | * | * | P | Polyproline II helix | trans | -60 | 124.4 | -179.4 | 24.4 | -31.9 | 0 | 0 | 0 | 109.5 | G221 | P219-G221 PolarHBondContact O-N 3.11Å; P219-G221 VanDerWaalsContact O-N 3.11Å |
| 220 | R | 58.1 | Low | 54.5 | Low | 249 Ų | 249 | 146.2 Ų | 146.2 | 94% | 0.94 | 80% | 0.795 | S | S | * | * | trans | -57 | 115.1 | 164.8 | -100.5 | -178.7 | 171 | -168 | -3.1 | 107.2 | P218 | P218-R220 PolarHBondContact O-N 3.19Š| ||
| 221 | G | 59.4 | Low | 54.5 | Low | 59 Ų | 59 | 148.4 Ų | 148.4 | 61% | 0.608 | 80% | 0.8 | S | S | * | * | P | Polyproline II helix | trans | -60.8 | 157.7 | 170.3 | 0 | 0 | 0 | 0 | 0 | 111.4 | P219 | P219-G221 PolarHBondContact O-N 3.11Å; P219-G221 VanDerWaalsContact O-N 3.11Å |
| 222 | P | 58.6 | Low | 54.8 | Low | 136 Ų | 136 | 147.7 Ų | 147.7 | 88% | 0.883 | 80% | 0.797 | S | S | * | * | P | Polyproline II helix | trans | -62.3 | 140.9 | -179.1 | 25.9 | -32.7 | 0 | 0 | 0 | 111.1 | ||
| 223 | A | 55.3 | Low | 55 | Low | 95 Ų | 95 | 153.7 Ų | 153.7 | 79% | 0.785 | 82% | 0.823 | S | S | * | * | P | Polyproline II helix | trans | -58.8 | 135.2 | 178.7 | 0 | 0 | 0 | 0 | 0 | 111.4 | ||
| 224 | S | 50.6 | Low | 54.8 | Low | 109 Ų | 109 | 157.1 Ų | 157.1 | 76% | 0.762 | 83% | 0.833 | S | S | * | * | P | Polyproline II helix | trans | -59.9 | 135.5 | 167.2 | -51.7 | 0 | 0 | 0 | 0 | 109.8 | Q226 | S224-Q226 PolarHBondContact O-N 3.49Š|
| 225 | P | 55 | Low | 54.8 | Low | 124 Ų | 124 | 154.8 Ų | 154.8 | 81% | 0.805 | 83% | 0.834 | S | S | * | * | P | Polyproline II helix | trans | -71.8 | 131.8 | 173.1 | 29.6 | -30.1 | 0 | 0 | 0 | 109 | H227 | P225-H227 PolarHBondContact O-N 3.49Š|
| 226 | Q | 47.1 | Very low | 55.1 | Low | 189 Ų | 189 | 149.4 Ų | 149.4 | 88% | 0.883 | 83% | 0.834 | S | S | * | * | trans | -79.8 | 109.2 | 159.7 | -66.6 | -172.9 | 24.9 | 0 | 0 | 107.4 | S224 | S224-Q226 PolarHBondContact O-N 3.49Š| ||
| 227 | H | 42.8 | Very low | 55.1 | Low | 260 Ų | 260 | 142.2 Ų | 142.2 | 100% | 1.204 | 83% | 0.832 | S | S | * | * | trans | -167.3 | 0 | 139.7 | -121.4 | -71.3 | 0 | 0 | 0 | 110.9 | P225 | P225-H227 PolarHBondContact O-N 3.49Š|
Retrieved 227 of 227 residues in 72.7 ms
(Link to these results)