| 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 | 51.4 | Low | 53.1 | Low | 240 Ų | 240 | 147.6 Ų | 147.6 | 100% | 1.182 | 86% | 0.858 | S | S | * | * | 0 | 112.3 | 0 | -60 | -174.7 | 89.7 | 0 | 0 | 106.2 | |||||
| 2 | Q | 45.6 | Very low | 52.9 | Low | 201 Ų | 201 | 148.2 Ų | 148.2 | 94% | 0.939 | 85% | 0.854 | S | S | * | * | P | Polyproline II helix | trans | -90 | 130.4 | -170.4 | -66.7 | 178 | 54.9 | 0 | 0 | 109.2 | ||
| 3 | S | 53.6 | Low | 52.7 | Low | 122 Ų | 122 | 145.9 Ų | 145.9 | 85% | 0.853 | 85% | 0.848 | S | S | * | * | P | Polyproline II helix | trans | -87.2 | 123.7 | 178.9 | -30.9 | 0 | 0 | 0 | 0 | 109.7 | ||
| 4 | S | 60.8 | Low | 52.6 | Low | 116 Ų | 116 | 146.6 Ų | 146.6 | 81% | 0.811 | 84% | 0.844 | S | S | * | * | P | Polyproline II helix | trans | -86.6 | 143.4 | 172.1 | -57.2 | 0 | 0 | 0 | 0 | 111.2 | ||
| 5 | P | 58.8 | Low | 52.3 | Low | 123 Ų | 123 | 148.1 Ų | 148.1 | 80% | 0.799 | 85% | 0.847 | S | S | * | * | P | Polyproline II helix | trans | -86.2 | 146.3 | 176.4 | 32.6 | -31.7 | 0 | 0 | 0 | 113 | ||
| 6 | S | 49.7 | Very low | 51.8 | Low | 125 Ų | 125 | 150.3 Ų | 150.3 | 87% | 0.874 | 85% | 0.847 | S | S | * | * | P | Polyproline II helix | trans | -71.8 | 132.7 | 178.1 | -170.2 | 0 | 0 | 0 | 0 | 111.7 | ||
| 7 | T | 52.3 | Low | 51.5 | Low | 121 Ų | 121 | 148.9 Ų | 148.9 | 74% | 0.742 | 84% | 0.843 | S | S | * | * | P | Polyproline II helix | trans | -83.5 | 122.3 | 177.1 | -67.8 | 0 | 0 | 0 | 0 | 110.2 | ||
| 8 | A | 50.3 | Low | 51.1 | Low | 93 Ų | 93 | 150 Ų | 150 | 77% | 0.769 | 84% | 0.84 | S | S | * | * | P | Polyproline II helix | trans | -75.5 | 128.7 | 173.2 | 0 | 0 | 0 | 0 | 0 | 111.1 | ||
| 9 | H | 56.9 | Low | 50.9 | Low | 178 Ų | 178 | 151.1 Ų | 151.1 | 82% | 0.824 | 84% | 0.84 | S | S | * | * | P | Polyproline II helix | trans | -84.7 | 131.9 | 168.8 | -80.4 | -87.8 | 0 | 0 | 0 | 110.3 | ||
| 10 | P | 56.1 | Low | 50.5 | Low | 121 Ų | 121 | 149.1 Ų | 149.1 | 79% | 0.786 | 83% | 0.832 | S | S | * | * | P | Polyproline II helix | trans | -79.7 | 129 | 170.5 | 29.7 | -30 | 0 | 0 | 0 | 111.3 | ||
| 11 | Q | 48.7 | Very low | 50.4 | Low | 184 Ų | 184 | 147.4 Ų | 147.4 | 86% | 0.86 | 83% | 0.83 | S | S | * | * | P | Polyproline II helix | trans | -76.1 | 127.5 | 176 | -165.9 | -172.2 | -4 | 0 | 0 | 110.2 | ||
| 12 | L | 50.1 | Low | 50.4 | Low | 154 Ų | 154 | 143.1 Ų | 143.1 | 81% | 0.806 | 81% | 0.812 | S | S | * | * | P | Polyproline II helix | trans | -80.8 | 141.5 | 172.3 | -65 | 175 | 0 | 0 | 0 | 110.6 | ||
| 13 | P | 51.4 | Low | 50.3 | Low | 119 Ų | 119 | 136.8 Ų | 136.8 | 77% | 0.773 | 80% | 0.8 | S | S | * | * | P | Polyproline II helix | trans | -76.2 | 128.9 | 179.5 | 28.4 | -31.5 | 0 | 0 | 0 | 112.1 | L15 | P13-L15 PolarHBondContact O-N 2.95Š|
| 14 | I | 50.8 | Low | 49.7 | Very low | 156 Ų | 156 | 139.9 Ų | 139.9 | 80% | 0.8 | 80% | 0.804 | S | S | * | * | P | Polyproline II helix | trans | -68.2 | 117.4 | 169.3 | -68.8 | 163.3 | 0 | 0 | 0 | 108.1 | Q16 | I14-Q16 PolarHBondContact O-N 3.48Å; I14-Q16 VanDerWaalsContact O-N 3.16Å |
| 15 | L | 47.9 | Very low | 49.1 | Very low | 169 Ų | 169 | 141.1 Ų | 141.1 | 89% | 0.885 | 81% | 0.807 | S | S | * | * | trans | -73.2 | 103.2 | 167.5 | -79.5 | 174.8 | 0 | 0 | 0 | 109.2 | P13 T17 | P13-L15 PolarHBondContact O-N 2.95Å; L15-T17 PolarHBondContact O-N 3.07Å | ||
| 16 | Q | 43.7 | Very low | 48.7 | Very low | 182 Ų | 182 | 138.7 Ų | 138.7 | 85% | 0.85 | 80% | 0.804 | S | S | * | * | trans | -72.6 | 106 | 168.8 | -173.2 | 171.2 | -12.9 | 0 | 0 | 108.7 | I14 Q18 | I14-Q16 PolarHBondContact O-N 3.48Å; I14-Q16 VanDerWaalsContact O-N 3.16Å; Q16-Q18 PolarHBondContact O-N 3.32Å; Q16-Q18 VanDerWaalsContact O-N 3.14Å | ||
| 17 | T | 48.3 | Very low | 48.2 | Very low | 127 Ų | 127 | 138.4 Ų | 138.4 | 78% | 0.779 | 80% | 0.802 | S | S | * | * | trans | -69 | 109.1 | 168.4 | -70.7 | 0 | 0 | 0 | 0 | 108.4 | L15 | L15-T17 PolarHBondContact O-N 3.07Š| ||
| 18 | Q | 43.6 | Very low | 47.9 | Very low | 169 Ų | 169 | 139.8 Ų | 139.8 | 79% | 0.79 | 80% | 0.804 | S | S | * | * | trans | -71.3 | 122.3 | 177.3 | -166.7 | 176.1 | 17.9 | 0 | 0 | 109.6 | Q16 V20 | Q16-Q18 PolarHBondContact O-N 3.32Å; Q16-Q18 VanDerWaalsContact O-N 3.14Å; Q18-V20 PolarHBondContact O-N 2.92Å | ||
| 19 | M | 46.4 | Very low | 47.8 | Very low | 171 Ų | 171 | 141.4 Ų | 141.4 | 84% | 0.842 | 81% | 0.807 | S | S | * | * | trans | -90 | 101.3 | 177.3 | -42 | -158 | -68 | 0 | 0 | 108.1 | S21 | M19-S21 PolarHBondContact O-N 3.16Š| ||
| 20 | V | 43.8 | Very low | 47.3 | Very low | 111 Ų | 111 | 139.1 Ų | 139.1 | 67% | 0.673 | 81% | 0.805 | S | S | * | * | trans | -72.4 | 114.4 | 168.7 | 158.8 | 0 | 0 | 0 | 0 | 108.1 | Q18 | Q18-V20 PolarHBondContact O-N 2.92Š| ||
| 21 | S | 49.2 | Very low | 46.9 | Very low | 113 Ų | 113 | 138.6 Ų | 138.6 | 79% | 0.79 | 81% | 0.805 | S | S | * | * | trans | -89.9 | 106.3 | 165.4 | -59.2 | 0 | 0 | 0 | 0 | 107.4 | M19 | M19-S21 PolarHBondContact O-N 3.16Š| ||
| 22 | D | 49.8 | Very low | 46.9 | Very low | 150 Ų | 150 | 136 Ų | 136 | 80% | 0.802 | 80% | 0.804 | S | S | * | * | trans | -104.9 | 128.8 | 163.4 | -83.6 | -39.4 | 0 | 0 | 0 | 109.7 | ||||
| 23 | G | 43.4 | Very low | 46.2 | Very low | 68 Ų | 68 | 133 Ų | 133 | 70% | 0.701 | 80% | 0.801 | S | S | * | * | trans | -71.8 | 163.2 | -164.2 | 0 | 0 | 0 | 0 | 0 | 116.2 | ||||
| 24 | M | 41.8 | Very low | 45.7 | Very low | 188 Ų | 188 | 133.4 Ų | 133.4 | 93% | 0.926 | 81% | 0.807 | S | S | * | * | trans | -43.8 | 127.3 | 175.9 | -71.1 | 69.1 | 161.8 | 0 | 0 | 114.7 | ||||
| 25 | T | 49.1 | Very low | 45.2 | Very low | 142 Ų | 142 | 131.3 Ų | 131.3 | 87% | 0.871 | 81% | 0.806 | S | S | * | * | trans | -124.6 | 117.2 | 137.2 | 56 | 0 | 0 | 0 | 0 | 108 | ||||
| 26 | G | 48.6 | Very low | 44.8 | Very low | 71 Ų | 71 | 129 Ų | 129 | 73% | 0.732 | 80% | 0.804 | S | S | * | * | trans | -69.2 | 141.3 | -178 | 0 | 0 | 0 | 0 | 0 | 111.7 | ||||
| 27 | S | 39.5 | Very low | 44.9 | Very low | 119 Ų | 119 | 125.8 Ų | 125.8 | 83% | 0.832 | 80% | 0.802 | S | S | * | * | trans | -156.7 | 105 | 155.4 | -73.1 | 0 | 0 | 0 | 0 | 108.1 | ||||
| 28 | N | 46.2 | Very low | 45.1 | Very low | 150 Ų | 150 | 125.7 Ų | 125.7 | 80% | 0.802 | 80% | 0.803 | S | S | * | * | trans | -53.2 | 137.2 | 169.5 | -83 | -24.9 | 0 | 0 | 0 | 111.1 | V30 | N28-V30 PolarHBondContact O-N 2.97Š| ||
| 29 | P | 48.9 | Very low | 44.9 | Very low | 127 Ų | 127 | 124.8 Ų | 124.8 | 83% | 0.825 | 80% | 0.804 | S | S | * | * | trans | -78.5 | 110.3 | 161.3 | 29.9 | -29.3 | 0 | 0 | 0 | 109.4 | ||||
| 30 | V | 46.4 | Very low | 44.6 | Very low | 130 Ų | 130 | 122.6 Ų | 122.6 | 79% | 0.788 | 81% | 0.805 | S | S | * | * | P | Polyproline II helix | trans | -71.7 | 134 | 171.8 | -26 | 0 | 0 | 0 | 0 | 109.2 | N28 | N28-V30 PolarHBondContact O-N 2.97Š|
| 31 | S | 47.6 | Very low | 44.6 | Very low | 110 Ų | 110 | 123 Ų | 123 | 77% | 0.769 | 81% | 0.813 | S | S | * | * | P | Polyproline II helix | trans | -62.6 | 139.2 | 171.6 | -55.5 | 0 | 0 | 0 | 0 | 111.1 | A33 | S31-A33 PolarHBondContact O-N 3.32Š|
| 32 | P | 47.7 | Very low | 43.9 | Very low | 129 Ų | 129 | 121.4 Ų | 121.4 | 84% | 0.838 | 81% | 0.814 | S | S | * | * | P | Polyproline II helix | trans | -81 | 119.2 | 164.1 | 30.3 | -27.8 | 0 | 0 | 0 | 109.4 | ||
| 33 | A | 36.2 | Very low | 43.4 | Very low | 92 Ų | 92 | 119.6 Ų | 119.6 | 76% | 0.76 | 82% | 0.821 | S | S | * | * | P | Polyproline II helix | trans | -58.4 | 145.4 | 169.1 | 0 | 0 | 0 | 0 | 0 | 111.7 | S31 S35 | S31-A33 PolarHBondContact O-N 3.32Å; A33-S35 PolarHBondContact O-N 2.8Å |
| 34 | S | 40.9 | Very low | 43 | Very low | 127 Ų | 127 | 120.1 Ų | 120.1 | 89% | 0.888 | 83% | 0.826 | S | S | * | * | P | Polyproline II helix | trans | -51.2 | 129.9 | 166 | -49.6 | 0 | 0 | 0 | 0 | 110.8 | ||
| 35 | S | 40 | Very low | 42.6 | Very low | 112 Ų | 112 | 114.7 Ų | 114.7 | 78% | 0.783 | 82% | 0.818 | S | S | * | * | trans | -121 | 122.4 | 160.1 | 47.2 | 0 | 0 | 0 | 0 | 108.4 | A33 | A33-S35 PolarHBondContact O-N 2.8Š| ||
| 36 | S | 39.7 | Very low | 42 | Very low | 120 Ų | 120 | 116 Ų | 116 | 84% | 0.839 | 82% | 0.818 | S | S | * | * | P | Polyproline II helix | trans | -66.3 | 135.7 | 176.9 | 34.9 | 0 | 0 | 0 | 0 | 111.5 | ||
| 37 | S | 45.3 | Very low | 41.5 | Very low | 115 Ų | 115 | 118 Ų | 118 | 80% | 0.804 | 82% | 0.821 | S | S | * | * | P | Polyproline II helix | trans | -74.3 | 145.6 | 163.3 | -56.5 | 0 | 0 | 0 | 0 | 110.1 | ||
| 38 | P | 53.8 | Low | 41.7 | Very low | 125 Ų | 125 | 118.4 Ų | 118.4 | 81% | 0.812 | 82% | 0.82 | S | S | * | * | P | Polyproline II helix | trans | -86.4 | 145.5 | 164.3 | 33.4 | -28.4 | 0 | 0 | 0 | 111.2 | ||
| 39 | D | 39 | Very low | 41.2 | Very low | 151 Ų | 151 | 119.9 Ų | 119.9 | 81% | 0.807 | 82% | 0.822 | S | S | * | * | P | Polyproline II helix | trans | -51.3 | 150.5 | 168.5 | -98.4 | -47.8 | 0 | 0 | 0 | 113.6 | ||
| 40 | S | 39.9 | Very low | 40.6 | Very low | 124 Ų | 124 | 121.3 Ų | 121.3 | 87% | 0.867 | 82% | 0.818 | S | S | * | * | trans | -148.2 | 112.6 | 142.8 | -89.9 | 0 | 0 | 0 | 0 | 110.7 | ||||
| 41 | S | 44.6 | Very low | 40 | Very low | 120 Ų | 120 | 122.6 Ų | 122.6 | 84% | 0.839 | 82% | 0.819 | S | S | * | * | trans | -61.6 | 142.9 | 168.7 | -45.6 | 0 | 0 | 0 | 0 | 111.5 | ||||
| 42 | G | 32.8 | Very low | 39.3 | Very low | 79 Ų | 79 | 121 Ų | 121 | 81% | 0.814 | 81% | 0.811 | S | S | * | * | trans | -155.1 | 116.2 | 169.5 | 0 | 0 | 0 | 0 | 0 | 109.5 | ||||
| 43 | A | 40.5 | Very low | 38.8 | Very low | 113 Ų | 113 | 124 Ų | 124 | 93% | 0.934 | 82% | 0.815 | S | S | * | * | trans | -81.3 | 166 | -164.9 | 0 | 0 | 0 | 0 | 0 | 115.3 | ||||
| 44 | G | 33.9 | Very low | 38.6 | Very low | 79 Ų | 79 | 126.4 Ų | 126.4 | 81% | 0.814 | 81% | 0.814 | S | S | * | * | trans | 116.6 | 109.6 | 164.3 | 0 | 0 | 0 | 0 | 0 | 111.8 | ||||
| 45 | G | 34.3 | Very low | 38.4 | Very low | 73 Ų | 73 | 125.7 Ų | 125.7 | 75% | 0.753 | 81% | 0.809 | S | S | * | * | cis | 84.7 | 85.5 | 27.1 | 0 | 0 | 0 | 0 | 0 | 109.9 | ||||
| 46 | I | 35.7 | Very low | 38.2 | Very low | 171 Ų | 171 | 125.5 Ų | 125.5 | 88% | 0.877 | 81% | 0.808 | S | S | * | * | trans | 176.1 | 120.4 | 134.9 | 46.8 | 176.1 | 0 | 0 | 0 | 111.5 | ||||
| 47 | S | 38 | Very low | 38.2 | Very low | 113 Ų | 113 | 128.1 Ų | 128.1 | 79% | 0.79 | 81% | 0.812 | S | S | * | * | trans | -74 | 151.7 | 145.3 | -100.1 | 0 | 0 | 0 | 0 | 108.3 | ||||
| 48 | P | 43.8 | Very low | 37.9 | Very low | 126 Ų | 126 | 129.4 Ų | 129.4 | 82% | 0.818 | 81% | 0.81 | S | S | * | * | -143.8 | 159.6 | 104.7 | 17.4 | 5.4 | 0 | 0 | 0 | 116.3 | |||||
| 49 | Q | 37.1 | Very low | 37.5 | Very low | 181 Ų | 181 | 126.8 Ų | 126.8 | 85% | 0.846 | 81% | 0.805 | S | S | * | * | trans | -80.5 | 152.7 | -179.3 | -58.6 | -164.2 | 9.4 | 0 | 0 | 114.8 | ||||
| 50 | H | 34.8 | Very low | 38.2 | Very low | 158 Ų | 158 | 124.9 Ų | 124.9 | 73% | 0.731 | 80% | 0.802 | S | S | * | * | trans | 66.9 | 116.7 | 130.5 | -160.5 | -101.4 | 0 | 0 | 0 | 122.6 | ||||
| 51 | I | 33.4 | Very low | 38.3 | Very low | 157 Ų | 157 | 125 Ų | 125 | 81% | 0.805 | 80% | 0.799 | S | S | * | * | trans | 170.4 | 101.7 | 139 | -94.4 | 153.2 | 0 | 0 | 0 | 106.2 | ||||
| 52 | A | 34.5 | Very low | 37.8 | Very low | 75 Ų | 75 | 122.7 Ų | 122.7 | 62% | 0.62 | 80% | 0.795 | S | S | * | * | 95.3 | 134.4 | 69.8 | 0 | 0 | 0 | 0 | 0 | 113 | |||||
| 53 | Q | 36.4 | Very low | 38.6 | Very low | 193 Ų | 193 | 124.5 Ų | 124.5 | 90% | 0.902 | 79% | 0.792 | S | S | * | * | trans | 93.9 | 132.7 | 171.2 | -52.6 | -162.7 | -13.2 | 0 | 0 | 116.4 | ||||
| 54 | D | 32.3 | Very low | 38.2 | Very low | 142 Ų | 142 | 127.5 Ų | 127.5 | 76% | 0.759 | 79% | 0.787 | S | S | * | * | cis | -172.1 | 162.4 | -12.1 | -170 | 4.8 | 0 | 0 | 0 | 105.6 | ||||
| 55 | S | 35.8 | Very low | 38 | Very low | 112 Ų | 112 | 131.6 Ų | 131.6 | 78% | 0.783 | 79% | 0.79 | S | S | * | * | trans | 118.4 | 86.2 | 164.4 | -49.4 | 0 | 0 | 0 | 0 | 115.7 | ||||
| 56 | S | 36.4 | Very low | 38.2 | Very low | 109 Ų | 109 | 131.3 Ų | 131.3 | 76% | 0.762 | 79% | 0.787 | S | S | * | * | trans | -54.8 | 147.3 | 166 | -59.1 | 0 | 0 | 0 | 0 | 115.4 | ||||
