| 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 | 46.5 | Very low | 52.3 | Low | 245 Ų | 245 | 127.1 Ų | 127.1 | 100% | 1.207 | 74% | 0.736 | S | S | * | * | 0 | 52.1 | 0 | -68 | -169.6 | 176.1 | 0 | 0 | 112.1 | |||||
| 2 | A | 49.6 | Very low | 52.5 | Low | 96 Ų | 96 | 126.6 Ų | 126.6 | 79% | 0.793 | 73% | 0.728 | S | S | * | * | trans | -119 | -2.3 | -173.7 | 0 | 0 | 0 | 0 | 0 | 113.8 | ||||
| 3 | A | 52 | Low | 52.4 | Low | 91 Ų | 91 | 129 Ų | 129 | 75% | 0.752 | 73% | 0.728 | S | S | * | * | S | Bend | trans | -93.4 | -9.1 | -175.1 | 0 | 0 | 0 | 0 | 0 | 114.5 | ||
| 4 | A | 51.6 | Low | 52.6 | Low | 88 Ų | 88 | 124.6 Ų | 124.6 | 73% | 0.727 | 72% | 0.716 | S | S | * | * | S | Bend | trans | -91.8 | -8.9 | -172.8 | 0 | 0 | 0 | 0 | 0 | 115 | ||
| 5 | L | 50.6 | Low | 52.7 | Low | 146 Ų | 146 | 124.3 Ų | 124.3 | 76% | 0.764 | 71% | 0.71 | S | S | * | * | S | Bend | trans | -100.4 | -5.2 | -173 | -72.3 | 166 | 0 | 0 | 0 | 114.5 | ||
| 6 | S | 53.9 | Low | 52.7 | Low | 78 Ų | 78 | 125.5 Ų | 125.5 | 55% | 0.545 | 71% | 0.707 | S | S | . | * | S | Bend | trans | -89.2 | -15.6 | -179 | 63.2 | 0 | 0 | 0 | 0 | 114.1 | ||
| 7 | S | 53.3 | Low | 52.7 | Low | 95 Ų | 95 | 130.4 Ų | 130.4 | 66% | 0.664 | 71% | 0.712 | S | S | * | * | S | Bend | trans | -81.6 | -28.6 | -177.5 | -168.2 | 0 | 0 | 0 | 0 | 113.3 | R9 | S7-R9 PolarHBondContact O-N 3.3Š|
| 8 | S | 54.5 | Low | 52.6 | Low | 82 Ų | 82 | 135.1 Ų | 135.1 | 57% | 0.573 | 72% | 0.717 | S | S | * | * | H | α-helix | trans | -74.1 | -23.3 | -175.4 | -167.5 | 0 | 0 | 0 | 0 | 114.1 | ||
| 9 | R | 55 | Low | 52.5 | Low | 211 Ų | 211 | 135.8 Ų | 135.8 | 80% | 0.796 | 72% | 0.72 | S | S | * | * | H | α-helix | trans | -78.4 | -18.8 | 179.6 | -76.6 | -174.4 | 175.3 | -169.9 | -1 | 114.6 | S7 | S7-R9 PolarHBondContact O-N 3.3Å |
| 10 | R | 54.2 | Low | 52.5 | Low | 206 Ų | 206 | 136.1 Ų | 136.1 | 78% | 0.777 | 72% | 0.722 | S | S | * | * | H | α-helix | trans | -86.6 | -24.8 | 178.1 | -63.9 | -173.5 | -159.4 | -176.4 | 5.2 | 113 | ||
| 11 | A | 54.1 | Low | 52.4 | Low | 60 Ų | 60 | 136 Ų | 136 | 50% | 0.496 | 72% | 0.721 | S | S | . | * | H | α-helix | trans | -74.1 | -31 | 179.3 | 0 | 0 | 0 | 0 | 0 | 113.5 | ||
| 12 | L | 54.1 | Low | 52.7 | Low | 121 Ų | 121 | 132.3 Ų | 132.3 | 63% | 0.634 | 70% | 0.7 | S | S | * | * | H | α-helix | trans | -76.9 | -25.8 | 179.8 | -80.5 | 165.4 | 0 | 0 | 0 | 113.8 | ||
| 13 | H | 52.4 | Low | 52.8 | Low | 158 Ų | 158 | 133.8 Ų | 133.8 | 73% | 0.731 | 70% | 0.702 | S | S | * | * | H | α-helix | trans | -77.1 | -20.8 | 175 | -92.8 | -81.7 | 0 | 0 | 0 | 113.6 | ||
| 14 | A | 54.2 | Low | 52.8 | Low | 68 Ų | 68 | 137.3 Ų | 137.3 | 56% | 0.562 | 71% | 0.707 | S | S | * | * | H | α-helix | trans | -79.8 | -28.5 | 176.4 | 0 | 0 | 0 | 0 | 0 | 113 | ||