| 57 | L | 40.6 | Very low | 38 | Very low | 175 Ų | 175 | 129.6 Ų | 129.6 | 92% | 0.916 | 79% | 0.785 | S | S | * | * | trans | -148.7 | 83.4 | 131.5 | -110.1 | 157.4 | 0 | 0 | 0 | 108.7 | ||||
| 58 | D | 39.2 | Very low | 37.7 | Very low | 141 Ų | 141 | 130.1 Ų | 130.1 | 75% | 0.754 | 78% | 0.783 | S | S | * | * | trans | 30.3 | 104 | 140.7 | -143.8 | 68.6 | 0 | 0 | 0 | 118.6 | ||||
| 59 | G | 45.1 | Very low | 37.6 | Very low | 70 Ų | 70 | 130.8 Ų | 130.8 | 72% | 0.722 | 79% | 0.785 | S | S | * | * | -128 | 158.5 | 129.8 | 0 | 0 | 0 | 0 | 0 | 107.8 | |||||
| 60 | P | 53.5 | Low | 37.9 | Very low | 112 Ų | 112 | 127.8 Ų | 127.8 | 73% | 0.727 | 78% | 0.781 | S | S | * | * | trans | -133.9 | 156.8 | 143.7 | 33 | -18.9 | 0 | 0 | 0 | 115.8 | ||||
| 61 | P | 42.4 | Very low | 38.1 | Very low | 126 Ų | 126 | 128 Ų | 128 | 82% | 0.818 | 79% | 0.787 | S | S | * | * | trans | -96.7 | 169.7 | -178.7 | 26.6 | -7.2 | 0 | 0 | 0 | 112.9 | ||||
| 62 | G | 33.3 | Very low | 38.1 | Very low | 72 Ų | 72 | 129.7 Ų | 129.7 | 74% | 0.742 | 79% | 0.791 | S | S | * | * | trans | -72.4 | -162.2 | -178.5 | 0 | 0 | 0 | 0 | 0 | 115.7 | ||||
| 63 | P | 49.3 | Very low | 38.4 | Very low | 117 Ų | 117 | 129.3 Ų | 129.3 | 76% | 0.76 | 80% | 0.795 | S | S | * | * | cis | -150.4 | -179.4 | 29.4 | 36.6 | -11.9 | 0 | 0 | 0 | 118.9 | ||||
| 64 | Q | 32.8 | Very low | 38.4 | Very low | 175 Ų | 175 | 130 Ų | 130 | 82% | 0.818 | 80% | 0.795 | S | S | * | * | trans | 89.5 | 105.7 | 158.6 | -46.9 | -161.4 | 6.9 | 0 | 0 | 119.4 | ||||
| 65 | D | 30.1 | Very low | 38.6 | Very low | 166 Ų | 166 | 129.5 Ų | 129.5 | 89% | 0.888 | 80% | 0.803 | S | S | * | * | -159.6 | 146.5 | 100.5 | -107.1 | -25.4 | 0 | 0 | 0 | 110.1 | |||||
| 66 | G | 37.3 | Very low | 38.7 | Very low | 67 Ų | 67 | 131.4 Ų | 131.4 | 69% | 0.691 | 80% | 0.803 | S | S | * | * | trans | -68.5 | 160.2 | -171.4 | 0 | 0 | 0 | 0 | 0 | 114.3 | ||||
| 67 | T | 32.8 | Very low | 39.1 | Very low | 134 Ų | 134 | 130.6 Ų | 130.6 | 82% | 0.822 | 80% | 0.797 | S | S | * | * | trans | -179.6 | 124 | 131.2 | -69.7 | 0 | 0 | 0 | 0 | 110.2 | ||||
| 68 | T | 31.8 | Very low | 38.9 | Very low | 124 Ų | 124 | 130.2 Ų | 130.2 | 76% | 0.761 | 79% | 0.791 | S | S | * | * | trans | -22 | 134.5 | 157.9 | 48.6 | 0 | 0 | 0 | 0 | 119 | ||||
| 69 | V | 41.7 | Very low | 39.3 | Very low | 140 Ų | 140 | 129 Ų | 129 | 85% | 0.848 | 80% | 0.8 | S | S | * | * | trans | -63.5 | 145.2 | 149.1 | -102.5 | 0 | 0 | 0 | 0 | 109.8 | ||||
| 70 | P | 41.8 | Very low | 39.4 | Very low | 118 Ų | 118 | 129 Ų | 129 | 77% | 0.766 | 79% | 0.793 | S | S | * | * | -151.8 | 155.4 | 83.7 | 35.7 | -14.5 | 0 | 0 | 0 | 118.7 | |||||
| 71 | L | 39.4 | Very low | 38.9 | Very low | 164 Ų | 164 | 130.2 Ų | 130.2 | 86% | 0.859 | 79% | 0.794 | S | S | * | * | trans | -26.5 | 118 | 145.4 | 179.1 | 83.7 | 0 | 0 | 0 | 115 | ||||
| 72 | E | 33.6 | Very low | 39.2 | Very low | 191 Ų | 191 | 131.9 Ų | 131.9 | 89% | 0.893 | 80% | 0.795 | S | S | * | * | trans | -153.4 | 114.9 | 144.4 | -78.9 | -155.4 | 143.6 | 0 | 0 | 110.1 | ||||
| 73 | G | 40.2 | Very low | 39.9 | Very low | 68 Ų | 68 | 135.4 Ų | 135.4 | 70% | 0.701 | 80% | 0.802 | S | S | * | * | trans | -97.4 | 101.5 | 164.1 | 0 | 0 | 0 | 0 | 0 | 109 | ||||
| 74 | F | 37.5 | Very low | 40 | Very low | 207 Ų | 207 | 135.4 Ų | 135.4 | 91% | 0.908 | 80% | 0.795 | S | S | * | * | trans | -154.3 | 78.9 | 158.3 | -103.7 | -81.1 | 0 | 0 | 0 | 107.8 | L76 | F74-L76 PolarHBondContact O-N 3.02Š| ||
| 75 | S | 35.3 | Very low | 40.9 | Very low | 131 Ų | 131 | 138.4 Ų | 138.4 | 92% | 0.916 | 80% | 0.799 | S | S | * | * | trans | -91.6 | 85.8 | 170.3 | 178.2 | 0 | 0 | 0 | 0 | 109 | ||||
| 76 | L | 39.3 | Very low | 41.7 | Very low | 153 Ų | 153 | 133.8 Ų | 133.8 | 80% | 0.801 | 79% | 0.791 | S | S | * | * | trans | -94.4 | 119.7 | 159.9 | -166 | 70 | 0 | 0 | 0 | 108.1 | F74 H78 | F74-L76 PolarHBondContact O-N 3.02Å; L76-H78 PolarHBondContact O-N 3.42Å | ||
| 77 | S | 43.3 | Very low | 42.2 | Very low | 91 Ų | 91 | 138.5 Ų | 138.5 | 64% | 0.636 | 80% | 0.795 | S | S | * | * | trans | -23.4 | 116.7 | 163.1 | 49.7 | 0 | 0 | 0 | 0 | 116.5 | ||||
| 78 | H | 37.4 | Very low | 42.8 | Very low | 168 Ų | 168 | 140.9 Ų | 140.9 | 78% | 0.778 | 79% | 0.794 | S | S | * | * | trans | -164.6 | 84.1 | 136.4 | -116.3 | 66.8 | 0 | 0 | 0 | 110.8 | L76 A80 | L76-H78 PolarHBondContact O-N 3.42Å; H78-A80 VanDerWaalsContact C-N 3.27Å; H78-A80 PolarHBondContact O-N 2.95Å | ||
| 79 | A | 46.6 | Very low | 43.6 | Very low | 114 Ų | 114 | 145.5 Ų | 145.5 | 94% | 0.942 | 80% | 0.798 | S | S | * | * | trans | -92.9 | 51.7 | 171 | 0 | 0 | 0 | 0 | 0 | 110.8 | ||||
| 80 | A | 47.8 | Very low | 44.3 | Very low | 71 Ų | 71 | 147.9 Ų | 147.9 | 59% | 0.587 | 80% | 0.799 | S | S | * | * | trans | -147.5 | 67.4 | 177.2 | 0 | 0 | 0 | 0 | 0 | 110.7 | H78 | H78-A80 VanDerWaalsContact C-N 3.27Å; H78-A80 PolarHBondContact O-N 2.95Å | ||
| 81 | D | 43.3 | Very low | 45.4 | Very low | 138 Ų | 138 | 146.6 Ų | 146.6 | 74% | 0.738 | 78% | 0.782 | S | S | * | * | trans | -156.1 | 47.1 | 165.3 | -104.3 | -30.2 | 0 | 0 | 0 | 113.1 | ||||
| 82 | L | 48.6 | Very low | 47.2 | Very low | 160 Ų | 160 | 142.3 Ų | 142.3 | 84% | 0.838 | 77% | 0.766 | S | S | * | * | S | Bend | trans | -109.9 | 23.3 | 168 | -70.6 | 179.2 | 0 | 0 | 0 | 113.4 | ||
| 83 | V | 48.9 | Very low | 49.2 | Very low | 146 Ų | 146 | 141.4 Ų | 141.4 | 89% | 0.885 | 76% | 0.761 | S | S | * | * | S | Bend | trans | -121.4 | 29 | 173.8 | -179.8 | 0 | 0 | 0 | 0 | 111.5 | ||
| 84 | N | 49.6 | Very low | 51.1 | Low | 117 Ų | 117 | 141.5 Ų | 141.5 | 63% | 0.626 | 76% | 0.755 | S | S | * | * | trans | -147.4 | 57.7 | 170 | -151.7 | -28 | 0 | 0 | 0 | 112.7 | ||||
| 85 | R | 52.3 | Low | 53.3 | Low | 238 Ų | 238 | 136.2 Ų | 136.2 | 90% | 0.898 | 73% | 0.733 | S | S | * | * | trans | -115.7 | 39 | 171.5 | -158.3 | -174.1 | -91.2 | -100.4 | 3.6 | 111 | ||||
| 86 | G | 47.6 | Very low | 55.6 | Low | 70 Ų | 70 | 133.9 Ų | 133.9 | 72% | 0.722 | 71% | 0.71 | S | S | * | * | S | Bend | trans | -129.5 | -12 | -173.6 | 0 | 0 | 0 | 0 | 0 | 116.5 | ||
| 87 | Q | 48 | Very low | 57.8 | Low | 165 Ų | 165 | 129 Ų | 129 | 77% | 0.771 | 69% | 0.691 | S | S | * | * | trans | -146.8 | 87.9 | -177.9 | -66.9 | 177.9 | -71.1 | 0 | 0 | 109.9 | ||||
| 88 | K | 44.1 | Very low | 60 | Low | 185 Ų | 185 | 130.2 Ų | 130.2 | 80% | 0.804 | 69% | 0.687 | S | S | * | * | trans | -139.3 | 27.5 | 172.6 | -150 | -166.7 | 174.8 | -178.7 | 0 | 114.3 | ||||
| 89 | W | 50.4 | Low | 62.5 | Low | 221 Ų | 221 | 126.1 Ų | 126.1 | 84% | 0.837 | 67% | 0.668 | S | S | * | * | trans | -134.9 | 4.5 | 173.7 | -62.2 | 116.8 | 0 | 0 | 0 | 115.5 | K91 | W89-K91 PolarHBondContact O-N 2.93Š| ||
| 90 | E | 54.9 | Low | 64.6 | Low | 189 Ų | 189 | 123.1 Ų | 123.1 | 88% | 0.883 | 64% | 0.643 | S | S | * | * | trans | -83.9 | 60.1 | 167.7 | -65.9 | -159.7 | 170.9 | 0 | 0 | 110.5 | S92 | E90-S92 PolarHBondContact O-N 2.93Š| ||
| 91 | K | 64.5 | Low | 66.7 | Low | 92 Ų | 92 | 127 Ų | 127 | 40% | 0.4 | 65% | 0.647 | S | S | . | * | trans | -63.3 | 123.3 | 153.9 | -70.4 | -178.2 | 177.4 | -171.1 | 0 | 105.4 | W89 H93 E95 I96 | W89-K91 PolarHBondContact O-N 2.93Å; K91-H93 PolarHBondContact O-N 3.11Å; K91-E95 HydrophobicContact CB-CB 4.4Å; K91-E95 HydrophobicContact CB-CG 4.49Å; K91-I96 HydrophobicContact CB-CD1 4.16Å; K91-I96 HydrophobicContact CB-CG1 3.61Å; K91-I96 WeakPolarHBondContact O-CD1 3.37Å | ||
| 92 | S | 77.6 | Confident | 69.1 | Low | 74 Ų | 74 | 124.9 Ų | 124.9 | 52% | 0.517 | 63% | 0.633 | S | S | . | * | trans | -53.5 | 144.8 | 176.7 | 175.6 | 0 | 0 | 0 | 0 | 109 | E90 A94 E95 I96 | E90-S92 PolarHBondContact O-N 2.93Å; S92-A94 PolarHBondContact O-N 3.36Å; S92-E95 WeakPolarHBondContact O-CA 3.38Å; S92-E95 WeakPolarHBondContact O-CB 3.3Å; S92-E95 PolarHBondContact O-N 2.95Å; S92-I96 PolarHBondContact O-N 3.21Å | ||
| 93 | H | 75.3 | Confident | 71.1 | Confident | 171 Ų | 171 | 122 Ų | 122 | 79% | 0.792 | 62% | 0.615 | S | S | * | * | H | α-helix | trans | -49.2 | -31.1 | 176.7 | -94.4 | -82.7 | 0 | 0 | 0 | 112.7 | K91 A97 | K91-H93 PolarHBondContact O-N 3.11Å; H93-A97 WeakPolarHBondContact O-CB 3.38Å; H93-A97 PolarHBondContact O-N 2.92Å |
| 94 | A | 81.6 | Confident | 73.3 | Confident | 70 Ų | 70 | 117.2 Ų | 117.2 | 58% | 0.579 | 59% | 0.591 | S | S | * | * | H | α-helix | trans | -66.6 | -42.6 | 174.1 | 0 | 0 | 0 | 0 | 0 | 113.2 | S92 A97 E98 | S92-A94 PolarHBondContact O-N 3.36Å; A94-A97 PolarHBondContact O-N 3.28Å; A94-E98 PolarHBondContact O-N 3.12Å |
| 95 | E | 82.8 | Confident | 75.4 | Confident | 96 Ų | 96 | 117.8 Ų | 117.8 | 45% | 0.449 | 59% | 0.59 | S | S | . | * | H | α-helix | trans | -69.8 | -36.8 | 178.5 | -169.7 | -173.4 | 165.8 | 0 | 0 | 111.4 | K91 S92 A97 E98 Q99 | K91-E95 HydrophobicContact CB-CB 4.4Å; K91-E95 HydrophobicContact CB-CG 4.49Å; S92-E95 WeakPolarHBondContact O-CA 3.38Å; S92-E95 WeakPolarHBondContact O-CB 3.3Å; S92-E95 PolarHBondContact O-N 2.95Å; E95-A97 VanDerWaalsContact C-N 3.34Å; E95-E98 PolarHBondContact O-N 3.45Å; E95-Q99 VanDerWaalsContact O-CB 3.31Å; E95-Q99 WeakPolarHBondContact O-CB 3.45Å; E95-Q99 PolarHBondContact O-N 3.39Å |
| 96 | I | 83.1 | Confident | 77.5 | Confident | 83 Ų | 83 | 111.3 Ų | 111.3 | 43% | 0.426 | 57% | 0.572 | S | S | . | * | H | α-helix | trans | -63.6 | -43 | 172.9 | -60.9 | 172.7 | 0 | 0 | 0 | 110.3 | K91 S92 A100 | K91-I96 HydrophobicContact CB-CD1 4.16Å; K91-I96 HydrophobicContact CB-CG1 3.61Å; K91-I96 WeakPolarHBondContact O-CD1 3.37Å; S92-I96 PolarHBondContact O-N 3.21Å; I96-A100 WeakPolarHBondContact O-CB 3.43Å; I96-A100 PolarHBondContact O-N 3.44Å |
| 97 | A | 86.4 | Confident | 79.7 | Confident | 50 Ų | 50 | 114.4 Ų | 114.4 | 41% | 0.413 | 57% | 0.568 | S | S | . | * | H | α-helix | trans | -68.2 | -36.4 | 178.6 | 0 | 0 | 0 | 0 | 0 | 112.5 | H93 A94 E95 K101 | H93-A97 WeakPolarHBondContact O-CB 3.38Å; H93-A97 PolarHBondContact O-N 2.92Å; A94-A97 PolarHBondContact O-N 3.28Å; E95-A97 VanDerWaalsContact C-N 3.34Å; A97-K101 VanDerWaalsContact O-CG 3.3Å; A97-K101 WeakPolarHBondContact O-CG 3.45Å; A97-K101 PolarHBondContact O-N 3.01Å; A97-K101 VanDerWaalsContact O-N 3.16Å |
| 98 | E | 89.4 | Confident | 81.9 | Confident | 116 Ų | 116 | 110.3 Ų | 110.3 | 54% | 0.542 | 55% | 0.554 | S | S | . | * | H | α-helix | trans | -66.8 | -47.1 | 174.6 | -170.7 | -176 | -176.8 | 0 | 0 | 111.4 | A94 E95 A100 K101 H102 | A94-E98 PolarHBondContact O-N 3.12Å; E95-E98 PolarHBondContact O-N 3.45Å; E98-A100 VanDerWaalsContact C-N 3.33Å; E98-A100 PolarHBondContact O-N 3.36Å; E98-K101 WeakPolarHBondContact O-CB 3.32Å; E98-K101 PolarHBondContact O-N 2.73Å; E98-K101 VanDerWaalsContact O-N 3.12Å; E98-H102 PolarHBondContact O-N 3.38Å; E98-H102 VanDerWaalsContact O-N 3.11Å |
| 99 | Q | 89.5 | Confident | 84.3 | Confident | 82 Ų | 82 | 107.7 Ų | 107.7 | 38% | 0.383 | 54% | 0.539 | S | S | . | . | H | α-helix | trans | -58.5 | -44.5 | 175.8 | -177.9 | 65.2 | 20.4 | 0 | 0 | 111.7 | E95 K101 H102 E103 | E95-Q99 VanDerWaalsContact O-CB 3.31Å; E95-Q99 WeakPolarHBondContact O-CB 3.45Å; E95-Q99 PolarHBondContact O-N 3.39Å; Q99-K101 VanDerWaalsContact C-N 3.28Å; Q99-K101 PolarHBondContact O-N 2.89Å; Q99-H102 PolarHBondContact O-N 3.15Å; Q99-E103 WeakPolarHBondContact CG-OE1 3.35Å; Q99-E103 PolarHBondContact NE2-OE1 3.45Å; Q99-E103 WeakPolarHBondContact O-CG 3.39Å; Q99-E103 PolarHBondContact O-N 2.87Å |
| 100 | A | 90.7 | Very high | 86.2 | Confident | 51 Ų | 51 | 99 Ų | 99 | 42% | 0.421 | 51% | 0.509 | S | S | . | . | H | α-helix | trans | -63 | -33.5 | 178 | 0 | 0 | 0 | 0 | 0 | 112.6 | I96 E98 A104 | I96-A100 WeakPolarHBondContact O-CB 3.43Å; I96-A100 PolarHBondContact O-N 3.44Å; E98-A100 VanDerWaalsContact C-N 3.33Å; E98-A100 PolarHBondContact O-N 3.36Å; A100-A104 VanDerWaalsContact O-CB 3.29Å; A100-A104 WeakPolarHBondContact O-CB 3.31Å; A100-A104 PolarHBondContact O-N 2.93Å |
| 101 | K | 92.3 | Very high | 87.9 | Confident | 153 Ų | 153 | 92.7 Ų | 92.7 | 67% | 0.665 | 49% | 0.489 | S | S | * | . | H | α-helix | trans | -66.8 | -44.3 | 174.4 | -74 | 171.6 | -177.2 | -178.2 | 0 | 111.5 | A97 E98 Q99 A104 E105 | A97-K101 VanDerWaalsContact O-CG 3.3Å; A97-K101 WeakPolarHBondContact O-CG 3.45Å; A97-K101 PolarHBondContact O-N 3.01Å; A97-K101 VanDerWaalsContact O-N 3.16Å; E98-K101 WeakPolarHBondContact O-CB 3.32Å; E98-K101 PolarHBondContact O-N 2.73Å; E98-K101 VanDerWaalsContact O-N 3.12Å; Q99-K101 VanDerWaalsContact C-N 3.28Å; Q99-K101 PolarHBondContact O-N 2.89Å; K101-A104 PolarHBondContact O-N 2.88Å; K101-E105 WeakPolarHBondContact O-CB 3.42Å; K101-E105 PolarHBondContact O-N 3.36Å |
| 102 | H | 93.3 | Very high | 89.2 | Confident | 94 Ų | 94 | 92.1 Ų | 92.1 | 44% | 0.435 | 49% | 0.487 | S | S | . | . | H | α-helix | trans | -63.7 | -41.6 | 176.3 | -78.5 | -26.3 | 0 | 0 | 0 | 112.2 | E98 Q99 E105 I106 | E98-H102 PolarHBondContact O-N 3.38Å; E98-H102 VanDerWaalsContact O-N 3.11Å; Q99-H102 PolarHBondContact O-N 3.15Å; H102-E105 IonicContact ND1-OE2 2.63Å; H102-E105 PolarHBondContact O-N 2.89Å; H102-I106 VanDerWaalsContact O-CG1 3.25Å; H102-I106 WeakPolarHBondContact O-CG1 3.29Å; H102-I106 PolarHBondContact O-N 2.87Å |
| 103 | E | 91.8 | Very high | 89.7 | Confident | 98 Ų | 98 | 90.4 Ų | 90.4 | 46% | 0.458 | 47% | 0.472 | S | S | . | . | H | α-helix | trans | -63.9 | -42.9 | 175.9 | -72 | 174.8 | -170.4 | 0 | 0 | 111.7 | Q99 E105 I106 E107 | Q99-E103 WeakPolarHBondContact CG-OE1 3.35Å; Q99-E103 PolarHBondContact NE2-OE1 3.45Å; Q99-E103 WeakPolarHBondContact O-CG 3.39Å; Q99-E103 PolarHBondContact O-N 2.87Å; E103-E105 PolarHBondContact O-N 3.25Å; E103-I106 PolarHBondContact O-N 3.07Å; E103-E107 WeakPolarHBondContact O-CG 3.39Å; E103-E107 PolarHBondContact O-N 3.34Å |
| 104 | A | 93.3 | Very high | 90.3 | Very high | 47 Ų | 47 | 87.9 Ų | 87.9 | 39% | 0.388 | 46% | 0.456 | S | S | . | . | H | α-helix | trans | -64.6 | -36.9 | 176 | 0 | 0 | 0 | 0 | 0 | 113 | A100 K101 E107 T108 | A100-A104 VanDerWaalsContact O-CB 3.29Å; A100-A104 WeakPolarHBondContact O-CB 3.31Å; A100-A104 PolarHBondContact O-N 2.93Å; K101-A104 PolarHBondContact O-N 2.88Å; A104-E107 PolarHBondContact O-N 3.39Å; A104-T108 WeakPolarHBondContact O-CB 3.25Å; A104-T108 PolarHBondContact O-N 3.47Å; A104-T108 PolarHBondContact O-OG1 3.35Å |
| 105 | E | 95.6 | Very high | 90.5 | Very high | 129 Ų | 129 | 93.6 Ų | 93.6 | 60% | 0.603 | 47% | 0.467 | S | S | * | . | H | α-helix | trans | -64.5 | -43.9 | 174.9 | -175.3 | 177.1 | -173 | 0 | 0 | 111.2 | K101 H102 E103 T108 R109 | K101-E105 WeakPolarHBondContact O-CB 3.42Å; K101-E105 PolarHBondContact O-N 3.36Å; H102-E105 IonicContact ND1-OE2 2.63Å; H102-E105 PolarHBondContact O-N 2.89Å; E103-E105 PolarHBondContact O-N 3.25Å; E105-T108 PolarHBondContact O-N 3.32Å; E105-R109 WeakPolarHBondContact O-CB 3.43Å; E105-R109 PolarHBondContact O-N 3.45Å |
| 106 | I | 94.9 | Very high | 90.8 | Very high | 101 Ų | 101 | 94.2 Ų | 94.2 | 52% | 0.518 | 47% | 0.471 | S | S | . | . | H | α-helix | trans | -60.7 | -47.1 | 174.8 | -68.3 | 165.3 | 0 | 0 | 0 | 110.5 | H102 E103 T108 R109 I110 | H102-I106 VanDerWaalsContact O-CG1 3.25Å; H102-I106 WeakPolarHBondContact O-CG1 3.29Å; H102-I106 PolarHBondContact O-N 2.87Å; E103-I106 PolarHBondContact O-N 3.07Å; I106-T108 VanDerWaalsContact C-N 3.34Å; I106-T108 PolarHBondContact O-N 2.8Å; I106-R109 PolarHBondContact O-N 2.81Å; I106-I110 HydrophobicContact CG2-CD1 3.7Å; I106-I110 HydrophobicContact CG2-CG1 4.39Å; I106-I110 VanDerWaalsContact O-CG1 3.24Å; I106-I110 WeakPolarHBondContact O-CG1 3.28Å; I106-I110 PolarHBondContact O-N 3.38Å |
| 107 | E | 93.6 | Very high | 90.6 | Very high | 136 Ų | 136 | 93.1 Ų | 93.1 | 64% | 0.636 | 48% | 0.479 | S | S | * | . | H | α-helix | trans | -62.3 | -41.7 | 178.4 | -74.1 | -178.7 | 173 | 0 | 0 | 112.5 | E103 A104 R109 I110 A111 | E103-E107 WeakPolarHBondContact O-CG 3.39Å; E103-E107 PolarHBondContact O-N 3.34Å; A104-E107 PolarHBondContact O-N 3.39Å; E107-R109 VanDerWaalsContact C-N 3.34Å; E107-I110 PolarHBondContact O-N 2.95Å; E107-A111 WeakPolarHBondContact O-CB 3.44Å; E107-A111 PolarHBondContact O-N 3.38Å |
| 108 | T | 94.7 | Very high | 90.1 | Very high | 78 Ų | 78 | 98.5 Ų | 98.5 | 48% | 0.479 | 49% | 0.494 | S | S | . | . | H | α-helix | trans | -61.4 | -45.5 | 175.4 | -57.8 | 0 | 0 | 0 | 0 | 110.2 | A104 E105 I106 I110 A111 E112 | A104-T108 WeakPolarHBondContact O-CB 3.25Å; A104-T108 PolarHBondContact O-N 3.47Å; A104-T108 PolarHBondContact O-OG1 3.35Å; E105-T108 PolarHBondContact O-N 3.32Å; I106-T108 VanDerWaalsContact C-N 3.34Å; I106-T108 PolarHBondContact O-N 2.8Å; T108-I110 PolarHBondContact O-N 3.41Å; T108-A111 WeakPolarHBondContact O-CB 3.36Å; T108-A111 PolarHBondContact O-N 2.9Å; T108-A111 VanDerWaalsContact O-N 3.15Å; T108-E112 WeakPolarHBondContact O-CG 3.43Å; T108-E112 PolarHBondContact O-N 2.81Å |
| 109 | R | 93.9 | Very high | 89.7 | Confident | 130 Ų | 130 | 98.6 Ų | 98.6 | 49% | 0.491 | 49% | 0.489 | S | S | . | . | H | α-helix | trans | -65.1 | -39.4 | 179 | -171 | 60.1 | 179.7 | 164 | 3.3 | 112.5 | E105 I106 E107 A111 E112 L113 | E105-R109 WeakPolarHBondContact O-CB 3.43Å; E105-R109 PolarHBondContact O-N 3.45Å; I106-R109 PolarHBondContact O-N 2.81Å; E107-R109 VanDerWaalsContact C-N 3.34Å; R109-A111 VanDerWaalsContact C-N 3.33Å; R109-E112 WeakPolarHBondContact CD-OE2 3.45Å; R109-E112 IonicContact CZ-OE2 2.59Å; R109-E112 IonicContact NH1-OE2 3.95Å; R109-E112 PolarHBondContact NH1-OE2 3.22Å; R109-E112 PolarHBondContact O-N 2.97Å; R109-L113 HydrophobicContact CG-CD1 4.38Å; R109-L113 VanDerWaalsContact O-CG 3.28Å; R109-L113 WeakPolarHBondContact O-CG 3.29Å; R109-L113 PolarHBondContact O-N 3.23Å |
| 110 | I | 90.6 | Very high | 88.9 | Confident | 40 Ų | 40 | 97.9 Ų | 97.9 | 21% | 0.205 | 49% | 0.493 | C | S | . | . | H | α-helix | trans | -64.4 | -40.7 | 173.9 | -68 | 166.4 | 0 | 0 | 0 | 110.3 | I106 E107 T108 L113 R114 | I106-I110 HydrophobicContact CG2-CD1 3.7Å; I106-I110 HydrophobicContact CG2-CG1 4.39Å; I106-I110 VanDerWaalsContact O-CG1 3.24Å; I106-I110 WeakPolarHBondContact O-CG1 3.28Å; I106-I110 PolarHBondContact O-N 3.38Å; E107-I110 PolarHBondContact O-N 2.95Å; T108-I110 PolarHBondContact O-N 3.41Å; I110-L113 PolarHBondContact O-N 2.9Å; I110-R114 HydrophobicContact CG2-CG 4.43Å; I110-R114 WeakPolarHBondContact O-CB 3.41Å; I110-R114 VanDerWaalsContact O-CG 3.29Å; I110-R114 WeakPolarHBondContact O-CG 3.24Å; I110-R114 PolarHBondContact O-N 2.88Å |
| 111 | A | 90 | Very high | 87.8 | Confident | 56 Ų | 56 | 102.4 Ų | 102.4 | 46% | 0.463 | 51% | 0.51 | S | S | . | . | H | α-helix | trans | -64.3 | -41.1 | 176.8 | 0 | 0 | 0 | 0 | 0 | 111.9 | E107 T108 R109 R114 K115 | E107-A111 WeakPolarHBondContact O-CB 3.44Å; E107-A111 PolarHBondContact O-N 3.38Å; T108-A111 WeakPolarHBondContact O-CB 3.36Å; T108-A111 PolarHBondContact O-N 2.9Å; T108-A111 VanDerWaalsContact O-N 3.15Å; R109-A111 VanDerWaalsContact C-N 3.33Å; A111-R114 PolarHBondContact O-N 3.5Å; A111-K115 VanDerWaalsContact O-CB 3.28Å; A111-K115 WeakPolarHBondContact O-CB 3.42Å; A111-K115 PolarHBondContact O-N 3.38Å |
| 112 | E | 91.9 | Very high | 86.9 | Confident | 79 Ų | 79 | 103.7 Ų | 103.7 | 37% | 0.369 | 52% | 0.515 | S | S | . | . | H | α-helix | trans | -59.2 | -50.5 | 171.8 | -72.8 | 175.6 | 175.2 | 0 | 0 | 111.3 | T108 R109 R114 K115 E116 | T108-E112 WeakPolarHBondContact O-CG 3.43Å; T108-E112 PolarHBondContact O-N 2.81Å; R109-E112 WeakPolarHBondContact CD-OE2 3.45Å; R109-E112 IonicContact CZ-OE2 2.59Å; R109-E112 IonicContact NH1-OE2 3.95Å; R109-E112 PolarHBondContact NH1-OE2 3.22Å; R109-E112 PolarHBondContact O-N 2.97Å; E112-R114 VanDerWaalsContact C-N 3.29Å; E112-R114 PolarHBondContact O-N 3.15Å; E112-K115 CarbonylContact O-C 3.58Å; E112-K115 WeakPolarHBondContact O-CB 3.28Å; E112-K115 PolarHBondContact O-N 2.92Å; E112-E116 WeakPolarHBondContact O-CB 3.43Å; E112-E116 WeakPolarHBondContact O-CG 3.45Å; E112-E116 PolarHBondContact O-N 3.38Å |
| 113 | L | 89.1 | Confident | 86 | Confident | 39 Ų | 39 | 109.7 Ų | 109.7 | 20% | 0.204 | 53% | 0.534 | C | S | . | . | H | α-helix | trans | -63.9 | -33.8 | 179.6 | -68 | 169.3 | 0 | 0 | 0 | 112.5 | R109 I110 G117 F118 W119 | R109-L113 HydrophobicContact CG-CD1 4.38Å; R109-L113 VanDerWaalsContact O-CG 3.28Å; R109-L113 WeakPolarHBondContact O-CG 3.29Å; R109-L113 PolarHBondContact O-N 3.23Å; I110-L113 PolarHBondContact O-N 2.9Å; L113-G117 PolarHBondContact O-N 3.39Å; L113-G117 VanDerWaalsContact O-N 3.15Å; L113-F118 HydrophobicContact CD2-CB 4.13Å; L113-F118 PolarHBondContact O-N 3.36Å; L113-W119 HydrophobicContact CB-CB 3.76Å; L113-W119 HydrophobicContact CB-CE3 4.43Å; L113-W119 HydrophobicContact CD1-CE3 3.97Å; L113-W119 HydrophobicContact CD1-CZ3 4.43Å; L113-W119 PolarHBondContact O-N 3.39Å |
| 114 | R | 87.3 | Confident | 85.1 | Confident | 117 Ų | 117 | 111.3 Ų | 111.3 | 44% | 0.442 | 55% | 0.545 | S | S | . | . | H | α-helix | trans | -68.9 | -39.4 | 172.4 | -75.2 | 176.8 | -178.7 | 146 | 1.6 | 111.7 | I110 A111 E112 G117 W119 | I110-R114 HydrophobicContact CG2-CG 4.43Å; I110-R114 WeakPolarHBondContact O-CB 3.41Å; I110-R114 VanDerWaalsContact O-CG 3.29Å; I110-R114 WeakPolarHBondContact O-CG 3.24Å; I110-R114 PolarHBondContact O-N 2.88Å; A111-R114 PolarHBondContact O-N 3.5Å; E112-R114 VanDerWaalsContact C-N 3.29Å; E112-R114 PolarHBondContact O-N 3.15Å; R114-G117 PolarHBondContact O-N 2.89Å; R114-W119 HydrophobicContact CB-CB 4.45Å; R114-W119 HydrophobicContact CG-CB 3.72Å; R114-W119 HydrophobicContact CG-CG 3.84Å |
| 115 | K | 87.4 | Confident | 84.2 | Confident | 190 Ų | 190 | 114.5 Ų | 114.5 | 83% | 0.826 | 56% | 0.562 | S | S | * | * | H | α-helix | trans | -68.3 | -39.7 | 177.5 | -177.1 | -176.2 | 176.4 | -173.6 | 0 | 112 | A111 E112 G117 | A111-K115 VanDerWaalsContact O-CB 3.28Å; A111-K115 WeakPolarHBondContact O-CB 3.42Å; A111-K115 PolarHBondContact O-N 3.38Å; E112-K115 CarbonylContact O-C 3.58Å; E112-K115 WeakPolarHBondContact O-CB 3.28Å; E112-K115 PolarHBondContact O-N 2.92Å; K115-G117 PolarHBondContact O-N 3.41Å |
| 116 | E | 87.4 | Confident | 83.4 | Confident | 110 Ų | 110 | 117.3 Ų | 117.3 | 51% | 0.514 | 57% | 0.572 | S | S | . | * | T | Hydrogen-bonded Turn | trans | -77.6 | -7.3 | 176.3 | -67.2 | 176 | -175 | 0 | 0 | 112.8 | E112 F118 | E112-E116 WeakPolarHBondContact O-CB 3.43Å; E112-E116 WeakPolarHBondContact O-CG 3.45Å; E112-E116 PolarHBondContact O-N 3.38Å; E116-F118 VanDerWaalsContact C-N 3.25Å; E116-F118 HydrophobicContact CB-CD2 3.57Å; E116-F118 HydrophobicContact CB-CE2 3.99Å; E116-F118 PolarHBondContact O-N 3.03Å |
| 117 | G | 78.9 | Confident | 82.8 | Confident | 59 Ų | 59 | 118.2 Ų | 118.2 | 61% | 0.608 | 58% | 0.582 | S | S | * | * | T | Hydrogen-bonded Turn | trans | 79.6 | 1.2 | 177.7 | 0 | 0 | 0 | 0 | 0 | 114.8 | L113 R114 K115 W119 | L113-G117 PolarHBondContact O-N 3.39Å; L113-G117 VanDerWaalsContact O-N 3.15Å; R114-G117 PolarHBondContact O-N 2.89Å; K115-G117 PolarHBondContact O-N 3.41Å; G117-W119 VanDerWaalsContact C-N 3.28Å; G117-W119 PolarHBondContact O-N 2.95Å |
| 118 | F | 77 | Confident | 82.2 | Confident | 163 Ų | 163 | 117.3 Ų | 117.3 | 72% | 0.715 | 59% | 0.588 | S | S | * | * | S | Bend | trans | -77.5 | -10.8 | 175.2 | -65.4 | -66.2 | 0 | 0 | 0 | 113.6 | L113 E116 | L113-F118 HydrophobicContact CD2-CB 4.13Å; L113-F118 PolarHBondContact O-N 3.36Å; E116-F118 VanDerWaalsContact C-N 3.25Å; E116-F118 HydrophobicContact CB-CD2 3.57Å; E116-F118 HydrophobicContact CB-CE2 3.99Å; E116-F118 PolarHBondContact O-N 3.03Å |
| 119 | W | 79.8 | Confident | 81.6 | Confident | 119 Ų | 119 | 121.8 Ų | 121.8 | 45% | 0.451 | 60% | 0.603 | S | S | . | * | S | Bend | trans | -115.4 | 98.5 | 171.8 | -164.5 | -73.8 | 0 | 0 | 0 | 110.7 | L113 R114 G117 L121 | L113-W119 HydrophobicContact CB-CB 3.76Å; L113-W119 HydrophobicContact CB-CE3 4.43Å; L113-W119 HydrophobicContact CD1-CE3 3.97Å; L113-W119 HydrophobicContact CD1-CZ3 4.43Å; L113-W119 PolarHBondContact O-N 3.39Å; R114-W119 HydrophobicContact CB-CB 4.45Å; R114-W119 HydrophobicContact CG-CB 3.72Å; R114-W119 HydrophobicContact CG-CG 3.84Å; G117-W119 VanDerWaalsContact C-N 3.28Å; G117-W119 PolarHBondContact O-N 2.95Å; W119-L121 PolarHBondContact O-N 2.76Å |
| 120 | S | 73.1 | Confident | 81.2 | Confident | 67 Ų | 67 | 120.5 Ų | 120.5 | 47% | 0.469 | 61% | 0.612 | S | S | . | * | trans | -70.1 | 124.6 | 179.9 | 65.1 | 0 | 0 | 0 | 0 | 111.6 | K122 | S120-K122 PolarHBondContact O-N 3.18Å; S120-K122 PolarHBondContact OG-O 3.45Å | ||