| 15 | L | 53.9 | Low | 52.6 | Low | 120 Ų | 120 | 138.9 Ų | 138.9 | 63% | 0.628 | 71% | 0.71 | S | S | * | * | H | α-helix | trans | -79.9 | -28.8 | 178.5 | -84.7 | 161.2 | 0 | 0 | 0 | 113.3 | R17 | L15-R17 VanDerWaalsContact C-N 3.27Å; L15-R17 PolarHBondContact O-N 3.01Å |
| 16 | H | 53.4 | Low | 52.8 | Low | 143 Ų | 143 | 137.8 Ų | 137.8 | 66% | 0.662 | 71% | 0.714 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -75.3 | -14.9 | 179.4 | -141.7 | -92.8 | 0 | 0 | 0 | 113.7 | ||
| 17 | R | 52.6 | Low | 52.6 | Low | 208 Ų | 208 | 146 Ų | 146 | 79% | 0.785 | 73% | 0.733 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -92.6 | -13.7 | 179.9 | -144.8 | 176.4 | -174.1 | -177.1 | 0.7 | 113.6 | L15 | L15-R17 VanDerWaalsContact C-N 3.27Å; L15-R17 PolarHBondContact O-N 3.01Å |
| 18 | R | 50.4 | Low | 52.2 | Low | 216 Ų | 216 | 150.9 Ų | 150.9 | 82% | 0.815 | 75% | 0.745 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -94.1 | -12.3 | 178.9 | -110.6 | -178 | 177.2 | -171.7 | -0.8 | 114.5 | ||
| 19 | L | 51.9 | Low | 52.4 | Low | 148 Ų | 148 | 151.3 Ų | 151.3 | 78% | 0.775 | 75% | 0.754 | S | S | * | * | S | Bend | trans | -93.4 | -1.2 | 178.4 | -76.3 | 164.2 | 0 | 0 | 0 | 114 | ||
| 20 | L | 52.3 | Low | 52.9 | Low | 142 Ų | 142 | 146.8 Ų | 146.8 | 74% | 0.743 | 75% | 0.752 | S | S | * | * | S | Bend | trans | -101.8 | 8 | -179.1 | -70.9 | 172.6 | 0 | 0 | 0 | 114.1 | ||
| 21 | L | 50.4 | Low | 52.7 | Low | 134 Ų | 134 | 143.1 Ų | 143.1 | 70% | 0.702 | 75% | 0.754 | S | S | * | * | S | Bend | trans | -125.6 | 12 | -170.4 | -84.8 | 158.1 | 0 | 0 | 0 | 115.5 | ||
| 22 | H | 51.7 | Low | 53.2 | Low | 168 Ų | 168 | 147.9 Ų | 147.9 | 78% | 0.778 | 77% | 0.77 | S | S | * | * | trans | -136.6 | 103.8 | 175.1 | -77.9 | -70.2 | 0 | 0 | 0 | 112.2 | ||||
| 23 | P | 51.5 | Low | 53.2 | Low | 127 Ų | 127 | 147.5 Ų | 147.5 | 83% | 0.825 | 78% | 0.775 | S | S | * | * | P | Polyproline II helix | trans | -76.7 | 118.2 | 162.3 | 18 | -5.2 | 0 | 0 | 0 | 108.7 | ||
| 24 | L | 52.1 | Low | 52.7 | Low | 165 Ų | 165 | 151.7 Ų | 151.7 | 86% | 0.864 | 78% | 0.784 | S | S | * | * | P | Polyproline II helix | trans | -72.4 | 143.3 | 171 | -88.3 | 138.4 | 0 | 0 | 0 | 110.7 | ||
| 25 | P | 47.6 | Very low | 52.8 | Low | 120 Ų | 120 | 157.5 Ų | 157.5 | 78% | 0.779 | 80% | 0.799 | S | S | * | * | P | Polyproline II helix | trans | -78.3 | 128 | -174.6 | 31.1 | -31.7 | 0 | 0 | 0 | 111.4 | R27 | P25-R27 PolarHBondContact O-N 3.3Š|
| 26 | S | 55.5 | Low | 52.4 | Low | 124 Ų | 124 | 160.4 Ų | 160.4 | 87% | 0.867 | 81% | 0.809 | S | S | * | * | P | Polyproline II helix | trans | -70.6 | 121.4 | 173.9 | 32.8 | 0 | 0 | 0 | 0 | 111.5 | ||
| 27 | R | 49.9 | Very low | 52.6 | Low | 250 Ų | 250 | 163.1 Ų | 163.1 | 94% | 0.943 | 82% | 0.82 | S | S | * | * | P | Polyproline II helix | trans | -74.9 | 137.2 | 174.2 | -112 | 177.6 | 176.1 | -179.2 | -2 | 111.2 | P25 | P25-R27 PolarHBondContact O-N 3.3Š|
| 28 | H | 44.8 | Very low | 52.8 | Low | 198 Ų | 198 | 159.1 Ų | 159.1 | 92% | 0.917 | 82% | 0.82 | S | S | * | * | P | Polyproline II helix | trans | -46.2 | 140.3 | 174.3 | -81.8 | -59.1 | 0 | 0 | 0 | 115.8 | ||
| 29 | A | 58.2 | Low | 52.8 | Low | 91 Ų | 91 | 154.1 Ų | 154.1 | 75% | 0.752 | 82% | 0.818 | S | S | * | * | trans | -126.1 | 141.7 | 153.7 | 0 | 0 | 0 | 0 | 0 | 109.2 | ||||
| 30 | P | 66.5 | Low | 53.4 | Low | 116 Ų | 116 | 152.8 Ų | 152.8 | 75% | 0.753 | 82% | 0.819 | S | S | * | * | trans | -84 | 165 | -168.9 | 34.4 | -35.3 | 0 | 0 | 0 | 113.6 | ||||
| 31 | P | 50.3 | Low | 53.4 | Low | 128 Ų | 128 | 151.7 Ų | 151.7 | 83% | 0.831 | 82% | 0.82 | S | S | * | * | trans | -84.4 | 145.4 | -172 | 34.8 | -32.5 | 0 | 0 | 0 | 112.2 | ||||
| 32 | I | 63.8 | Low | 53.2 | Low | 161 Ų | 161 | 150.6 Ų | 150.6 | 83% | 0.826 | 82% | 0.824 | S | S | * | * | trans | -112 | 140.7 | 174.3 | -64.9 | 179.1 | 0 | 0 | 0 | 108.5 | ||||
| 33 | P | 53.4 | Low | 53 | Low | 113 Ų | 113 | 147.8 Ų | 147.8 | 73% | 0.734 | 82% | 0.823 | S | S | * | * | P | Polyproline II helix | trans | -83.2 | 153.4 | -154.9 | 31.8 | -34.6 | 0 | 0 | 0 | 115.1 | ||
| 34 | R | 42.7 | Very low | 52.7 | Low | 246 Ų | 246 | 146.9 Ų | 146.9 | 93% | 0.928 | 82% | 0.82 | S | S | * | * | P | Polyproline II helix | trans | -82.3 | 132.5 | 177.1 | -68 | 177.3 | 173.7 | 171.7 | -3.3 | 111 | ||
| 35 | H | 56.8 | Low | 52.3 | Low | 189 Ų | 189 | 144.5 Ų | 144.5 | 88% | 0.875 | 82% | 0.817 | S | S | * | * | P | Polyproline II helix | trans | -97.8 | 131.8 | 161.6 | -87.6 | -72.2 | 0 | 0 | 0 | 110.7 | ||
| 36 | H | 44.9 | Very low | 52 | Low | 181 Ų | 181 | 144.4 Ų | 144.4 | 84% | 0.838 | 82% | 0.819 | S | S | * | * | P | Polyproline II helix | trans | -69.2 | 139.2 | 177.9 | -79.7 | -38.8 | 0 | 0 | 0 | 113.2 | ||
| 37 | F | 57.2 | Low | 51.3 | Low | 201 Ų | 201 | 143.6 Ų | 143.6 | 88% | 0.882 | 81% | 0.813 | S | S | * | * | trans | -138.7 | 146.4 | 145.7 | -88 | -79.3 | 0 | 0 | 0 | 109.3 | ||||
| 38 | P | 56.8 | Low | 51 | Low | 123 Ų | 123 | 136.5 Ų | 136.5 | 80% | 0.799 | 80% | 0.802 | S | S | * | * | P | Polyproline II helix | trans | -87.3 | 143.5 | -162.6 | 34 | -32.4 | 0 | 0 | 0 | 113.2 | ||
| 39 | S | 50.9 | Low | 50.8 | Low | 111 Ų | 111 | 138.1 Ų | 138.1 | 78% | 0.776 | 80% | 0.8 | S | S | * | * | P | Polyproline II helix | trans | -100.1 | 147 | 174.8 | 46.7 | 0 | 0 | 0 | 0 | 112.1 | ||
| 40 | P | 63.8 | Low | 50 | Low | 121 Ų | 121 | 144 Ų | 144 | 79% | 0.786 | 81% | 0.809 | S | S | * | * | P | Polyproline II helix | trans | -90.1 | 167.3 | 160 | 35.9 | -28.2 | 0 | 0 | 0 | 111.6 | ||
| 41 | P | 53.1 | Low | 48.4 | Very low | 118 Ų | 118 | 148 Ų | 148 | 77% | 0.766 | 82% | 0.815 | S | S | * | * | P | Polyproline II helix | trans | -103.9 | 145.7 | -137.1 | 38.2 | -34.8 | 0 | 0 | 0 | 117.1 | ||
| 42 | S | 46.3 | Very low | 47.9 | Very low | 112 Ų | 112 | 148.9 Ų | 148.9 | 78% | 0.783 | 82% | 0.818 | S | S | * | * | trans | 46 | 119.9 | 136.1 | 67.1 | 0 | 0 | 0 | 0 | 123.2 | ||||