| 121 | L | 68 | Low | 81 | Confident | 146 Ų | 146 | 124.7 Ų | 124.7 | 76% | 0.764 | 64% | 0.642 | S | S | * | * | S | Bend | trans | -74 | -8.4 | 171.4 | -74.9 | 149.6 | 0 | 0 | 0 | 113.4 | W119 | W119-L121 PolarHBondContact O-N 2.76Š|
| 122 | K | 74.4 | Confident | 81 | Confident | 180 Ų | 180 | 130.3 Ų | 130.3 | 78% | 0.783 | 65% | 0.651 | S | S | * | * | S | Bend | trans | -109.5 | 147.9 | 179.6 | -80.7 | 175.3 | 175.3 | 167.2 | 0 | 110.2 | S120 L124 | S120-K122 PolarHBondContact O-N 3.18Å; S120-K122 PolarHBondContact OG-O 3.45Å; K122-L124 PolarHBondContact O-N 3.48Å |
| 123 | R | 73.1 | Confident | 81.1 | Confident | 220 Ų | 220 | 131.7 Ų | 131.7 | 83% | 0.83 | 67% | 0.667 | S | S | * | * | P | Polyproline II helix | trans | -53.7 | 126.2 | 168.7 | -154.9 | 177.7 | 99.8 | -172.1 | 6.8 | 108 | ||
| 124 | L | 73.3 | Confident | 81.3 | Confident | 132 Ų | 132 | 135.1 Ų | 135.1 | 69% | 0.691 | 68% | 0.68 | S | S | * | * | P | Polyproline II helix | trans | -50.4 | 134.5 | 177.3 | -70.6 | 165.8 | 0 | 0 | 0 | 109.1 | K122 K126 | K122-L124 PolarHBondContact O-N 3.48Å; L124-K126 PolarHBondContact O-N 2.92Å |
| 125 | P | 75.2 | Confident | 81.7 | Confident | 113 Ų | 113 | 130.5 Ų | 130.5 | 73% | 0.734 | 67% | 0.669 | S | S | * | * | P | Polyproline II helix | trans | -49.7 | 136.4 | 172.4 | -26.2 | 34.3 | 0 | 0 | 0 | 109.5 | V127 | P125-V127 PolarHBondContact O-N 3.44Š|
| 126 | K | 77.6 | Confident | 82.1 | Confident | 188 Ų | 188 | 128.9 Ų | 128.9 | 82% | 0.817 | 66% | 0.664 | S | S | * | * | trans | -59.2 | 110.1 | -180 | -149 | 176.9 | -176.1 | -175.1 | 0 | 106.6 | L124 | L124-K126 PolarHBondContact O-N 2.92Š| ||
| 127 | V | 82 | Confident | 82.6 | Confident | 120 Ų | 120 | 132.4 Ų | 132.4 | 73% | 0.727 | 67% | 0.673 | S | S | * | * | trans | -55.6 | 126.4 | 178.8 | 173.5 | 0 | 0 | 0 | 0 | 106.6 | P125 E129 | P125-V127 PolarHBondContact O-N 3.44Å; V127-E129 PolarHBondContact O-N 2.95Å | ||
| 128 | P | 81.7 | Confident | 83.4 | Confident | 118 Ų | 118 | 132.1 Ų | 132.1 | 77% | 0.766 | 66% | 0.657 | S | S | * | * | trans | -61.2 | 105.9 | 172.1 | -14.8 | 27.2 | 0 | 0 | 0 | 106.8 | ||||
| 129 | E | 81.7 | Confident | 84.3 | Confident | 171 Ų | 171 | 130.1 Ų | 130.1 | 80% | 0.799 | 65% | 0.645 | S | S | * | * | P | Polyproline II helix | trans | -63.8 | 130.8 | 176.3 | -167.3 | 171.8 | 175.6 | 0 | 0 | 107.7 | V127 | V127-E129 PolarHBondContact O-N 2.95Š|
| 130 | P | 86.1 | Confident | 85.1 | Confident | 103 Ų | 103 | 127.9 Ų | 127.9 | 67% | 0.669 | 64% | 0.642 | S | S | * | * | P | Polyproline II helix | trans | -51.2 | 139.6 | 173.9 | -26 | 34.2 | 0 | 0 | 0 | 109.8 | R132 | P130-R132 PolarHBondContact O-N 3.24Š|
| 131 | P | 87.2 | Confident | 86.3 | Confident | 128 Ų | 128 | 128.6 Ų | 128.6 | 83% | 0.831 | 65% | 0.646 | S | S | * | * | P | Polyproline II helix | trans | -53 | 119.4 | 178.8 | -25.5 | 33.4 | 0 | 0 | 0 | 110.4 | ||
| 132 | R | 89.9 | Confident | 87.6 | Confident | 175 Ų | 175 | 125.1 Ų | 125.1 | 66% | 0.66 | 63% | 0.626 | S | S | * | * | P | Polyproline II helix | trans | -59.6 | 131.3 | 178 | -176.6 | -171.7 | 171.1 | -120.5 | 0.8 | 108.8 | P130 D138 | P130-R132 PolarHBondContact O-N 3.24Å; R132-D138 IonicContact CZ-OD2 3.56Å; R132-D138 IonicContact NH1-OD1 2.73Å; R132-D138 IonicContact NH1-OD2 3.4Å; R132-D138 PolarHBondContact NH1-OD2 3.2Å |
| 133 | P | 92.7 | Very high | 88.7 | Confident | 108 Ų | 108 | 121.3 Ų | 121.3 | 70% | 0.701 | 61% | 0.611 | S | S | * | * | P | Polyproline II helix | trans | -64.2 | 144.7 | 172.5 | 27.7 | -34 | 0 | 0 | 0 | 110.2 | G135 | P133-G135 PolarHBondContact O-N 3.34Š|
| 134 | K | 93.4 | Very high | 89.9 | Confident | 111 Ų | 111 | 116.3 Ų | 116.3 | 48% | 0.483 | 60% | 0.598 | S | S | . | * | P | Polyproline II helix | trans | -58.9 | 121.3 | 177.2 | -68.5 | -172.3 | 180 | -172.6 | 0 | 110.3 | D138 Y139 E142 | K134-D138 WeakPolarHBondContact CA-OD2 3.34Å; K134-D138 HydrophobicContact CB-CB 4.18Å; K134-D138 HydrophobicContact CG-CB 4.41Å; K134-Y139 HydrophobicContact CB-CE1 4.42Å; K134-Y139 HydrophobicContact CB-CE2 3.81Å; K134-Y139 HydrophobicContact CD-CE1 3.91Å; K134-E142 WeakPolarHBondContact CD-OE1 3.06Å; K134-E142 WeakPolarHBondContact CE-OE1 3.26Å; K134-E142 IonicContact NZ-OE1 3.49Å; K134-E142 PolarHBondContact NZ-OE1 3.05Å; K134-E142 IonicContact NZ-OE2 3.83Å; K134-E142 PolarHBondContact NZ-OE2 3.08Å |
| 135 | G | 95.5 | Very high | 91.1 | Very high | 20 Ų | 20 | 116.9 Ų | 116.9 | 21% | 0.206 | 60% | 0.597 | C | S | . | * | P | Polyproline II helix | trans | -83.2 | 170.3 | 169.9 | 0 | 0 | 0 | 0 | 0 | 111.5 | P133 W137 D138 Y139 | P133-G135 PolarHBondContact O-N 3.34Å; G135-W137 PolarHBondContact O-N 2.99Å; G135-D138 PolarHBondContact N-OD2 3.45Å; G135-D138 WeakPolarHBondContact O-CB 3.5Å; G135-D138 PolarHBondContact O-N 2.98Å; G135-Y139 VanDerWaalsContact O-CD2 3.26Å; G135-Y139 WeakPolarHBondContact O-CD2 3.47Å; G135-Y139 PolarHBondContact O-N 2.88Å |
| 136 | H | 96.7 | Very high | 92.1 | Very high | 155 Ų | 155 | 118.2 Ų | 118.2 | 72% | 0.718 | 59% | 0.588 | S | S | * | * | H | α-helix | trans | -54.2 | -39 | 178.3 | -176.6 | 62.3 | 0 | 0 | 0 | 113.2 | D138 Y139 L140 | H136-D138 VanDerWaalsContact C-N 3.32Å; H136-D138 PolarHBondContact O-N 3.28Å; H136-Y139 PolarHBondContact O-N 3.37Å; H136-L140 PolarHBondContact O-N 2.63Å; H136-L140 VanDerWaalsContact O-N 3.08Å |
| 137 | W | 96.8 | Very high | 93.1 | Very high | 185 Ų | 185 | 111.8 Ų | 111.8 | 70% | 0.701 | 56% | 0.562 | S | S | * | * | H | α-helix | trans | -63.9 | -33.1 | 176.5 | -75.6 | 106.2 | 0 | 0 | 0 | 113.8 | G135 Y139 L140 C141 | G135-W137 PolarHBondContact O-N 2.99Å; W137-Y139 VanDerWaalsContact C-N 3.34Å; W137-L140 HydrophobicContact CE3-CD2 3.59Å; W137-L140 HydrophobicContact CH2-CD2 4.4Å; W137-L140 HydrophobicContact CZ3-CD2 3.41Å; W137-L140 VanDerWaalsContact CZ3-CD2 3.41Å; W137-L140 PolarHBondContact O-N 3.42Å; W137-C141 PolarHBondContact O-N 3.07Å; W137-C141 PolarHBondContact O-SG 3.37Å |
| 138 | D | 96 | Very high | 93.9 | Very high | 52 Ų | 52 | 109.3 Ų | 109.3 | 28% | 0.278 | 55% | 0.55 | S | S | . | * | H | α-helix | trans | -66.7 | -41.3 | 179 | -58.4 | -44.7 | 0 | 0 | 0 | 109.8 | R132 K134 G135 H136 C141 E142 | R132-D138 IonicContact CZ-OD2 3.56Å; R132-D138 IonicContact NH1-OD1 2.73Å; R132-D138 IonicContact NH1-OD2 3.4Å; R132-D138 PolarHBondContact NH1-OD2 3.2Å; K134-D138 WeakPolarHBondContact CA-OD2 3.34Å; K134-D138 HydrophobicContact CB-CB 4.18Å; K134-D138 HydrophobicContact CG-CB 4.41Å; G135-D138 PolarHBondContact N-OD2 3.45Å; G135-D138 WeakPolarHBondContact O-CB 3.5Å; G135-D138 PolarHBondContact O-N 2.98Å; H136-D138 VanDerWaalsContact C-N 3.32Å; H136-D138 PolarHBondContact O-N 3.28Å; D138-C141 PolarHBondContact O-N 3.15Å; D138-E142 WeakPolarHBondContact O-CG 3.34Å; D138-E142 PolarHBondContact O-N 3.38Å |
| 139 | Y | 96.1 | Very high | 94.7 | Very high | 121 Ų | 121 | 106.4 Ų | 106.4 | 48% | 0.475 | 54% | 0.536 | S | S | . | . | H | α-helix | trans | -63.5 | -42.8 | 172.6 | -64.4 | -69.9 | 0 | 0 | 0 | 112.3 | K134 G135 H136 W137 C141 E142 E143 | K134-Y139 HydrophobicContact CB-CE1 4.42Å; K134-Y139 HydrophobicContact CB-CE2 3.81Å; K134-Y139 HydrophobicContact CD-CE1 3.91Å; G135-Y139 VanDerWaalsContact O-CD2 3.26Å; G135-Y139 WeakPolarHBondContact O-CD2 3.47Å; G135-Y139 PolarHBondContact O-N 2.88Å; H136-Y139 PolarHBondContact O-N 3.37Å; W137-Y139 VanDerWaalsContact C-N 3.34Å; Y139-C141 VanDerWaalsContact C-N 3.29Å; Y139-C141 PolarHBondContact O-N 3.41Å; Y139-E142 PolarHBondContact O-N 2.91Å; Y139-E143 VanDerWaalsContact O-CG 3.31Å; Y139-E143 WeakPolarHBondContact O-CG 3.4Å; Y139-E143 PolarHBondContact O-N 3.48Å |
| 140 | L | 97.4 | Very high | 95.5 | Very high | 72 Ų | 72 | 102 Ų | 102 | 38% | 0.377 | 52% | 0.518 | S | S | . | . | H | α-helix | trans | -58.8 | -43.6 | 176.6 | -178 | 68.7 | 0 | 0 | 0 | 111.6 | H136 W137 E143 M144 | H136-L140 PolarHBondContact O-N 2.63Å; H136-L140 VanDerWaalsContact O-N 3.08Å; W137-L140 HydrophobicContact CE3-CD2 3.59Å; W137-L140 HydrophobicContact CH2-CD2 4.4Å; W137-L140 HydrophobicContact CZ3-CD2 3.41Å; W137-L140 VanDerWaalsContact CZ3-CD2 3.41Å; W137-L140 PolarHBondContact O-N 3.42Å; L140-E143 PolarHBondContact O-N 3.44Å; L140-M144 WeakPolarHBondContact O-CB 3.31Å; L140-M144 PolarHBondContact O-N 3.35Å |
| 141 | C | 97 | Very high | 96.1 | Very high | 83 Ų | 83 | 101.6 Ų | 101.6 | 56% | 0.561 | 51% | 0.506 | S | S | * | . | H | α-helix | trans | -67.1 | -38.8 | 178.1 | -72.4 | 0 | 0 | 0 | 0 | 112.3 | W137 D138 Y139 E143 M144 Q145 | W137-C141 PolarHBondContact O-N 3.07Å; W137-C141 PolarHBondContact O-SG 3.37Å; D138-C141 PolarHBondContact O-N 3.15Å; Y139-C141 VanDerWaalsContact C-N 3.29Å; Y139-C141 PolarHBondContact O-N 3.41Å; C141-E143 VanDerWaalsContact C-N 3.34Å; C141-M144 PolarHBondContact O-N 3.42Å; C141-Q145 WeakPolarHBondContact O-CB 3.44Å; C141-Q145 PolarHBondContact O-N 2.68Å |
| 142 | E | 95.8 | Very high | 96.6 | Very high | 72 Ų | 72 | 97.6 Ų | 97.6 | 34% | 0.336 | 48% | 0.484 | S | S | . | . | H | α-helix | trans | -59 | -46.6 | 172.7 | -76.2 | 170.8 | -160.7 | 0 | 0 | 111.1 | K134 D138 Y139 Q145 W146 | K134-E142 WeakPolarHBondContact CD-OE1 3.06Å; K134-E142 WeakPolarHBondContact CE-OE1 3.26Å; K134-E142 IonicContact NZ-OE1 3.49Å; K134-E142 PolarHBondContact NZ-OE1 3.05Å; K134-E142 IonicContact NZ-OE2 3.83Å; K134-E142 PolarHBondContact NZ-OE2 3.08Å; D138-E142 WeakPolarHBondContact O-CG 3.34Å; D138-E142 PolarHBondContact O-N 3.38Å; Y139-E142 PolarHBondContact O-N 2.91Å; E142-Q145 PolarHBondContact O-N 3.29Å; E142-W146 VanDerWaalsContact O-CD1 3.25Å; E142-W146 PolarHBondContact O-N 3.28Å |
| 143 | E | 97.4 | Very high | 97 | Very high | 101 Ų | 101 | 95.3 Ų | 95.3 | 47% | 0.472 | 48% | 0.481 | S | S | . | . | H | α-helix | trans | -63.1 | -46.1 | 178.9 | -66.7 | -60.4 | 135.3 | 0 | 0 | 112 | Y139 L140 C141 Q145 W146 L147 | Y139-E143 VanDerWaalsContact O-CG 3.31Å; Y139-E143 WeakPolarHBondContact O-CG 3.4Å; Y139-E143 PolarHBondContact O-N 3.48Å; L140-E143 PolarHBondContact O-N 3.44Å; C141-E143 VanDerWaalsContact C-N 3.34Å; E143-Q145 VanDerWaalsContact C-N 3.27Å; E143-Q145 PolarHBondContact O-N 2.94Å; E143-W146 VanDerWaalsContact CA-CD1 3.45Å; E143-W146 VanDerWaalsContact CA-NE1 3.31Å; E143-W146 VanDerWaalsContact CD-NE1 3.29Å; E143-W146 PolarHBondContact O-N 3.38Å; E143-W146 PolarHBondContact O-NE1 3.32Å; E143-W146 VanDerWaalsContact OE2-CE2 3.28Å; E143-W146 WeakPolarHBondContact OE2-CZ2 3.41Å; E143-W146 PolarHBondContact OE2-NE1 3.33Å; E143-L147 VanDerWaalsContact O-CB 3.31Å; E143-L147 WeakPolarHBondContact O-CB 3.43Å; E143-L147 PolarHBondContact O-N 2.68Å; E143-L147 VanDerWaalsContact O-N 3.08Å |
| 144 | M | 98.3 | Very high | 97.3 | Very high | 114 Ų | 114 | 92.9 Ų | 92.9 | 56% | 0.562 | 46% | 0.46 | S | S | * | . | H | α-helix | trans | -66 | -32 | 179.4 | -157.6 | 72.5 | 80.3 | 0 | 0 | 112.1 | L140 C141 L147 S148 | L140-M144 WeakPolarHBondContact O-CB 3.31Å; L140-M144 PolarHBondContact O-N 3.35Å; C141-M144 PolarHBondContact O-N 3.42Å; M144-L147 HydrophobicContact SD-CD2 4.39Å; M144-S148 VanDerWaalsContact O-CB 3.31Å; M144-S148 WeakPolarHBondContact O-CB 3.31Å; M144-S148 PolarHBondContact O-N 2.91Å |
| 145 | Q | 97.9 | Very high | 97.6 | Very high | 144 Ų | 144 | 94.4 Ų | 94.4 | 67% | 0.673 | 46% | 0.463 | S | S | * | . | H | α-helix | trans | -64.5 | -50.8 | 179 | -174.6 | 175.2 | 31 | 0 | 0 | 111.3 | C141 E142 E143 S148 A149 | C141-Q145 WeakPolarHBondContact O-CB 3.44Å; C141-Q145 PolarHBondContact O-N 2.68Å; E142-Q145 PolarHBondContact O-N 3.29Å; E143-Q145 VanDerWaalsContact C-N 3.27Å; E143-Q145 PolarHBondContact O-N 2.94Å; Q145-S148 PolarHBondContact O-N 3.34Å; Q145-S148 PolarHBondContact O-OG 3.03Å; Q145-A149 PolarHBondContact O-N 2.98Å |