| 43 | S | 46 | Very low | 46.5 | Very low | 109 Ų | 109 | 147.2 Ų | 147.2 | 76% | 0.762 | 82% | 0.816 | S | S | * | * | -158.5 | 102.2 | 123.5 | 45.5 | 0 | 0 | 0 | 0 | 108.2 | |||||
| 44 | S | 45.3 | Very low | 46.1 | Very low | 108 Ų | 108 | 148.6 Ų | 148.6 | 76% | 0.755 | 82% | 0.822 | S | S | * | * | 38.3 | 116.1 | 109.5 | 61.4 | 0 | 0 | 0 | 0 | 114.3 | |||||
| 45 | S | 44.3 | Very low | 45.9 | Very low | 115 Ų | 115 | 147.6 Ų | 147.6 | 80% | 0.804 | 82% | 0.818 | S | S | * | * | -174.4 | 155.8 | 62.8 | 44.6 | 0 | 0 | 0 | 0 | 113.3 | |||||
| 46 | S | 41.3 | Very low | 45.6 | Very low | 118 Ų | 118 | 144.7 Ų | 144.7 | 83% | 0.825 | 82% | 0.816 | S | S | * | * | trans | -11.2 | 160.2 | 158.4 | -64.6 | 0 | 0 | 0 | 0 | 119.8 | ||||
| 47 | S | 41.4 | Very low | 45.4 | Very low | 106 Ų | 106 | 143.3 Ų | 143.3 | 74% | 0.741 | 82% | 0.815 | S | S | * | * | cis | 171.8 | 153 | -10.8 | -174.3 | 0 | 0 | 0 | 0 | 105.9 | ||||
| 48 | S | 44.2 | Very low | 44.4 | Very low | 102 Ų | 102 | 138.2 Ų | 138.2 | 71% | 0.713 | 81% | 0.81 | S | S | * | * | trans | 90.4 | 97.1 | 156.5 | 85.2 | 0 | 0 | 0 | 0 | 121.2 | ||||
| 49 | R | 39.5 | Very low | 43.5 | Very low | 232 Ų | 232 | 143.6 Ų | 143.6 | 88% | 0.875 | 81% | 0.814 | S | S | * | * | 18 | 127.1 | 127.4 | -55.3 | 177.5 | -160.4 | 158.9 | 6.1 | 118.1 | |||||
| 50 | F | 40.9 | Very low | 43.1 | Very low | 213 Ų | 213 | 146.3 Ų | 146.3 | 93% | 0.934 | 82% | 0.82 | S | S | * | * | -156.3 | 131.7 | 122.2 | -88 | -71.7 | 0 | 0 | 0 | 111.2 | |||||
| 51 | F | 33.2 | Very low | 42 | Very low | 202 Ų | 202 | 148.5 Ų | 148.5 | 89% | 0.886 | 82% | 0.824 | S | S | * | * | trans | -73.7 | 144.9 | 166.9 | -89.9 | -102 | 0 | 0 | 0 | 109.8 | ||||
| 52 | T | 39.8 | Very low | 41.3 | Very low | 145 Ų | 145 | 151.8 Ų | 151.8 | 89% | 0.89 | 83% | 0.829 | S | S | * | * | -165.6 | 144.9 | 126.3 | 40.7 | 0 | 0 | 0 | 0 | 112.3 | |||||
| 53 | T | 35.5 | Very low | 41 | Very low | 126 Ų | 126 | 154 Ų | 154 | 77% | 0.773 | 83% | 0.831 | S | S | * | * | trans | -78.1 | 136.6 | -179.9 | -179.9 | 0 | 0 | 0 | 0 | 111.5 | ||||
| 54 | T | 44.3 | Very low | 40.8 | Very low | 142 Ų | 142 | 157.9 Ų | 157.9 | 87% | 0.871 | 84% | 0.837 | S | S | * | * | trans | -144.6 | 126 | 152.5 | 46 | 0 | 0 | 0 | 0 | 111.1 | ||||
| 55 | R | 38.8 | Very low | 40.5 | Very low | 225 Ų | 225 | 157.1 Ų | 157.1 | 85% | 0.849 | 84% | 0.837 | S | S | * | * | P | Polyproline II helix | trans | -71 | 150.3 | 165.2 | -74.8 | 169.3 | 160.5 | 155.6 | -5.5 | 109.3 | ||
| 56 | P | 49.4 | Very low | 40.4 | Very low | 128 Ų | 128 | 163.7 Ų | 163.7 | 83% | 0.831 | 84% | 0.844 | S | S | * | * | P | Polyproline II helix | trans | -92.6 | 128.9 | 150.2 | 28.5 | -17 | 0 | 0 | 0 | 109.8 | ||
| 57 | D | 41.4 | Very low | 40.3 | Very low | 153 Ų | 153 | 169.8 Ų | 169.8 | 82% | 0.818 | 85% | 0.849 | S | S | * | * | P | Polyproline II helix | trans | -60.5 | 136.1 | 178.6 | -85.8 | -52.1 | 0 | 0 | 0 | 113.3 | R59 | D57-R59 PolarHBondContact O-N 2.84Š|
| 58 | A | 35.8 | Very low | 40.2 | Very low | 94 Ų | 94 | 172 Ų | 172 | 78% | 0.777 | 85% | 0.852 | S | S | * | * | trans | -75.9 | 105.7 | 158.2 | 0 | 0 | 0 | 0 | 0 | 108.5 | ||||
| 59 | R | 39 | Very low | 40 | Very low | 235 Ų | 235 | 173.7 Ų | 173.7 | 89% | 0.887 | 86% | 0.857 | S | S | * | * | trans | -179.4 | 89 | 157.2 | -102 | 162.4 | -165.7 | -151.1 | 6.1 | 110.2 | D57 | D57-R59 PolarHBondContact O-N 2.84Š| ||
| 60 | L | 41.6 | Very low | 40.2 | Very low | 169 Ų | 169 | 168.4 Ų | 168.4 | 89% | 0.885 | 85% | 0.851 | S | S | * | * | trans | -167.4 | 140.1 | 150.9 | -108.9 | 152.6 | 0 | 0 | 0 | 108.6 | ||||
| 61 | L | 40.3 | Very low | 40 | Very low | 166 Ų | 166 | 162.1 Ų | 162.1 | 87% | 0.869 | 85% | 0.846 | S | S | * | * | trans | 88.3 | 53.7 | 179.6 | -51.5 | 176.4 | 0 | 0 | 0 | 116.7 | ||||
| 62 | Q | 38.8 | Very low | 40.1 | Very low | 188 Ų | 188 | 156 Ų | 156 | 88% | 0.879 | 84% | 0.841 | S | S | * | * | trans | -88 | 97.8 | 142.9 | -175.5 | -179 | 17.3 | 0 | 0 | 107.5 | ||||
| 63 | L | 40.4 | Very low | 40 | Very low | 158 Ų | 158 | 154.1 Ų | 154.1 | 83% | 0.827 | 84% | 0.839 | S | S | * | * | trans | 172.9 | 94.1 | 158 | -97.5 | 147 | 0 | 0 | 0 | 108.9 | ||||
| 64 | H | 42.5 | Very low | 40.3 | Very low | 190 Ų | 190 | 159.2 Ų | 159.2 | 88% | 0.88 | 84% | 0.844 | S | S | * | * | trans | -170.6 | 124.2 | 132.6 | -102.9 | 102 | 0 | 0 | 0 | 112 | ||||
| 65 | A | 38.7 | Very low | 40.2 | Very low | 92 Ų | 92 | 158.2 Ų | 158.2 | 76% | 0.76 | 84% | 0.843 | S | S | * | * | trans | 67.8 | 80.4 | 143.8 | 0 | 0 | 0 | 0 | 0 | 119.5 | ||||
| 66 | R | 40.6 | Very low | 40.2 | Very low | 253 Ų | 253 | 157.8 Ų | 157.8 | 96% | 0.955 | 85% | 0.847 | S | S | * | * | trans | -70.3 | 121.8 | 135.3 | -81.9 | 177.6 | 151.2 | -171.9 | -6 | 108.7 | ||||
| 67 | R | 39.9 | Very low | 39.6 | Very low | 247 Ų | 247 | 156.2 Ų | 156.2 | 93% | 0.932 | 85% | 0.846 | S | S | * | * | trans | -145.3 | 115.6 | 151.6 | -115.4 | -176 | -174 | -158.4 | 2 | 111.5 | ||||
| 68 | L | 39.8 | Very low | 39.4 | Very low | 151 Ų | 151 | 154.1 Ų | 154.1 | 79% | 0.791 | 85% | 0.85 | S | S | * | * | trans | -52.7 | 141 | 161.1 | -115 | 90.5 | 0 | 0 | 0 | 111.7 | V70 | L68-V70 HydrophobicContact CD2-CG2 4.49Š| ||
| 69 | V | 40.8 | Very low | 39.4 | Very low | 138 Ų | 138 | 153 Ų | 153 | 84% | 0.836 | 85% | 0.847 | S | S | * | * | trans | -168.2 | 102.1 | 140.6 | 175.8 | 0 | 0 | 0 | 0 | 105.3 | ||||
| 70 | V | 42.8 | Very low | 39.4 | Very low | 121 Ų | 121 | 148.9 Ų | 148.9 | 73% | 0.733 | 85% | 0.848 | S | S | * | * | 49.2 | 102.6 | 79 | -179.3 | 0 | 0 | 0 | 0 | 115.2 | L68 | L68-V70 HydrophobicContact CD2-CG2 4.49Š| |||