| 146 | W | 97.4 | Very high | 97.7 | Very high | 141 Ų | 141 | 102.3 Ų | 102.3 | 53% | 0.534 | 49% | 0.487 | S | S | . | . | H | α-helix | trans | -69.2 | -36.8 | 179 | 73.4 | -104.4 | 0 | 0 | 0 | 111.6 | E142 E143 S148 A149 D150 | E142-W146 VanDerWaalsContact O-CD1 3.25Å; E142-W146 PolarHBondContact O-N 3.28Å; E143-W146 VanDerWaalsContact CA-CD1 3.45Å; E143-W146 VanDerWaalsContact CA-NE1 3.31Å; E143-W146 VanDerWaalsContact CD-NE1 3.29Å; E143-W146 PolarHBondContact O-N 3.38Å; E143-W146 PolarHBondContact O-NE1 3.32Å; E143-W146 VanDerWaalsContact OE2-CE2 3.28Å; E143-W146 WeakPolarHBondContact OE2-CZ2 3.41Å; E143-W146 PolarHBondContact OE2-NE1 3.33Å; W146-S148 VanDerWaalsContact C-N 3.28Å; W146-S148 PolarHBondContact O-N 2.88Å; W146-A149 WeakPolarHBondContact O-CB 3.31Å; W146-A149 PolarHBondContact O-N 3.25Å; W146-A149 VanDerWaalsContact O-N 3.15Å; W146-D150 PolarHBondContact O-N 3.08Å |
| 147 | L | 98.4 | Very high | 97.8 | Very high | 54 Ų | 54 | 101.4 Ų | 101.4 | 28% | 0.283 | 48% | 0.477 | S | S | . | . | H | α-helix | trans | -63 | -36.5 | 176.8 | -174.1 | 65.2 | 0 | 0 | 0 | 112 | E143 M144 A149 D150 F151 | E143-L147 VanDerWaalsContact O-CB 3.31Å; E143-L147 WeakPolarHBondContact O-CB 3.43Å; E143-L147 PolarHBondContact O-N 2.68Å; E143-L147 VanDerWaalsContact O-N 3.08Å; M144-L147 HydrophobicContact SD-CD2 4.39Å; L147-A149 VanDerWaalsContact C-N 3.3Å; L147-A149 PolarHBondContact O-N 3.22Å; L147-D150 PolarHBondContact O-N 2.93Å; L147-F151 HydrophobicContact CD1-CD2 4.36Å; L147-F151 HydrophobicContact CD1-CE2 3.83Å; L147-F151 HydrophobicContact CD1-CZ 4.07Å; L147-F151 HydrophobicContact CD2-CE2 3.85Å; L147-F151 HydrophobicContact CD2-CZ 4.5Å; L147-F151 HydrophobicContact CG-CD2 3.97Å; L147-F151 HydrophobicContact CG-CE2 3.54Å; L147-F151 HydrophobicContact CG-CZ 4.26Å; L147-F151 WeakPolarHBondContact O-CD2 3.46Å; L147-F151 PolarHBondContact O-N 3.44Å |
| 148 | S | 98.4 | Very high | 97.9 | Very high | 68 Ų | 68 | 97.4 Ų | 97.4 | 48% | 0.476 | 46% | 0.464 | S | S | . | . | H | α-helix | trans | -62.1 | -38.7 | 175.9 | 79.5 | 0 | 0 | 0 | 0 | 112.3 | M144 Q145 W146 A152 | M144-S148 VanDerWaalsContact O-CB 3.31Å; M144-S148 WeakPolarHBondContact O-CB 3.31Å; M144-S148 PolarHBondContact O-N 2.91Å; Q145-S148 PolarHBondContact O-N 3.34Å; Q145-S148 PolarHBondContact O-OG 3.03Å; W146-S148 VanDerWaalsContact C-N 3.28Å; W146-S148 PolarHBondContact O-N 2.88Å; S148-A152 WeakPolarHBondContact O-CB 3.41Å; S148-A152 PolarHBondContact O-N 3.3Å; S148-A152 VanDerWaalsContact O-N 3.07Å |
| 149 | A | 97.9 | Very high | 98 | Very high | 57 Ų | 57 | 101.6 Ų | 101.6 | 47% | 0.471 | 48% | 0.476 | S | S | . | . | H | α-helix | trans | -68.4 | -41.6 | 176.7 | 0 | 0 | 0 | 0 | 0 | 111 | Q145 W146 L147 A152 Q153 | Q145-A149 PolarHBondContact O-N 2.98Å; W146-A149 WeakPolarHBondContact O-CB 3.31Å; W146-A149 PolarHBondContact O-N 3.25Å; W146-A149 VanDerWaalsContact O-N 3.15Å; L147-A149 VanDerWaalsContact C-N 3.3Å; L147-A149 PolarHBondContact O-N 3.22Å; A149-A152 PolarHBondContact O-N 3.17Å; A149-Q153 WeakPolarHBondContact O-CB 3.42Å; A149-Q153 PolarHBondContact O-N 3.02Å |
| 150 | D | 98.3 | Very high | 98.1 | Very high | 78 Ų | 78 | 97.1 Ų | 97.1 | 42% | 0.417 | 47% | 0.467 | S | S | . | . | H | α-helix | trans | -58.5 | -52.2 | 176 | -171.2 | 69.4 | 0 | 0 | 0 | 111.1 | W146 L147 A152 Q153 E154 | W146-D150 PolarHBondContact O-N 3.08Å; L147-D150 PolarHBondContact O-N 2.93Å; D150-A152 VanDerWaalsContact C-N 3.28Å; D150-A152 PolarHBondContact O-N 2.88Å; D150-Q153 CarbonylContact O-C 3.59Å; D150-Q153 PolarHBondContact O-N 3.28Å; D150-Q153 VanDerWaalsContact O-N 3.17Å; D150-E154 WeakPolarHBondContact O-CB 3.48Å; D150-E154 PolarHBondContact O-N 3.38Å |
| 151 | F | 98.7 | Very high | 98.2 | Very high | 94 Ų | 94 | 97.4 Ų | 97.4 | 41% | 0.412 | 47% | 0.472 | S | S | . | . | H | α-helix | trans | -62.2 | -33.5 | 176.8 | -72 | -49.4 | 0 | 0 | 0 | 113.6 | L147 E154 R155 | L147-F151 HydrophobicContact CD1-CD2 4.36Å; L147-F151 HydrophobicContact CD1-CE2 3.83Å; L147-F151 HydrophobicContact CD1-CZ 4.07Å; L147-F151 HydrophobicContact CD2-CE2 3.85Å; L147-F151 HydrophobicContact CD2-CZ 4.5Å; L147-F151 HydrophobicContact CG-CD2 3.97Å; L147-F151 HydrophobicContact CG-CE2 3.54Å; L147-F151 HydrophobicContact CG-CZ 4.26Å; L147-F151 WeakPolarHBondContact O-CD2 3.46Å; L147-F151 PolarHBondContact O-N 3.44Å; F151-E154 PolarHBondContact O-N 2.83Å; F151-R155 WeakPolarHBondContact O-CB 3.36Å; F151-R155 PolarHBondContact O-N 2.75Å |
| 152 | A | 98.6 | Very high | 98.3 | Very high | 45 Ų | 45 | 96.2 Ų | 96.2 | 37% | 0.372 | 47% | 0.467 | S | S | . | . | H | α-helix | trans | -67 | -45.6 | 175.8 | 0 | 0 | 0 | 0 | 0 | 111.5 | S148 A149 D150 E154 R156 | S148-A152 WeakPolarHBondContact O-CB 3.41Å; S148-A152 PolarHBondContact O-N 3.3Å; S148-A152 VanDerWaalsContact O-N 3.07Å; A149-A152 PolarHBondContact O-N 3.17Å; D150-A152 VanDerWaalsContact C-N 3.28Å; D150-A152 PolarHBondContact O-N 2.88Å; A152-E154 VanDerWaalsContact C-N 3.29Å; A152-R156 WeakPolarHBondContact O-CB 3.35Å; A152-R156 PolarHBondContact O-N 2.99Å |
| 153 | Q | 98.6 | Very high | 98.4 | Very high | 127 Ų | 127 | 99.2 Ų | 99.2 | 59% | 0.593 | 48% | 0.476 | S | S | * | . | H | α-helix | trans | -61.9 | -41.8 | 173.3 | -172.7 | 170.5 | 8.9 | 0 | 0 | 110.2 | A149 D150 R156 W157 | A149-Q153 WeakPolarHBondContact O-CB 3.42Å; A149-Q153 PolarHBondContact O-N 3.02Å; D150-Q153 CarbonylContact O-C 3.59Å; D150-Q153 PolarHBondContact O-N 3.28Å; D150-Q153 VanDerWaalsContact O-N 3.17Å; Q153-R156 CarbonylContact O-C 3.6Å; Q153-R156 WeakPolarHBondContact O-CA 3.32Å; Q153-R156 WeakPolarHBondContact O-CB 3.41Å; Q153-R156 PolarHBondContact O-N 3.38Å; Q153-W157 PolarHBondContact O-N 3.07Å |
| 154 | E | 98.7 | Very high | 98.5 | Very high | 56 Ų | 56 | 100.8 Ų | 100.8 | 26% | 0.262 | 48% | 0.481 | S | S | . | . | H | α-helix | trans | -58.3 | -52.3 | 178.7 | -154.4 | -168.1 | -173.7 | 0 | 0 | 112.3 | D150 F151 A152 R156 W157 K158 | D150-E154 WeakPolarHBondContact O-CB 3.48Å; D150-E154 PolarHBondContact O-N 3.38Å; F151-E154 PolarHBondContact O-N 2.83Å; A152-E154 VanDerWaalsContact C-N 3.29Å; E154-R156 VanDerWaalsContact C-N 3.25Å; E154-R156 PolarHBondContact O-N 3.03Å; E154-W157 VanDerWaalsContact CA-NE1 3.33Å; E154-W157 HydrophobicContact CG-CZ2 3.95Å; E154-W157 PolarHBondContact O-N 3.49Å; E154-K158 HydrophobicContact CG-CD 4.04Å; E154-K158 VanDerWaalsContact O-CB 3.3Å; E154-K158 WeakPolarHBondContact O-CB 3.3Å; E154-K158 WeakPolarHBondContact O-CG 3.48Å; E154-K158 PolarHBondContact O-N 3.06Å; E154-K158 WeakPolarHBondContact OE1-CE 3.21Å; E154-K158 IonicContact OE1-NZ 3.85Å; E154-K158 PolarHBondContact OE1-NZ 3.46Å; E154-K158 IonicContact OE2-NZ 3.97Å |
| 155 | R | 98.8 | Very high | 98.5 | Very high | 144 Ų | 144 | 99.1 Ų | 99.1 | 54% | 0.543 | 48% | 0.477 | S | S | . | . | H | α-helix | trans | -58.8 | -37.5 | 172.9 | -81 | -177.9 | -106.1 | 104.2 | 0.1 | 112 | F151 R159 | F151-R155 WeakPolarHBondContact O-CB 3.36Å; F151-R155 PolarHBondContact O-N 2.75Å; R155-R159 VanDerWaalsContact O-CB 3.3Å; R155-R159 WeakPolarHBondContact O-CB 3.3Å; R155-R159 WeakPolarHBondContact O-CG 3.45Å; R155-R159 PolarHBondContact O-N 2.88Å; R155-R159 PolarHBondContact O-NE 3Å |
| 156 | R | 98.8 | Very high | 98.6 | Very high | 186 Ų | 186 | 96.3 Ų | 96.3 | 70% | 0.702 | 47% | 0.47 | S | S | * | . | H | α-helix | trans | -69 | -49.4 | -178.8 | -166.6 | -179.1 | -162.1 | -159 | 4.8 | 111.3 | A152 Q153 E154 G160 | A152-R156 WeakPolarHBondContact O-CB 3.35Å; A152-R156 PolarHBondContact O-N 2.99Å; Q153-R156 CarbonylContact O-C 3.6Å; Q153-R156 WeakPolarHBondContact O-CA 3.32Å; Q153-R156 WeakPolarHBondContact O-CB 3.41Å; Q153-R156 PolarHBondContact O-N 3.38Å; E154-R156 VanDerWaalsContact C-N 3.25Å; E154-R156 PolarHBondContact O-N 3.03Å; R156-G160 PolarHBondContact O-N 3.24Å |
| 157 | W | 98.6 | Very high | 98.6 | Very high | 136 Ų | 136 | 97.9 Ų | 97.9 | 52% | 0.515 | 48% | 0.475 | S | S | . | . | H | α-helix | trans | -71.5 | -40.2 | -177.1 | 76.1 | -111 | 0 | 0 | 0 | 111.5 | Q153 E154 R159 G160 V161 | Q153-W157 PolarHBondContact O-N 3.07Å; E154-W157 VanDerWaalsContact CA-NE1 3.33Å; E154-W157 HydrophobicContact CG-CZ2 3.95Å; E154-W157 PolarHBondContact O-N 3.49Å; W157-R159 PolarHBondContact O-N 2.95Å; W157-G160 CarbonylContact O-C 3.57Å; W157-G160 WeakPolarHBondContact O-CA 3.37Å; W157-G160 PolarHBondContact O-N 3.38Å; W157-V161 HydrophobicContact CE3-CG2 4.02Å; W157-V161 HydrophobicContact CZ3-CG2 4.34Å; W157-V161 WeakPolarHBondContact O-CG2 3.35Å; W157-V161 PolarHBondContact O-N 3.37Å |
| 158 | K | 98.8 | Very high | 98.6 | Very high | 101 Ų | 101 | 100 Ų | 100 | 44% | 0.439 | 49% | 0.485 | S | S | . | . | H | α-helix | trans | -61 | -44.7 | 174.9 | -74.3 | -179.6 | 170.9 | 173.1 | 0 | 112.3 | E154 G160 V161 A162 | E154-K158 HydrophobicContact CG-CD 4.04Å; E154-K158 VanDerWaalsContact O-CB 3.3Å; E154-K158 WeakPolarHBondContact O-CB 3.3Å; E154-K158 WeakPolarHBondContact O-CG 3.48Å; E154-K158 PolarHBondContact O-N 3.06Å; E154-K158 WeakPolarHBondContact OE1-CE 3.21Å; E154-K158 IonicContact OE1-NZ 3.85Å; E154-K158 PolarHBondContact OE1-NZ 3.46Å; E154-K158 IonicContact OE2-NZ 3.97Å; K158-G160 VanDerWaalsContact C-N 3.27Å; K158-G160 PolarHBondContact O-N 3.09Å; K158-V161 PolarHBondContact O-N 3.2Å; K158-A162 PolarHBondContact O-N 3.3Å |
| 159 | R | 98.8 | Very high | 98.7 | Very high | 140 Ų | 140 | 100.4 Ų | 100.4 | 53% | 0.528 | 48% | 0.484 | S | S | . | . | H | α-helix | trans | -61.3 | -37 | 171.9 | -76.2 | -178.9 | -68.8 | 157.8 | -5.6 | 112 | R155 W157 A162 R163 | R155-R159 VanDerWaalsContact O-CB 3.3Å; R155-R159 WeakPolarHBondContact O-CB 3.3Å; R155-R159 WeakPolarHBondContact O-CG 3.45Å; R155-R159 PolarHBondContact O-N 2.88Å; R155-R159 PolarHBondContact O-NE 3Å; W157-R159 PolarHBondContact O-N 2.95Å; R159-A162 PolarHBondContact O-N 3.43Å; R159-R163 WeakPolarHBondContact O-CG 3.47Å; R159-R163 PolarHBondContact O-N 3.32Å |
| 160 | G | 98.7 | Very high | 98.7 | Very high | 27 Ų | 27 | 102.9 Ų | 102.9 | 28% | 0.278 | 49% | 0.488 | S | S | . | . | H | α-helix | trans | -59.9 | -47 | 174 | 0 | 0 | 0 | 0 | 0 | 112.6 | R156 W157 K158 R163 K164 | R156-G160 PolarHBondContact O-N 3.24Å; W157-G160 CarbonylContact O-C 3.57Å; W157-G160 WeakPolarHBondContact O-CA 3.37Å; W157-G160 PolarHBondContact O-N 3.38Å; K158-G160 VanDerWaalsContact C-N 3.27Å; K158-G160 PolarHBondContact O-N 3.09Å; G160-R163 PolarHBondContact O-N 2.96Å; G160-K164 PolarHBondContact O-N 2.95Å |
| 161 | V | 98.8 | Very high | 98.7 | Very high | 78 Ų | 78 | 104.8 Ų | 104.8 | 47% | 0.473 | 49% | 0.49 | S | S | . | . | H | α-helix | trans | -61.5 | -48 | 176.4 | 173.7 | 0 | 0 | 0 | 0 | 110.9 | W157 K158 R163 K164 V165 | W157-V161 HydrophobicContact CE3-CG2 4.02Å; W157-V161 HydrophobicContact CZ3-CG2 4.34Å; W157-V161 WeakPolarHBondContact O-CG2 3.35Å; W157-V161 PolarHBondContact O-N 3.37Å; K158-V161 PolarHBondContact O-N 3.2Å; V161-R163 VanDerWaalsContact C-N 3.33Å; V161-R163 PolarHBondContact O-N 3.18Å; V161-K164 WeakPolarHBondContact O-CA 3.27Å; V161-K164 WeakPolarHBondContact O-CB 3.35Å; V161-K164 PolarHBondContact O-N 3.5Å; V161-V165 WeakPolarHBondContact O-CG2 3.42Å; V161-V165 PolarHBondContact O-N 3.22Å |
| 162 | A | 98.8 | Very high | 98.7 | Very high | 57 Ų | 57 | 104.5 Ų | 104.5 | 47% | 0.471 | 49% | 0.49 | S | S | . | . | H | α-helix | trans | -56.3 | -45.8 | 177.6 | 0 | 0 | 0 | 0 | 0 | 112.1 | K158 R159 K164 V165 V166 | K158-A162 PolarHBondContact O-N 3.3Å; R159-A162 PolarHBondContact O-N 3.43Å; A162-K164 VanDerWaalsContact C-N 3.27Å; A162-K164 PolarHBondContact O-N 3Å; A162-V165 PolarHBondContact O-N 2.98Å; A162-V166 WeakPolarHBondContact O-CG2 3.45Å; A162-V166 PolarHBondContact O-N 3.33Å |
| 163 | R | 98.7 | Very high | 98.7 | Very high | 136 Ų | 136 | 107.7 Ų | 107.7 | 51% | 0.513 | 50% | 0.496 | S | S | . | . | H | α-helix | trans | -60.8 | -34.4 | 174.6 | -73.8 | -173.3 | -66.7 | -93.8 | -0.1 | 113.1 | R159 G160 V161 R167 | R159-R163 WeakPolarHBondContact O-CG 3.47Å; R159-R163 PolarHBondContact O-N 3.32Å; G160-R163 PolarHBondContact O-N 2.96Å; V161-R163 VanDerWaalsContact C-N 3.33Å; V161-R163 PolarHBondContact O-N 3.18Å; R163-R167 WeakPolarHBondContact O-CG 3.34Å; R163-R167 PolarHBondContact O-N 2.59Å |
| 164 | K | 98.7 | Very high | 98.7 | Very high | 133 Ų | 133 | 104.9 Ų | 104.9 | 58% | 0.578 | 48% | 0.484 | S | S | * | . | H | α-helix | trans | -67.1 | -45.4 | 176.2 | -170.2 | 175.6 | -178.9 | -179.8 | 0 | 110.7 | G160 V161 A162 V166 R167 M168 | G160-K164 PolarHBondContact O-N 2.95Å; V161-K164 WeakPolarHBondContact O-CA 3.27Å; V161-K164 WeakPolarHBondContact O-CB 3.35Å; V161-K164 PolarHBondContact O-N 3.5Å; A162-K164 VanDerWaalsContact C-N 3.27Å; A162-K164 PolarHBondContact O-N 3Å; K164-V166 PolarHBondContact O-N 2.97Å; K164-R167 PolarHBondContact O-N 3.48Å; K164-M168 WeakPolarHBondContact O-CG 3.4Å; K164-M168 PolarHBondContact O-N 2.9Å |
| 165 | V | 98.8 | Very high | 98.7 | Very high | 80 Ų | 80 | 106 Ų | 106 | 49% | 0.485 | 49% | 0.489 | S | S | . | . | H | α-helix | trans | -59.8 | -47.6 | 177.3 | 176 | 0 | 0 | 0 | 0 | 111 | V161 A162 R167 M168 V169 | V161-V165 WeakPolarHBondContact O-CG2 3.42Å; V161-V165 PolarHBondContact O-N 3.22Å; A162-V165 PolarHBondContact O-N 2.98Å; V165-R167 PolarHBondContact O-N 3.14Å; V165-M168 WeakPolarHBondContact O-CB 3.18Å; V165-M168 PolarHBondContact O-N 3.03Å; V165-M168 VanDerWaalsContact O-N 3.09Å; V165-V169 WeakPolarHBondContact O-CG2 3.32Å; V165-V169 PolarHBondContact O-N 3.48Å |
| 166 | V | 98.8 | Very high | 98.6 | Very high | 85 Ų | 85 | 102.8 Ų | 102.8 | 52% | 0.515 | 48% | 0.48 | S | S | . | . | H | α-helix | trans | -55.9 | -48.7 | 177 | 171.4 | 0 | 0 | 0 | 0 | 111.5 | A162 K164 M168 V169 I170 | A162-V166 WeakPolarHBondContact O-CG2 3.45Å; A162-V166 PolarHBondContact O-N 3.33Å; K164-V166 PolarHBondContact O-N 2.97Å; V166-M168 VanDerWaalsContact C-N 3.3Å; V166-M168 PolarHBondContact O-N 3.34Å; V166-V169 PolarHBondContact O-N 2.98Å; V166-I170 HydrophobicContact CG1-CD1 3.78Å; V166-I170 HydrophobicContact CG1-CG1 4.48Å; V166-I170 WeakPolarHBondContact O-CG1 3.4Å; V166-I170 PolarHBondContact O-N 3.24Å |
| 167 | R | 98.7 | Very high | 98.6 | Very high | 174 Ų | 174 | 100.6 Ų | 100.6 | 66% | 0.657 | 47% | 0.472 | S | S | * | . | H | α-helix | trans | -62 | -37.1 | 177.5 | -74.6 | -171.8 | -68.8 | 176 | -0.6 | 112.7 | R163 K164 V165 R171 | R163-R167 WeakPolarHBondContact O-CG 3.34Å; R163-R167 PolarHBondContact O-N 2.59Å; K164-R167 PolarHBondContact O-N 3.48Å; V165-R167 PolarHBondContact O-N 3.14Å; R167-R171 VanDerWaalsContact O-CB 3.27Å; R167-R171 WeakPolarHBondContact O-CB 3.5Å; R167-R171 PolarHBondContact O-N 2.73Å |
| 168 | M | 98.8 | Very high | 98.6 | Very high | 99 Ų | 99 | 98.4 Ų | 98.4 | 49% | 0.488 | 47% | 0.467 | S | S | . | . | H | α-helix | trans | -64 | -42.8 | 176 | -74.8 | -179.2 | 69.6 | 0 | 0 | 112.1 | K164 V165 V166 R171 H172 | K164-M168 WeakPolarHBondContact O-CG 3.4Å; K164-M168 PolarHBondContact O-N 2.9Å; V165-M168 WeakPolarHBondContact O-CB 3.18Å; V165-M168 PolarHBondContact O-N 3.03Å; V165-M168 VanDerWaalsContact O-N 3.09Å; V166-M168 VanDerWaalsContact C-N 3.3Å; V166-M168 PolarHBondContact O-N 3.34Å; M168-R171 PolarHBondContact O-N 3.49Å; M168-H172 VanDerWaalsContact O-CB 3.3Å; M168-H172 WeakPolarHBondContact O-CB 3.37Å; M168-H172 PolarHBondContact O-N 2.86Å |
| 169 | V | 98.8 | Very high | 98.5 | Very high | 75 Ų | 75 | 100 Ų | 100 | 46% | 0.455 | 47% | 0.474 | S | S | . | . | H | α-helix | trans | -65.2 | -45.5 | 178 | 174.9 | 0 | 0 | 0 | 0 | 111 | V165 V166 R171 H172 H173 | V165-V169 WeakPolarHBondContact O-CG2 3.32Å; V165-V169 PolarHBondContact O-N 3.48Å; V166-V169 PolarHBondContact O-N 2.98Å; V169-R171 PolarHBondContact O-N 3.29Å; V169-H172 PolarHBondContact O-N 3.31Å; V169-H173 PolarHBondContact O-N 3.4Å; V169-H173 VanDerWaalsContact O-N 3.1Å |
| 170 | I | 98.6 | Very high | 98.4 | Very high | 109 Ų | 109 | 99.3 Ų | 99.3 | 56% | 0.559 | 48% | 0.477 | S | S | * | . | H | α-helix | trans | -58.5 | -50.9 | 176.7 | -67.5 | 168 | 0 | 0 | 0 | 110.3 | V166 H172 H173 E174 | V166-I170 HydrophobicContact CG1-CD1 3.78Å; V166-I170 HydrophobicContact CG1-CG1 4.48Å; V166-I170 WeakPolarHBondContact O-CG1 3.4Å; V166-I170 PolarHBondContact O-N 3.24Å; I170-H172 VanDerWaalsContact C-N 3.32Å; I170-H172 PolarHBondContact O-N 3.1Å; I170-H173 PolarHBondContact O-N 3.27Å; I170-E174 PolarHBondContact O-N 3.44Å |
| 171 | R | 98.5 | Very high | 98.4 | Very high | 118 Ų | 118 | 103 Ų | 103 | 45% | 0.445 | 49% | 0.487 | S | S | . | . | H | α-helix | trans | -59.2 | -43.2 | 178.4 | -177 | -167.1 | 62.1 | 87.1 | 14 | 111.5 | R167 M168 V169 H173 E174 E175 | R167-R171 VanDerWaalsContact O-CB 3.27Å; R167-R171 WeakPolarHBondContact O-CB 3.5Å; R167-R171 PolarHBondContact O-N 2.73Å; M168-R171 PolarHBondContact O-N 3.49Å; V169-R171 PolarHBondContact O-N 3.29Å; R171-H173 PolarHBondContact O-N 3.38Å; R171-E174 PolarHBondContact O-N 2.88Å; R171-E175 VanDerWaalsContact CD-OE1 3.3Å; R171-E175 WeakPolarHBondContact CD-OE1 3.46Å; R171-E175 HydrophobicContact CG-CG 4.27Å; R171-E175 VanDerWaalsContact CG-OE1 3.23Å; R171-E175 WeakPolarHBondContact CG-OE1 3.23Å; R171-E175 IonicContact CZ-OE1 3.77Å; R171-E175 IonicContact CZ-OE2 2.7Å; R171-E175 IonicContact NE-OE1 2.72Å; R171-E175 IonicContact NH1-OE1 3.61Å; R171-E175 PolarHBondContact NH1-OE1 3.29Å; R171-E175 IonicContact NH1-OE2 2.61Å; R171-E175 PolarHBondContact NH1-OE2 3.43Å; R171-E175 IonicContact NH2-OE2 3.48Å; R171-E175 WeakPolarHBondContact O-CB 3.3Å; R171-E175 WeakPolarHBondContact O-CG 3.44Å; R171-E175 PolarHBondContact O-N 2.7Å |
| 172 | H | 98.5 | Very high | 98.3 | Very high | 89 Ų | 89 | 105.8 Ų | 105.8 | 41% | 0.412 | 49% | 0.489 | S | S | . | . | H | α-helix | trans | -58.2 | -48.1 | 179 | 174.9 | -108.3 | 0 | 0 | 0 | 111.5 | M168 V169 I170 E174 E175 Q176 | M168-H172 VanDerWaalsContact O-CB 3.3Å; M168-H172 WeakPolarHBondContact O-CB 3.37Å; M168-H172 PolarHBondContact O-N 2.86Å; V169-H172 PolarHBondContact O-N 3.31Å; I170-H172 VanDerWaalsContact C-N 3.32Å; I170-H172 PolarHBondContact O-N 3.1Å; H172-E174 VanDerWaalsContact C-N 3.35Å; H172-E174 PolarHBondContact O-N 3.45Å; H172-E175 PolarHBondContact O-N 2.61Å; H172-Q176 WeakPolarHBondContact O-CB 3.3Å; H172-Q176 WeakPolarHBondContact O-CG 3.49Å; H172-Q176 PolarHBondContact O-N 3.16Å |
| 173 | H | 98.7 | Very high | 98.3 | Very high | 111 Ų | 111 | 105.5 Ų | 105.5 | 51% | 0.514 | 49% | 0.487 | S | S | . | . | H | α-helix | trans | -68.5 | -34.5 | 179.2 | -69.9 | 174.1 | 0 | 0 | 0 | 113.2 | V169 I170 R171 R177 | V169-H173 PolarHBondContact O-N 3.4Å; V169-H173 VanDerWaalsContact O-N 3.1Å; I170-H173 PolarHBondContact O-N 3.27Å; R171-H173 PolarHBondContact O-N 3.38Å; H173-R177 PolarHBondContact O-N 3.01Å |
| 174 | E | 98.3 | Very high | 98.3 | Very high | 69 Ų | 69 | 107.1 Ų | 107.1 | 32% | 0.322 | 49% | 0.493 | S | S | . | . | H | α-helix | trans | -65 | -45.7 | 174.2 | -174.2 | 55.1 | -142.8 | 0 | 0 | 111.5 | I170 R171 H172 Q176 R177 Q178 | I170-E174 PolarHBondContact O-N 3.44Å; R171-E174 PolarHBondContact O-N 2.88Å; H172-E174 VanDerWaalsContact C-N 3.35Å; H172-E174 PolarHBondContact O-N 3.45Å; E174-Q176 VanDerWaalsContact C-N 3.34Å; E174-Q176 PolarHBondContact O-N 3.49Å; E174-R177 PolarHBondContact O-N 3.39Å; E174-R177 IonicContact OE1-NH1 3.85Å; E174-R177 IonicContact OE2-CZ 2.81Å; E174-R177 IonicContact OE2-NH1 2.95Å; E174-R177 PolarHBondContact OE2-NH1 3.38Å; E174-R177 IonicContact OE2-NH2 3.83Å; E174-Q178 WeakPolarHBondContact O-CG 3.39Å; E174-Q178 PolarHBondContact O-N 3.48Å; E174-Q178 PolarHBondContact OE1-NE2 2.99Å |
| 175 | E | 98.1 | Very high | 98.2 | Very high | 80 Ų | 80 | 107.6 Ų | 107.6 | 37% | 0.374 | 49% | 0.491 | S | S | . | . | H | α-helix | trans | -62.1 | -40.8 | 176.2 | -76 | 172 | -178 | 0 | 0 | 112.3 | R171 H172 Q178 K179 | R171-E175 VanDerWaalsContact CD-OE1 3.3Å; R171-E175 WeakPolarHBondContact CD-OE1 3.46Å; R171-E175 HydrophobicContact CG-CG 4.27Å; R171-E175 VanDerWaalsContact CG-OE1 3.23Å; R171-E175 WeakPolarHBondContact CG-OE1 3.23Å; R171-E175 IonicContact CZ-OE1 3.77Å; R171-E175 IonicContact CZ-OE2 2.7Å; R171-E175 IonicContact NE-OE1 2.72Å; R171-E175 IonicContact NH1-OE1 3.61Å; R171-E175 PolarHBondContact NH1-OE1 3.29Å; R171-E175 IonicContact NH1-OE2 2.61Å; R171-E175 PolarHBondContact NH1-OE2 3.43Å; R171-E175 IonicContact NH2-OE2 3.48Å; R171-E175 WeakPolarHBondContact O-CB 3.3Å; R171-E175 WeakPolarHBondContact O-CG 3.44Å; R171-E175 PolarHBondContact O-N 2.7Å; H172-E175 PolarHBondContact O-N 2.61Å; E175-Q178 PolarHBondContact O-N 3.43Å; E175-K179 VanDerWaalsContact O-CB 3.24Å; E175-K179 WeakPolarHBondContact O-CB 3.31Å; E175-K179 PolarHBondContact O-N 2.97Å |
| 176 | Q | 98.2 | Very high | 98.2 | Very high | 76 Ų | 76 | 109.4 Ų | 109.4 | 36% | 0.355 | 49% | 0.494 | S | S | . | . | H | α-helix | trans | -61.5 | -47.6 | 176 | -72.7 | -64.1 | 100.9 | 0 | 0 | 111.1 | H172 E174 Q178 K179 E180 | H172-Q176 WeakPolarHBondContact O-CB 3.3Å; H172-Q176 WeakPolarHBondContact O-CG 3.49Å; H172-Q176 PolarHBondContact O-N 3.16Å; E174-Q176 VanDerWaalsContact C-N 3.34Å; E174-Q176 PolarHBondContact O-N 3.49Å; Q176-Q178 PolarHBondContact O-N 3.42Å; Q176-K179 PolarHBondContact O-N 3.05Å; Q176-E180 WeakPolarHBondContact O-CG 3.24Å; Q176-E180 PolarHBondContact O-N 2.72Å |
| 177 | R | 97.8 | Very high | 98.2 | Very high | 140 Ų | 140 | 111.2 Ų | 111.2 | 53% | 0.528 | 50% | 0.497 | S | S | . | . | H | α-helix | trans | -60 | -45.3 | 177.2 | -163.8 | -168.2 | -52.7 | 133.4 | 10.3 | 111.9 | H173 E174 K179 E180 E181 | H173-R177 PolarHBondContact O-N 3.01Å; E174-R177 PolarHBondContact O-N 3.39Å; E174-R177 IonicContact OE1-NH1 3.85Å; E174-R177 IonicContact OE2-CZ 2.81Å; E174-R177 IonicContact OE2-NH1 2.95Å; E174-R177 PolarHBondContact OE2-NH1 3.38Å; E174-R177 IonicContact OE2-NH2 3.83Å; R177-K179 VanDerWaalsContact C-N 3.34Å; R177-K179 PolarHBondContact O-N 2.95Å; R177-E180 PolarHBondContact O-N 3.46Å; R177-E181 WeakPolarHBondContact O-CB 3.46Å; R177-E181 PolarHBondContact O-N 3.23Å |
| 178 | Q | 98 | Very high | 98.1 | Very high | 90 Ų | 90 | 106.8 Ų | 106.8 | 42% | 0.421 | 48% | 0.484 | S | S | . | . | H | α-helix | trans | -65.1 | -38.1 | 178.2 | -71.9 | 178.9 | 23.7 | 0 | 0 | 112.4 | E174 E175 Q176 E181 R182 | E174-Q178 WeakPolarHBondContact O-CG 3.39Å; E174-Q178 PolarHBondContact O-N 3.48Å; E174-Q178 PolarHBondContact OE1-NE2 2.99Å; E175-Q178 PolarHBondContact O-N 3.43Å; Q176-Q178 PolarHBondContact O-N 3.42Å; Q178-E181 PolarHBondContact O-N 2.87Å; Q178-R182 VanDerWaalsContact O-CB 3.31Å; Q178-R182 WeakPolarHBondContact O-CB 3.21Å; Q178-R182 PolarHBondContact O-N 3.09Å |
| 179 | K | 97.6 | Very high | 98.1 | Very high | 133 Ų | 133 | 103.6 Ų | 103.6 | 58% | 0.578 | 47% | 0.473 | S | S | * | . | H | α-helix | trans | -65.2 | -43.5 | 177 | -175.3 | 178.5 | 178.6 | -177.8 | 0 | 111.2 | E175 Q176 R177 R182 A183 | E175-K179 VanDerWaalsContact O-CB 3.24Å; E175-K179 WeakPolarHBondContact O-CB 3.31Å; E175-K179 PolarHBondContact O-N 2.97Å; Q176-K179 PolarHBondContact O-N 3.05Å; R177-K179 VanDerWaalsContact C-N 3.34Å; R177-K179 PolarHBondContact O-N 2.95Å; K179-R182 PolarHBondContact O-N 2.93Å; K179-A183 WeakPolarHBondContact O-CB 3.5Å; K179-A183 PolarHBondContact O-N 3.31Å |
| 180 | E | 97.5 | Very high | 98.1 | Very high | 127 Ų | 127 | 106.3 Ų | 106.3 | 59% | 0.593 | 48% | 0.479 | S | S | * | . | H | α-helix | trans | -62.9 | -44.9 | 175.1 | -72.4 | 170.5 | -167.2 | 0 | 0 | 111.8 | Q176 R177 R182 A183 R184 | Q176-E180 WeakPolarHBondContact O-CG 3.24Å; Q176-E180 PolarHBondContact O-N 2.72Å; R177-E180 PolarHBondContact O-N 3.46Å; E180-R182 VanDerWaalsContact C-N 3.34Å; E180-R182 PolarHBondContact O-N 3.29Å; E180-A183 PolarHBondContact O-N 3.41Å; E180-R184 WeakPolarHBondContact O-CB 3.33Å; E180-R184 PolarHBondContact O-N 2.9Å |
| 181 | E | 97.6 | Very high | 98.1 | Very high | 104 Ų | 104 | 106.2 Ų | 106.2 | 49% | 0.486 | 48% | 0.478 | S | S | . | . | H | α-helix | trans | -62.9 | -41.9 | 177 | -164.7 | -162.3 | 137.8 | 0 | 0 | 111.7 | R177 Q178 R184 R185 | R177-E181 WeakPolarHBondContact O-CB 3.46Å; R177-E181 PolarHBondContact O-N 3.23Å; Q178-E181 PolarHBondContact O-N 2.87Å; E181-R184 PolarHBondContact O-N 2.95Å; E181-R185 PolarHBondContact O-N 2.94Å; E181-R185 IonicContact OE1-CZ 3.59Å; E181-R185 IonicContact OE1-NH1 3.65Å; E181-R185 IonicContact OE1-NH2 2.88Å; E181-R185 PolarHBondContact OE1-NH2 3.3Å |