| 71 | G | 35.8 | Very low | 39.2 | Very low | 82 Ų | 82 | 144.5 Ų | 144.5 | 85% | 0.845 | 84% | 0.843 | S | S | * | * | trans | 83.7 | 141.2 | 138.9 | 0 | 0 | 0 | 0 | 0 | 118.6 | ||||
| 72 | G | 37 | Very low | 39 | Very low | 74 Ų | 74 | 140.7 Ų | 140.7 | 76% | 0.763 | 84% | 0.844 | S | S | * | * | trans | 135.8 | 82 | 153.1 | 0 | 0 | 0 | 0 | 0 | 115.4 | ||||
| 73 | A | 37.3 | Very low | 38.8 | Very low | 104 Ų | 104 | 136 Ų | 136 | 86% | 0.86 | 85% | 0.846 | S | S | * | * | trans | -64.2 | 129.9 | 154.5 | 0 | 0 | 0 | 0 | 0 | 109.2 | ||||
| 74 | R | 41.7 | Very low | 38.9 | Very low | 234 Ų | 234 | 132.4 Ų | 132.4 | 88% | 0.883 | 85% | 0.847 | S | S | * | * | trans | -137.3 | 117.1 | 162.4 | -80.9 | -168.9 | 169.1 | -171.1 | -3.2 | 110.5 | ||||
| 75 | S | 41.3 | Very low | 38.8 | Very low | 120 Ų | 120 | 128.9 Ų | 128.9 | 84% | 0.839 | 84% | 0.844 | S | S | * | * | trans | -61.9 | 139.4 | 167.6 | -45.3 | 0 | 0 | 0 | 0 | 110.6 | ||||
| 76 | F | 39.5 | Very low | 39.1 | Very low | 216 Ų | 216 | 129.2 Ų | 129.2 | 95% | 0.947 | 84% | 0.841 | S | S | * | * | trans | -89.5 | 119.5 | 165.7 | -74.3 | -87.6 | 0 | 0 | 0 | 109 | ||||
| 77 | A | 36.6 | Very low | 39.2 | Very low | 96 Ų | 96 | 125.8 Ų | 125.8 | 79% | 0.793 | 83% | 0.833 | S | S | * | * | trans | -131.1 | 148.4 | 164.4 | 0 | 0 | 0 | 0 | 0 | 108.6 | ||||
| 78 | A | 36.2 | Very low | 39.3 | Very low | 109 Ų | 109 | 121.9 Ų | 121.9 | 90% | 0.901 | 83% | 0.83 | S | S | * | * | trans | 84 | 126.6 | 163.7 | 0 | 0 | 0 | 0 | 0 | 119 | ||||
| 79 | G | 37.5 | Very low | 39.7 | Very low | 70 Ų | 70 | 118.9 Ų | 118.9 | 72% | 0.722 | 83% | 0.827 | S | S | * | * | trans | 154.6 | 65.9 | 175.7 | 0 | 0 | 0 | 0 | 0 | 107.6 | ||||
| 80 | V | 38 | Very low | 40 | Very low | 149 Ų | 149 | 117.9 Ų | 117.9 | 90% | 0.903 | 82% | 0.823 | S | S | * | * | 47.4 | 107.8 | 82 | -178.9 | 0 | 0 | 0 | 0 | 111.7 | |||||
| 81 | G | 37.2 | Very low | 39.9 | Very low | 77 Ų | 77 | 120.7 Ų | 120.7 | 79% | 0.794 | 83% | 0.833 | S | S | * | * | trans | 169.2 | 106.4 | 166 | 0 | 0 | 0 | 0 | 0 | 115.2 | ||||
| 82 | G | 36.4 | Very low | 40.1 | Very low | 86 Ų | 86 | 120 Ų | 120 | 89% | 0.887 | 83% | 0.825 | S | S | * | * | trans | 73.9 | 124.9 | 153.2 | 0 | 0 | 0 | 0 | 0 | 116.9 | ||||
| 83 | G | 35.7 | Very low | 40.3 | Very low | 88 Ų | 88 | 126.4 Ų | 126.4 | 91% | 0.907 | 84% | 0.835 | S | S | * | * | cis | 115.2 | 106.1 | 31.3 | 0 | 0 | 0 | 0 | 0 | 108.1 | ||||
| 84 | G | 41.1 | Very low | 40.3 | Very low | 84 Ų | 84 | 124.9 Ų | 124.9 | 87% | 0.866 | 83% | 0.83 | S | S | * | * | trans | 173.2 | 78.3 | -179.4 | 0 | 0 | 0 | 0 | 0 | 115 | ||||
| 85 | S | 41 | Very low | 40.3 | Very low | 116 Ų | 116 | 120.8 Ų | 120.8 | 81% | 0.811 | 83% | 0.831 | S | S | * | * | trans | -56 | 142.4 | 167 | -157.6 | 0 | 0 | 0 | 0 | 110.9 | ||||
| 86 | S | 45.2 | Very low | 40.3 | Very low | 98 Ų | 98 | 125.1 Ų | 125.1 | 69% | 0.685 | 84% | 0.835 | S | S | * | * | 161.7 | 162.5 | 74.9 | 44.5 | 0 | 0 | 0 | 0 | 110.4 | |||||