| 182 | R | 97.9 | Very high | 98.1 | Very high | 136 Ų | 136 | 108.5 Ų | 108.5 | 51% | 0.513 | 49% | 0.487 | S | S | . | . | H | α-helix | trans | -62.9 | -46.3 | 175.4 | -171.9 | -177.6 | -63.3 | 133.3 | 3.8 | 111.2 | Q178 K179 E180 R184 R185 E186 | Q178-R182 VanDerWaalsContact O-CB 3.31Å; Q178-R182 WeakPolarHBondContact O-CB 3.21Å; Q178-R182 PolarHBondContact O-N 3.09Å; K179-R182 PolarHBondContact O-N 2.93Å; E180-R182 VanDerWaalsContact C-N 3.34Å; E180-R182 PolarHBondContact O-N 3.29Å; R182-R184 VanDerWaalsContact C-N 3.31Å; R182-R184 PolarHBondContact O-N 3.46Å; R182-R185 PolarHBondContact O-N 3.39Å; R182-R185 VanDerWaalsContact O-N 3.15Å; R182-E186 HydrophobicContact CG-CG 4.47Å; R182-E186 WeakPolarHBondContact CG-OE1 3.35Å; R182-E186 WeakPolarHBondContact O-CG 3.32Å; R182-E186 PolarHBondContact O-N 3.45Å |
| 183 | A | 98.1 | Very high | 98.1 | Very high | 52 Ų | 52 | 111.8 Ų | 111.8 | 43% | 0.43 | 50% | 0.496 | S | S | . | . | H | α-helix | trans | -58.4 | -43.8 | 177 | 0 | 0 | 0 | 0 | 0 | 111.5 | K179 E180 R185 E186 E187 | K179-A183 WeakPolarHBondContact O-CB 3.5Å; K179-A183 PolarHBondContact O-N 3.31Å; E180-A183 PolarHBondContact O-N 3.41Å; A183-R185 VanDerWaalsContact C-N 3.35Å; A183-R185 PolarHBondContact O-N 2.93Å; A183-E186 PolarHBondContact O-N 3.29Å; A183-E187 WeakPolarHBondContact O-CB 3.36Å; A183-E187 PolarHBondContact O-N 3.38Å |
| 184 | R | 97.7 | Very high | 98.1 | Very high | 170 Ų | 170 | 110.5 Ų | 110.5 | 64% | 0.642 | 49% | 0.492 | S | S | * | . | H | α-helix | trans | -61.4 | -41.5 | 176.1 | -171.6 | 178.3 | -175.2 | 174.2 | 0.3 | 112.3 | E180 E181 R182 Q188 | E180-R184 WeakPolarHBondContact O-CB 3.33Å; E180-R184 PolarHBondContact O-N 2.9Å; E181-R184 PolarHBondContact O-N 2.95Å; R182-R184 VanDerWaalsContact C-N 3.31Å; R182-R184 PolarHBondContact O-N 3.46Å; R184-Q188 WeakPolarHBondContact O-CG 3.47Å; R184-Q188 PolarHBondContact O-N 2.99Å; R184-Q188 VanDerWaalsContact O-N 3.09Å |
| 185 | R | 97.8 | Very high | 98.1 | Very high | 142 Ų | 142 | 110 Ų | 110 | 54% | 0.536 | 50% | 0.5 | S | S | . | . | H | α-helix | trans | -66.7 | -42.1 | 177.4 | -172 | -175.8 | -71.9 | 100.4 | -1.5 | 111.4 | E181 R182 A183 Q188 A189 | E181-R185 PolarHBondContact O-N 2.94Å; E181-R185 IonicContact OE1-CZ 3.59Å; E181-R185 IonicContact OE1-NH1 3.65Å; E181-R185 IonicContact OE1-NH2 2.88Å; E181-R185 PolarHBondContact OE1-NH2 3.3Å; R182-R185 PolarHBondContact O-N 3.39Å; R182-R185 VanDerWaalsContact O-N 3.15Å; A183-R185 VanDerWaalsContact C-N 3.35Å; A183-R185 PolarHBondContact O-N 2.93Å; R185-Q188 PolarHBondContact O-N 3.42Å; R185-A189 WeakPolarHBondContact O-CB 3.48Å; R185-A189 PolarHBondContact O-N 2.89Å |
| 186 | E | 98.1 | Very high | 98.1 | Very high | 118 Ų | 118 | 109.1 Ų | 109.1 | 55% | 0.551 | 50% | 0.503 | S | S | * | . | H | α-helix | trans | -64.2 | -41.7 | 177.8 | -74.8 | 173.6 | -171.4 | 0 | 0 | 112.1 | R182 A183 A189 K190 | R182-E186 HydrophobicContact CG-CG 4.47Å; R182-E186 WeakPolarHBondContact CG-OE1 3.35Å; R182-E186 WeakPolarHBondContact O-CG 3.32Å; R182-E186 PolarHBondContact O-N 3.45Å; A183-E186 PolarHBondContact O-N 3.29Å; E186-A189 PolarHBondContact O-N 3.43Å; E186-K190 WeakPolarHBondContact O-CB 3.37Å; E186-K190 PolarHBondContact O-N 2.88Å |
| 187 | E | 98.1 | Very high | 98.2 | Very high | 124 Ų | 124 | 109 Ų | 109 | 58% | 0.579 | 51% | 0.507 | S | S | * | . | H | α-helix | trans | -61.4 | -48.4 | 174.5 | -175.1 | 179.1 | -167.6 | 0 | 0 | 111.4 | A183 A189 K190 L191 | A183-E187 WeakPolarHBondContact O-CB 3.36Å; A183-E187 PolarHBondContact O-N 3.38Å; E187-A189 VanDerWaalsContact C-N 3.31Å; E187-A189 PolarHBondContact O-N 3.15Å; E187-K190 WeakPolarHBondContact O-CB 3.37Å; E187-K190 PolarHBondContact O-N 3.35Å; E187-K190 VanDerWaalsContact O-N 3.12Å; E187-L191 PolarHBondContact O-N 3.14Å |
| 188 | Q | 98.2 | Very high | 98.2 | Very high | 81 Ų | 81 | 108 Ų | 108 | 38% | 0.379 | 51% | 0.51 | S | S | . | . | H | α-helix | trans | -60 | -42.2 | 174.9 | -72.2 | 179.5 | 25.9 | 0 | 0 | 111.9 | R184 R185 K190 L191 R192 | R184-Q188 WeakPolarHBondContact O-CG 3.47Å; R184-Q188 PolarHBondContact O-N 2.99Å; R184-Q188 VanDerWaalsContact O-N 3.09Å; R185-Q188 PolarHBondContact O-N 3.42Å; Q188-K190 VanDerWaalsContact C-N 3.3Å; Q188-K190 PolarHBondContact O-N 2.93Å; Q188-L191 PolarHBondContact O-N 2.85Å; Q188-R192 WeakPolarHBondContact O-CG 3.37Å; Q188-R192 PolarHBondContact O-N 3.29Å |
| 189 | A | 98.4 | Very high | 98.2 | Very high | 31 Ų | 31 | 105.6 Ų | 105.6 | 26% | 0.256 | 51% | 0.505 | S | S | . | . | H | α-helix | trans | -62.3 | -39.1 | 176.2 | 0 | 0 | 0 | 0 | 0 | 111.4 | R185 E186 E187 R192 R193 | R185-A189 WeakPolarHBondContact O-CB 3.48Å; R185-A189 PolarHBondContact O-N 2.89Å; E186-A189 PolarHBondContact O-N 3.43Å; E187-A189 VanDerWaalsContact C-N 3.31Å; E187-A189 PolarHBondContact O-N 3.15Å; A189-R192 PolarHBondContact O-N 3.4Å; A189-R193 WeakPolarHBondContact O-CG 3.39Å; A189-R193 PolarHBondContact O-N 2.89Å |
| 190 | K | 98.5 | Very high | 98.3 | Very high | 133 Ų | 133 | 105.5 Ų | 105.5 | 58% | 0.578 | 51% | 0.505 | S | S | * | . | H | α-helix | trans | -60.7 | -48.3 | 174.1 | -175.7 | -177.2 | 177.6 | -176.1 | 0 | 111.2 | E186 E187 Q188 R192 R193 I194 | E186-K190 WeakPolarHBondContact O-CB 3.37Å; E186-K190 PolarHBondContact O-N 2.88Å; E187-K190 WeakPolarHBondContact O-CB 3.37Å; E187-K190 PolarHBondContact O-N 3.35Å; E187-K190 VanDerWaalsContact O-N 3.12Å; Q188-K190 VanDerWaalsContact C-N 3.3Å; Q188-K190 PolarHBondContact O-N 2.93Å; K190-R192 VanDerWaalsContact C-N 3.35Å; K190-R192 PolarHBondContact O-N 3.39Å; K190-R193 WeakPolarHBondContact O-CB 3.41Å; K190-R193 PolarHBondContact O-N 2.94Å; K190-I194 HydrophobicContact CG-CD1 4.24Å; K190-I194 WeakPolarHBondContact O-CG1 3.44Å; K190-I194 PolarHBondContact O-N 3.13Å |
| 191 | L | 98.5 | Very high | 98.3 | Very high | 106 Ų | 106 | 104.2 Ų | 104.2 | 56% | 0.555 | 50% | 0.502 | S | S | * | . | H | α-helix | trans | -60.6 | -43.1 | 177.1 | -67.2 | 175.5 | 0 | 0 | 0 | 111.9 | E187 Q188 R193 I194 A195 | E187-L191 PolarHBondContact O-N 3.14Å; Q188-L191 PolarHBondContact O-N 2.85Å; L191-R193 VanDerWaalsContact C-N 3.31Å; L191-R193 PolarHBondContact O-N 3.5Å; L191-I194 PolarHBondContact O-N 2.73Å; L191-A195 PolarHBondContact O-N 3.2Å |
| 192 | R | 98.6 | Very high | 98.3 | Very high | 166 Ų | 166 | 103.1 Ų | 103.1 | 63% | 0.626 | 50% | 0.502 | S | S | * | . | H | α-helix | trans | -60.6 | -39.3 | 175.6 | -71.1 | 176.6 | -159.4 | -90.8 | 1.5 | 112.3 | Q188 A189 K190 S196 | Q188-R192 WeakPolarHBondContact O-CG 3.37Å; Q188-R192 PolarHBondContact O-N 3.29Å; A189-R192 PolarHBondContact O-N 3.4Å; K190-R192 VanDerWaalsContact C-N 3.35Å; K190-R192 PolarHBondContact O-N 3.39Å; R192-S196 VanDerWaalsContact O-CB 3.32Å; R192-S196 WeakPolarHBondContact O-CB 3.45Å; R192-S196 PolarHBondContact O-N 3.43Å; R192-S196 PolarHBondContact O-OG 3.15Å |
| 193 | R | 98.6 | Very high | 98.3 | Very high | 158 Ų | 158 | 103.9 Ų | 103.9 | 60% | 0.596 | 51% | 0.505 | S | S | * | . | H | α-helix | trans | -63.8 | -47.4 | 175.4 | -71.3 | 179.3 | -159.2 | 109.4 | -3.6 | 111.2 | A189 K190 L191 A195 S196 T197 | A189-R193 WeakPolarHBondContact O-CG 3.39Å; A189-R193 PolarHBondContact O-N 2.89Å; K190-R193 WeakPolarHBondContact O-CB 3.41Å; K190-R193 PolarHBondContact O-N 2.94Å; L191-R193 VanDerWaalsContact C-N 3.31Å; L191-R193 PolarHBondContact O-N 3.5Å; R193-A195 PolarHBondContact O-N 2.95Å; R193-S196 WeakPolarHBondContact O-CB 3.32Å; R193-S196 PolarHBondContact O-N 3.5Å; R193-T197 PolarHBondContact O-N 3.26Å; R193-T197 PolarHBondContact O-OG1 2.93Å |
| 194 | I | 98.6 | Very high | 98.3 | Very high | 84 Ų | 84 | 106.1 Ų | 106.1 | 43% | 0.431 | 51% | 0.507 | S | S | . | . | H | α-helix | trans | -58.6 | -50.9 | 178.4 | -65.7 | 167 | 0 | 0 | 0 | 110.4 | K190 L191 S196 T197 M198 | K190-I194 HydrophobicContact CG-CD1 4.24Å; K190-I194 WeakPolarHBondContact O-CG1 3.44Å; K190-I194 PolarHBondContact O-N 3.13Å; L191-I194 PolarHBondContact O-N 2.73Å; I194-S196 VanDerWaalsContact C-N 3.28Å; I194-S196 PolarHBondContact O-N 2.95Å; I194-T197 WeakPolarHBondContact O-CB 3.38Å; I194-T197 PolarHBondContact O-N 3.04Å; I194-T197 VanDerWaalsContact O-N 3.13Å; I194-M198 HydrophobicContact CG2-SD 4.2Å; I194-M198 WeakPolarHBondContact O-CG 3.35Å; I194-M198 PolarHBondContact O-N 3.19Å |
| 195 | A | 98.6 | Very high | 98.3 | Very high | 59 Ų | 59 | 103.7 Ų | 103.7 | 49% | 0.488 | 50% | 0.501 | S | S | . | . | H | α-helix | trans | -58.9 | -40.3 | 177.7 | 0 | 0 | 0 | 0 | 0 | 112.1 | L191 R193 T197 M198 A199 | L191-A195 PolarHBondContact O-N 3.2Å; R193-A195 PolarHBondContact O-N 2.95Å; A195-T197 PolarHBondContact O-N 3.4Å; A195-M198 PolarHBondContact O-N 3.32Å; A195-A199 WeakPolarHBondContact O-CB 3.33Å; A195-A199 PolarHBondContact O-N 2.94Å |
| 196 | S | 98.7 | Very high | 98.4 | Very high | 62 Ų | 62 | 104.6 Ų | 104.6 | 43% | 0.434 | 50% | 0.504 | S | S | . | . | H | α-helix | trans | -64.1 | -39.5 | 176.8 | -61.1 | 0 | 0 | 0 | 0 | 112.4 | R192 R193 I194 K200 | R192-S196 VanDerWaalsContact O-CB 3.32Å; R192-S196 WeakPolarHBondContact O-CB 3.45Å; R192-S196 PolarHBondContact O-N 3.43Å; R192-S196 PolarHBondContact O-OG 3.15Å; R193-S196 WeakPolarHBondContact O-CB 3.32Å; R193-S196 PolarHBondContact O-N 3.5Å; I194-S196 VanDerWaalsContact C-N 3.28Å; I194-S196 PolarHBondContact O-N 2.95Å; S196-K200 WeakPolarHBondContact O-CG 3.43Å; S196-K200 PolarHBondContact O-N 3.12Å; S196-K200 VanDerWaalsContact O-N 3.14Å |
| 197 | T | 98.6 | Very high | 98.3 | Very high | 74 Ų | 74 | 101 Ų | 101 | 45% | 0.454 | 49% | 0.492 | S | S | . | . | H | α-helix | trans | -64.1 | -51.4 | 174.8 | -58.8 | 0 | 0 | 0 | 0 | 110.6 | R193 I194 A195 A199 K200 D201 | R193-T197 PolarHBondContact O-N 3.26Å; R193-T197 PolarHBondContact O-OG1 2.93Å; I194-T197 WeakPolarHBondContact O-CB 3.38Å; I194-T197 PolarHBondContact O-N 3.04Å; I194-T197 VanDerWaalsContact O-N 3.13Å; A195-T197 PolarHBondContact O-N 3.4Å; T197-A199 VanDerWaalsContact C-N 3.26Å; T197-A199 PolarHBondContact O-N 2.95Å; T197-K200 WeakPolarHBondContact O-CA 3.49Å; T197-K200 WeakPolarHBondContact O-CB 3.46Å; T197-K200 PolarHBondContact O-N 2.99Å; T197-D201 PolarHBondContact O-N 3.37Å |
| 198 | M | 98.5 | Very high | 98.2 | Very high | 119 Ų | 119 | 98.6 Ų | 98.6 | 59% | 0.586 | 48% | 0.484 | S | S | * | . | H | α-helix | trans | -56.7 | -41.4 | 177.7 | -66.7 | 178.6 | 71 | 0 | 0 | 112.1 | I194 A195 K200 D201 V202 | I194-M198 HydrophobicContact CG2-SD 4.2Å; I194-M198 WeakPolarHBondContact O-CG 3.35Å; I194-M198 PolarHBondContact O-N 3.19Å; A195-M198 PolarHBondContact O-N 3.32Å; M198-K200 VanDerWaalsContact C-N 3.29Å; M198-K200 PolarHBondContact O-N 3.45Å; M198-D201 PolarHBondContact O-N 3.45Å; M198-V202 WeakPolarHBondContact O-CG2 3.48Å; M198-V202 PolarHBondContact O-N 3.15Å |
| 199 | A | 98.5 | Very high | 98.1 | Very high | 38 Ų | 38 | 97.7 Ų | 97.7 | 31% | 0.314 | 48% | 0.484 | S | S | . | . | H | α-helix | trans | -64.3 | -33.2 | 176.8 | 0 | 0 | 0 | 0 | 0 | 112.8 | A195 T197 R203 | A195-A199 WeakPolarHBondContact O-CB 3.33Å; A195-A199 PolarHBondContact O-N 2.94Å; T197-A199 VanDerWaalsContact C-N 3.26Å; T197-A199 PolarHBondContact O-N 2.95Å; A199-R203 WeakPolarHBondContact O-CG 3.46Å; A199-R203 PolarHBondContact O-N 3.45Å; A199-R203 VanDerWaalsContact O-N 3.15Å; A199-R203 PolarHBondContact O-NH1 3.2Å |
| 200 | K | 98.6 | Very high | 97.9 | Very high | 131 Ų | 131 | 101.9 Ų | 101.9 | 57% | 0.57 | 50% | 0.498 | S | S | * | . | H | α-helix | trans | -67.2 | -44.3 | 172.5 | -71.3 | 172.2 | -179.2 | -178 | 0 | 110.7 | S196 T197 M198 V202 R203 Q204 | S196-K200 WeakPolarHBondContact O-CG 3.43Å; S196-K200 PolarHBondContact O-N 3.12Å; S196-K200 VanDerWaalsContact O-N 3.14Å; T197-K200 WeakPolarHBondContact O-CA 3.49Å; T197-K200 WeakPolarHBondContact O-CB 3.46Å; T197-K200 PolarHBondContact O-N 2.99Å; M198-K200 VanDerWaalsContact C-N 3.29Å; M198-K200 PolarHBondContact O-N 3.45Å; K200-V202 VanDerWaalsContact C-N 3.34Å; K200-V202 PolarHBondContact O-N 3.22Å; K200-R203 VanDerWaalsContact CG-NH2 3.27Å; K200-R203 PolarHBondContact O-N 2.97Å; K200-Q204 WeakPolarHBondContact O-CB 3.5Å; K200-Q204 PolarHBondContact O-N 2.96Å |
| 201 | D | 97.9 | Very high | 97.7 | Very high | 100 Ų | 100 | 100.8 Ų | 100.8 | 54% | 0.535 | 49% | 0.493 | S | S | . | . | H | α-helix | trans | -61.8 | -43 | -180 | -59.8 | -23.3 | 0 | 0 | 0 | 111.3 | T197 M198 Q204 F205 | T197-D201 PolarHBondContact O-N 3.37Å; M198-D201 PolarHBondContact O-N 3.45Å; D201-Q204 PolarHBondContact O-N 3.09Å; D201-F205 PolarHBondContact O-N 3.48Å |