| 87 | K | 42.6 | Very low | 40.3 | Very low | 182 Ų | 182 | 118.5 Ų | 118.5 | 79% | 0.791 | 83% | 0.827 | S | S | * | * | trans | 90.8 | 100.2 | 168.5 | -64.2 | -173.9 | 171.1 | 175.9 | 0 | 116 | ||||
| 88 | L | 42.6 | Very low | 40.3 | Very low | 165 Ų | 165 | 121.9 Ų | 121.9 | 86% | 0.864 | 83% | 0.831 | S | S | * | * | 63.4 | 131.6 | 83 | -67.9 | 169.9 | 0 | 0 | 0 | 110.8 | |||||
| 89 | A | 47.4 | Very low | 40.6 | Very low | 88 Ų | 88 | 119.9 Ų | 119.9 | 73% | 0.727 | 82% | 0.821 | S | S | * | * | cis | -167.2 | -166.6 | -1.5 | 0 | 0 | 0 | 0 | 0 | 105 | ||||
| 90 | P | 46.3 | Very low | 41.1 | Very low | 116 Ų | 116 | 124.2 Ų | 124.2 | 75% | 0.753 | 83% | 0.827 | S | S | * | * | -111.8 | 155.2 | -113.9 | 21.6 | 0.7 | 0 | 0 | 0 | 115.5 | |||||
| 91 | L | 40.7 | Very low | 41.7 | Very low | 181 Ų | 181 | 119.7 Ų | 119.7 | 95% | 0.948 | 81% | 0.811 | S | S | * | * | 24.4 | 106.6 | 128.1 | -137.1 | 85 | 0 | 0 | 0 | 117.2 | |||||
| 92 | G | 40.2 | Very low | 42.8 | Very low | 67 Ų | 67 | 126.4 Ų | 126.4 | 69% | 0.691 | 81% | 0.812 | S | S | * | * | trans | -170.5 | 110.2 | 164.6 | 0 | 0 | 0 | 0 | 0 | 112.1 | ||||
| 93 | Q | 42.5 | Very low | 43.9 | Very low | 208 Ų | 208 | 126.4 Ų | 126.4 | 97% | 0.972 | 80% | 0.796 | S | S | * | * | trans | 67.2 | 116.9 | 161.7 | -81.8 | 163.5 | -45.7 | 0 | 0 | 119.6 | ||||
| 94 | G | 36.2 | Very low | 45.2 | Very low | 73 Ų | 73 | 128 Ų | 128 | 75% | 0.753 | 78% | 0.784 | S | S | * | * | trans | 146.3 | 53.7 | 150.2 | 0 | 0 | 0 | 0 | 0 | 116 | K96 | G94-K96 VanDerWaalsContact C-N 3.32Å; G94-K96 PolarHBondContact O-N 3.33Å | ||
| 95 | V | 41.1 | Very low | 46.6 | Very low | 148 Ų | 148 | 128.3 Ų | 128.3 | 90% | 0.897 | 77% | 0.765 | S | S | * | * | trans | -75.9 | 84.3 | 169.5 | -153.8 | 0 | 0 | 0 | 0 | 109.1 | ||||
| 96 | K | 42.3 | Very low | 47.9 | Very low | 211 Ų | 211 | 125.9 Ų | 125.9 | 92% | 0.917 | 75% | 0.752 | S | S | * | * | trans | -150.4 | 107.7 | 162.7 | -73.9 | -168.6 | 179 | 176.3 | 0 | 109.2 | G94 | G94-K96 VanDerWaalsContact C-N 3.32Å; G94-K96 PolarHBondContact O-N 3.33Å | ||
| 97 | G | 39.5 | Very low | 49.2 | Very low | 76 Ų | 76 | 123.8 Ų | 123.8 | 78% | 0.784 | 74% | 0.741 | S | S | * | * | trans | 123.3 | 68.3 | 169.2 | 0 | 0 | 0 | 0 | 0 | 114 | G99 | G97-G99 PolarHBondContact O-N 3.19Š| ||
| 98 | L | 36.9 | Very low | 50.6 | Low | 167 Ų | 167 | 121.4 Ų | 121.4 | 87% | 0.874 | 73% | 0.73 | S | S | * | * | trans | -68.5 | 75.2 | 161.3 | -129.6 | 86.2 | 0 | 0 | 0 | 108.3 | L100 | L98-L100 PolarHBondContact O-N 3.34Š| ||
| 99 | G | 42.9 | Very low | 51.9 | Low | 68 Ų | 68 | 118.7 Ų | 118.7 | 70% | 0.701 | 72% | 0.717 | S | S | * | * | trans | -79.6 | 108.4 | 176.1 | 0 | 0 | 0 | 0 | 0 | 110.5 | G97 G101 | G97-G99 PolarHBondContact O-N 3.19Å; G99-G101 PolarHBondContact O-N 3.14Å | ||