| 202 | V | 98.5 | Very high | 97.4 | Very high | 82 Ų | 82 | 100.3 Ų | 100.3 | 50% | 0.497 | 49% | 0.494 | S | S | . | . | H | α-helix | trans | -61.6 | -45.7 | 174.6 | 172.6 | 0 | 0 | 0 | 0 | 111.6 | M198 K200 Q204 F205 W206 | M198-V202 WeakPolarHBondContact O-CG2 3.48Å; M198-V202 PolarHBondContact O-N 3.15Å; K200-V202 VanDerWaalsContact C-N 3.34Å; K200-V202 PolarHBondContact O-N 3.22Å; V202-Q204 VanDerWaalsContact C-N 3.3Å; V202-Q204 PolarHBondContact O-N 3.43Å; V202-F205 PolarHBondContact O-N 3.14Å; V202-W206 PolarHBondContact O-N 3.34Å; V202-W206 VanDerWaalsContact O-N 3.14Å |
| 203 | R | 97.6 | Very high | 96.9 | Very high | 151 Ų | 151 | 97.8 Ų | 97.8 | 57% | 0.57 | 49% | 0.493 | S | S | * | . | H | α-helix | trans | -61.4 | -40.5 | 176 | -76.9 | -171.7 | -64 | -86.6 | -0.8 | 111.8 | A199 K200 W206 S207 | A199-R203 WeakPolarHBondContact O-CG 3.46Å; A199-R203 PolarHBondContact O-N 3.45Å; A199-R203 VanDerWaalsContact O-N 3.15Å; A199-R203 PolarHBondContact O-NH1 3.2Å; K200-R203 VanDerWaalsContact CG-NH2 3.27Å; K200-R203 PolarHBondContact O-N 2.97Å; R203-W206 PolarHBondContact O-N 3.24Å; R203-S207 WeakPolarHBondContact O-CB 3.39Å; R203-S207 PolarHBondContact O-N 3.47Å |
| 204 | Q | 98.1 | Very high | 96.4 | Very high | 99 Ų | 99 | 96.2 Ų | 96.2 | 46% | 0.463 | 49% | 0.492 | S | S | . | . | H | α-helix | trans | -65.8 | -41.9 | 178.4 | -172 | 60.9 | 46.5 | 0 | 0 | 111.7 | K200 D201 V202 S207 N208 | K200-Q204 WeakPolarHBondContact O-CB 3.5Å; K200-Q204 PolarHBondContact O-N 2.96Å; D201-Q204 PolarHBondContact O-N 3.09Å; V202-Q204 VanDerWaalsContact C-N 3.3Å; V202-Q204 PolarHBondContact O-N 3.43Å; Q204-S207 PolarHBondContact O-N 2.91Å; Q204-N208 PolarHBondContact NE2-OD1 2.95Å; Q204-N208 PolarHBondContact O-N 2.9Å; Q204-N208 PolarHBondContact O-OD1 3.4Å |
| 205 | F | 98.2 | Very high | 95.7 | Very high | 119 Ų | 119 | 97.6 Ų | 97.6 | 52% | 0.522 | 50% | 0.497 | S | S | . | . | H | α-helix | trans | -55.8 | -52.6 | 174.9 | 172.1 | -97.2 | 0 | 0 | 0 | 111.2 | D201 V202 S207 N208 V209 | D201-F205 PolarHBondContact O-N 3.48Å; V202-F205 PolarHBondContact O-N 3.14Å; F205-S207 PolarHBondContact O-N 3.35Å; F205-N208 WeakPolarHBondContact O-CB 3.29Å; F205-N208 PolarHBondContact O-N 3.26Å; F205-N208 VanDerWaalsContact O-N 3.13Å; F205-V209 HydrophobicContact CD1-CG2 4.35Å; F205-V209 HydrophobicContact CE1-CG2 3.9Å; F205-V209 HydrophobicContact CE2-CG2 4.18Å; F205-V209 HydrophobicContact CZ-CG2 3.81Å; F205-V209 WeakPolarHBondContact O-CG2 3.48Å; F205-V209 PolarHBondContact O-N 2.87Å |
| 206 | W | 98.1 | Very high | 94.9 | Very high | 161 Ų | 161 | 97 Ų | 97 | 61% | 0.61 | 49% | 0.492 | S | S | * | . | H | α-helix | trans | -64.6 | -39 | 179.9 | -72.8 | 115.9 | 0 | 0 | 0 | 113 | V202 R203 N208 V209 E210 | V202-W206 PolarHBondContact O-N 3.34Å; V202-W206 VanDerWaalsContact O-N 3.14Å; R203-W206 PolarHBondContact O-N 3.24Å; W206-N208 VanDerWaalsContact C-N 3.28Å; W206-N208 PolarHBondContact O-N 2.89Å; W206-V209 HydrophobicContact CE3-CB 4.4Å; W206-V209 HydrophobicContact CE3-CG1 4.45Å; W206-V209 PolarHBondContact O-N 3Å; W206-E210 WeakPolarHBondContact O-CB 3.5Å; W206-E210 PolarHBondContact O-N 3.46Å |
| 207 | S | 97.5 | Very high | 93.9 | Very high | 42 Ų | 42 | 96.9 Ų | 96.9 | 29% | 0.294 | 50% | 0.501 | S | S | . | . | H | α-helix | trans | -60.6 | -37.8 | 173.3 | -176.9 | 0 | 0 | 0 | 0 | 112.2 | R203 Q204 F205 K211 | R203-S207 WeakPolarHBondContact O-CB 3.39Å; R203-S207 PolarHBondContact O-N 3.47Å; Q204-S207 PolarHBondContact O-N 2.91Å; F205-S207 PolarHBondContact O-N 3.35Å; S207-K211 VanDerWaalsContact O-CG 3.29Å; S207-K211 WeakPolarHBondContact O-CG 3.44Å; S207-K211 PolarHBondContact O-N 2.89Å; S207-K211 VanDerWaalsContact O-N 3.09Å |
| 208 | N | 96.4 | Very high | 92.7 | Very high | 75 Ų | 75 | 102.2 Ų | 102.2 | 40% | 0.401 | 52% | 0.518 | S | S | . | . | H | α-helix | trans | -69.2 | -41.6 | 176.1 | -68.6 | -8.3 | 0 | 0 | 0 | 111.7 | Q204 F205 W206 E210 K211 V212 | Q204-N208 PolarHBondContact NE2-OD1 2.95Å; Q204-N208 PolarHBondContact O-N 2.9Å; Q204-N208 PolarHBondContact O-OD1 3.4Å; F205-N208 WeakPolarHBondContact O-CB 3.29Å; F205-N208 PolarHBondContact O-N 3.26Å; F205-N208 VanDerWaalsContact O-N 3.13Å; W206-N208 VanDerWaalsContact C-N 3.28Å; W206-N208 PolarHBondContact O-N 2.89Å; N208-E210 VanDerWaalsContact C-N 3.33Å; N208-E210 PolarHBondContact O-N 2.93Å; N208-K211 PolarHBondContact O-N 3.38Å; N208-V212 WeakPolarHBondContact O-CG2 3.46Å; N208-V212 PolarHBondContact O-N 3.13Å |
| 209 | V | 95.8 | Very high | 91.1 | Very high | 62 Ų | 62 | 104 Ų | 104 | 38% | 0.376 | 52% | 0.522 | S | S | . | . | H | α-helix | trans | -59.2 | -45.4 | 174.8 | 171.6 | 0 | 0 | 0 | 0 | 110.9 | F205 W206 K211 V212 N213 | F205-V209 HydrophobicContact CD1-CG2 4.35Å; F205-V209 HydrophobicContact CE1-CG2 3.9Å; F205-V209 HydrophobicContact CE2-CG2 4.18Å; F205-V209 HydrophobicContact CZ-CG2 3.81Å; F205-V209 WeakPolarHBondContact O-CG2 3.48Å; F205-V209 PolarHBondContact O-N 2.87Å; W206-V209 HydrophobicContact CE3-CB 4.4Å; W206-V209 HydrophobicContact CE3-CG1 4.45Å; W206-V209 PolarHBondContact O-N 3Å; V209-K211 VanDerWaalsContact C-N 3.35Å; V209-K211 PolarHBondContact O-N 3.31Å; V209-V212 PolarHBondContact O-N 2.93Å; V209-N213 WeakPolarHBondContact O-CB 3.41Å; V209-N213 PolarHBondContact O-N 3.48Å |
| 210 | E | 94.3 | Very high | 89.2 | Confident | 119 Ų | 119 | 104.8 Ų | 104.8 | 56% | 0.556 | 53% | 0.534 | S | S | * | . | H | α-helix | trans | -61.2 | -42.4 | 177.8 | -173.5 | 179.3 | -166.2 | 0 | 0 | 111.9 | W206 N208 N213 H214 | W206-E210 WeakPolarHBondContact O-CB 3.5Å; W206-E210 PolarHBondContact O-N 3.46Å; N208-E210 VanDerWaalsContact C-N 3.33Å; N208-E210 PolarHBondContact O-N 2.93Å; E210-N213 PolarHBondContact O-N 3.29Å; E210-H214 WeakPolarHBondContact O-CB 3.43Å; E210-H214 PolarHBondContact O-N 3.24Å |
| 211 | K | 93.9 | Very high | 87.3 | Confident | 109 Ų | 109 | 109.1 Ų | 109.1 | 47% | 0.474 | 55% | 0.547 | S | S | . | . | H | α-helix | trans | -60.8 | -47.4 | 174.7 | -72.9 | 170.1 | -171.8 | 172.3 | 0 | 112.1 | S207 N208 V209 N213 H214 E215 | S207-K211 VanDerWaalsContact O-CG 3.29Å; S207-K211 WeakPolarHBondContact O-CG 3.44Å; S207-K211 PolarHBondContact O-N 2.89Å; S207-K211 VanDerWaalsContact O-N 3.09Å; N208-K211 PolarHBondContact O-N 3.38Å; V209-K211 VanDerWaalsContact C-N 3.35Å; V209-K211 PolarHBondContact O-N 3.31Å; K211-N213 VanDerWaalsContact C-N 3.29Å; K211-N213 PolarHBondContact O-N 2.96Å; K211-H214 PolarHBondContact O-N 3.46Å; K211-E215 WeakPolarHBondContact O-CG 3.46Å; K211-E215 PolarHBondContact O-N 3.34Å |
| 212 | V | 92.4 | Very high | 85.2 | Confident | 96 Ų | 96 | 109.9 Ų | 109.9 | 58% | 0.582 | 56% | 0.557 | S | S | * | * | H | α-helix | trans | -61.1 | -41 | 177.7 | 172.7 | 0 | 0 | 0 | 0 | 110.8 | N208 V209 E215 A216 | N208-V212 WeakPolarHBondContact O-CG2 3.46Å; N208-V212 PolarHBondContact O-N 3.13Å; V209-V212 PolarHBondContact O-N 2.93Å; V212-E215 PolarHBondContact O-N 3.24Å; V212-A216 VanDerWaalsContact O-CB 3.32Å; V212-A216 WeakPolarHBondContact O-CB 3.31Å; V212-A216 PolarHBondContact O-N 3.42Å |
| 213 | N | 87.4 | Confident | 83.2 | Confident | 114 Ų | 114 | 109.6 Ų | 109.6 | 61% | 0.61 | 57% | 0.57 | S | S | * | * | H | α-helix | trans | -63.7 | -44.7 | 176.3 | -169 | 24.6 | 0 | 0 | 0 | 111.8 | V209 E210 K211 E215 A216 G217 | V209-N213 WeakPolarHBondContact O-CB 3.41Å; V209-N213 PolarHBondContact O-N 3.48Å; E210-N213 PolarHBondContact O-N 3.29Å; K211-N213 VanDerWaalsContact C-N 3.29Å; K211-N213 PolarHBondContact O-N 2.96Å; N213-E215 PolarHBondContact O-N 3.3Å; N213-A216 PolarHBondContact O-N 3.01Å; N213-G217 PolarHBondContact O-N 3.28Å |
| 214 | H | 88.3 | Confident | 80.9 | Confident | 125 Ų | 125 | 109.5 Ų | 109.5 | 58% | 0.579 | 59% | 0.586 | S | S | * | * | H | α-helix | trans | -61.3 | -41.1 | 173.7 | -96.4 | -170.7 | 0 | 0 | 0 | 112.8 | E210 K211 G217 K218 | E210-H214 WeakPolarHBondContact O-CB 3.43Å; E210-H214 PolarHBondContact O-N 3.24Å; K211-H214 PolarHBondContact O-N 3.46Å; H214-G217 PolarHBondContact O-N 2.84Å; H214-K218 WeakPolarHBondContact O-CG 3.32Å; H214-K218 PolarHBondContact O-N 3.3Å |
| 215 | E | 84.5 | Confident | 78.3 | Confident | 113 Ų | 113 | 111.7 Ų | 111.7 | 53% | 0.528 | 64% | 0.635 | S | S | . | * | H | α-helix | trans | -67.2 | -41.4 | 176.1 | -74.1 | -176.6 | -171.9 | 0 | 0 | 112.1 | K211 V212 N213 G217 K218 K219 | K211-E215 WeakPolarHBondContact O-CG 3.46Å; K211-E215 PolarHBondContact O-N 3.34Å; V212-E215 PolarHBondContact O-N 3.24Å; N213-E215 PolarHBondContact O-N 3.3Å; E215-G217 VanDerWaalsContact C-N 3.33Å; E215-G217 PolarHBondContact O-N 3.01Å; E215-K218 PolarHBondContact O-N 3.3Å; E215-K219 VanDerWaalsContact O-CG 3.31Å; E215-K219 WeakPolarHBondContact O-CG 3.42Å; E215-K219 PolarHBondContact O-N 3.03Å |
| 216 | A | 81.1 | Confident | 77.4 | Confident | 46 Ų | 46 | 111.3 Ų | 111.3 | 38% | 0.38 | 64% | 0.641 | S | S | . | * | H | α-helix | trans | -62.3 | -40.3 | 174.7 | 0 | 0 | 0 | 0 | 0 | 111.8 | V212 N213 K219 | V212-A216 VanDerWaalsContact O-CB 3.32Å; V212-A216 WeakPolarHBondContact O-CB 3.31Å; V212-A216 PolarHBondContact O-N 3.42Å; N213-A216 PolarHBondContact O-N 3.01Å; A216-K219 PolarHBondContact O-N 3.49Å |
| 217 | G | 77.9 | Confident | 76.3 | Confident | 60 Ų | 60 | 108.7 Ų | 108.7 | 62% | 0.619 | 64% | 0.643 | S | S | * | * | H | α-helix | trans | -66.1 | -35.8 | 174.4 | 0 | 0 | 0 | 0 | 0 | 113.7 | N213 H214 E215 | N213-G217 PolarHBondContact O-N 3.28Å; H214-G217 PolarHBondContact O-N 2.84Å; E215-G217 VanDerWaalsContact C-N 3.33Å; E215-G217 PolarHBondContact O-N 3.01Å |
| 218 | K | 72.7 | Confident | 75.1 | Confident | 185 Ų | 185 | 112.4 Ų | 112.4 | 80% | 0.804 | 66% | 0.662 | S | S | * | * | H | α-helix | trans | -71.2 | -29.4 | 174.4 | -78 | -178 | -179.9 | -177.7 | 0 | 113.4 | H214 E215 G220 | H214-K218 WeakPolarHBondContact O-CG 3.32Å; H214-K218 PolarHBondContact O-N 3.3Å; E215-K218 PolarHBondContact O-N 3.3Å; K218-G220 PolarHBondContact O-N 3.36Å |
| 219 | K | 66.1 | Low | 73.8 | Confident | 158 Ų | 158 | 114.6 Ų | 114.6 | 69% | 0.687 | 68% | 0.678 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -82.1 | 13.3 | -179.9 | -70.1 | -175.1 | -172.3 | -175 | 0 | 113.9 | E215 A216 W221 | E215-K219 VanDerWaalsContact O-CG 3.31Å; E215-K219 WeakPolarHBondContact O-CG 3.42Å; E215-K219 PolarHBondContact O-N 3.03Å; A216-K219 PolarHBondContact O-N 3.49Å; K219-W221 PolarHBondContact O-N 2.83Å |
| 220 | G | 57.5 | Low | 72.5 | Confident | 54 Ų | 54 | 117.9 Ų | 117.9 | 56% | 0.557 | 70% | 0.696 | S | S | * | * | trans | 20.1 | 89.6 | 170.4 | 0 | 0 | 0 | 0 | 0 | 113.3 | K218 P222 | K218-G220 PolarHBondContact O-N 3.36Å; G220-P222 WeakPolarHBondContact O-CD 3.4Å | ||
| 221 | W | 59.5 | Low | 71 | Confident | 221 Ų | 221 | 117.8 Ų | 117.8 | 84% | 0.837 | 71% | 0.706 | S | S | * | * | trans | -43.4 | 116 | 179.5 | -89 | 54.2 | 0 | 0 | 0 | 109.5 | K219 G223 | K219-W221 PolarHBondContact O-N 2.83Å; W221-G223 PolarHBondContact O-N 3.15Å; W221-G223 VanDerWaalsContact O-N 3.15Å | ||
| 222 | P | 54.3 | Low | 69.4 | Low | 117 Ų | 117 | 118.4 Ų | 118.4 | 76% | 0.76 | 72% | 0.722 | S | S | * | * | trans | -60 | 125 | 174.6 | 23.2 | -30 | 0 | 0 | 0 | 107.2 | G220 V224 | G220-P222 WeakPolarHBondContact O-CD 3.4Å; P222-V224 PolarHBondContact O-N 3.26Å | ||
| 223 | G | 55.5 | Low | 67.6 | Low | 75 Ų | 75 | 120.2 Ų | 120.2 | 77% | 0.773 | 73% | 0.733 | S | S | * | * | trans | -49.7 | 133.9 | -170.2 | 0 | 0 | 0 | 0 | 0 | 112.8 | W221 G225 | W221-G223 PolarHBondContact O-N 3.15Å; W221-G223 VanDerWaalsContact O-N 3.15Å; G223-G225 VanDerWaalsContact C-N 3.34Å; G223-G225 PolarHBondContact O-N 3.42Å | ||
| 224 | V | 49.7 | Very low | 65.9 | Low | 149 Ų | 149 | 120.7 Ų | 120.7 | 90% | 0.903 | 74% | 0.743 | S | S | * | * | trans | -75.6 | 95.8 | 150.7 | -103.7 | 0 | 0 | 0 | 0 | 106.1 | P222 | P222-V224 PolarHBondContact O-N 3.26Š| ||
| 225 | G | 44.3 | Very low | 63.9 | Low | 145 Ų | 145 | 120.3 Ų | 120.3 | 100% | 1.495 | 76% | 0.758 | S | S | * | * | trans | -82.4 | 0 | 159.9 | 0 | 0 | 0 | 0 | 0 | 111.3 | G223 | G223-G225 VanDerWaalsContact C-N 3.34Å; G223-G225 PolarHBondContact O-N 3.42Å |
Retrieved 225 of 225 residues in 242.5 ms
(Link to these results)