| 100 | L | 47.6 | Very low | 53 | Low | 161 Ų | 161 | 116.7 Ų | 116.7 | 84% | 0.843 | 70% | 0.7 | S | S | * | * | trans | -61.5 | 53.4 | 171.1 | -88.1 | 78 | 0 | 0 | 0 | 113.1 | L98 | L98-L100 PolarHBondContact O-N 3.34Š| ||
| 101 | G | 50.6 | Low | 54.3 | Low | 54 Ų | 54 | 113.3 Ų | 113.3 | 56% | 0.557 | 68% | 0.682 | S | S | * | * | trans | -102.6 | -9.4 | -175.2 | 0 | 0 | 0 | 0 | 0 | 115.9 | G99 | G99-G101 PolarHBondContact O-N 3.14Š| ||
| 102 | R | 59 | Low | 55.7 | Low | 218 Ų | 218 | 106.7 Ų | 106.7 | 82% | 0.823 | 65% | 0.653 | S | S | * | * | S | Bend | trans | -112.4 | -2.8 | -168.8 | -72.6 | -177.7 | 155.1 | -177.7 | -5.8 | 119.5 | ||
| 103 | P | 59.7 | Low | 57.2 | Low | 86 Ų | 86 | 112.6 Ų | 112.6 | 56% | 0.558 | 66% | 0.655 | S | S | * | * | H | α-helix | trans | -76.1 | -29.4 | 178.6 | 29.8 | -32.5 | 0 | 0 | 0 | 112.8 | A106 A107 | P103-A106 PolarHBondContact O-N 2.97Å; P103-A107 VanDerWaalsContact O-CB 3.27Å; P103-A107 WeakPolarHBondContact O-CB 3.4Å; P103-A107 PolarHBondContact O-N 3.45Å |
| 104 | L | 64.7 | Low | 58.7 | Low | 122 Ų | 122 | 110.9 Ų | 110.9 | 64% | 0.639 | 64% | 0.641 | S | S | * | * | H | α-helix | trans | -69.9 | -36.3 | -176.1 | -75.4 | 171.5 | 0 | 0 | 0 | 112.8 | A107 K108 | L104-A107 PolarHBondContact O-N 2.82Å; L104-K108 WeakPolarHBondContact O-CB 3.3Å; L104-K108 VanDerWaalsContact O-CG 3.24Å; L104-K108 WeakPolarHBondContact O-CG 3.4Å; L104-K108 PolarHBondContact O-N 3.08Å |
| 105 | D | 69.2 | Low | 60.5 | Low | 90 Ų | 90 | 115 Ų | 115 | 48% | 0.481 | 63% | 0.634 | S | S | . | * | H | α-helix | trans | -75.5 | -35.7 | 178.5 | -63.6 | -34.2 | 0 | 0 | 0 | 111.7 | K108 N109 | D105-K108 PolarHBondContact O-N 3.41Å; D105-N109 WeakPolarHBondContact O-CB 3.37Å; D105-N109 PolarHBondContact O-N 3.48Å; D105-N109 PolarHBondContact O-ND2 3.15Å |
| 106 | A | 68 | Low | 62 | Low | 64 Ų | 64 | 114.5 Ų | 114.5 | 53% | 0.529 | 62% | 0.621 | S | S | . | * | H | α-helix | trans | -64.3 | -41.7 | 170.9 | 0 | 0 | 0 | 0 | 0 | 111.7 | P103 N109 A110 | P103-A106 PolarHBondContact O-N 2.97Å; A106-N109 PolarHBondContact O-N 2.95Å; A106-A110 VanDerWaalsContact O-CB 3.31Å; A106-A110 WeakPolarHBondContact O-CB 3.45Å; A106-A110 PolarHBondContact O-N 3.31Å |
| 107 | A | 72.5 | Confident | 63.6 | Low | 55 Ų | 55 | 106.9 Ų | 106.9 | 46% | 0.455 | 60% | 0.598 | S | S | . | * | H | α-helix | trans | -67.8 | -40 | 176.7 | 0 | 0 | 0 | 0 | 0 | 112.5 | P103 L104 A110 A111 | P103-A107 VanDerWaalsContact O-CB 3.27Å; P103-A107 WeakPolarHBondContact O-CB 3.4Å; P103-A107 PolarHBondContact O-N 3.45Å; L104-A107 PolarHBondContact O-N 2.82Å; A107-A110 PolarHBondContact O-N 3.33Å; A107-A111 WeakPolarHBondContact O-CB 3.28Å; A107-A111 PolarHBondContact O-N 3.29Å |
| 108 | K | 72.1 | Confident | 65.4 | Low | 132 Ų | 132 | 106.8 Ų | 106.8 | 57% | 0.574 | 58% | 0.582 | S | S | * | * | H | α-helix | trans | -64.1 | -41.8 | 174.1 | -77.2 | 169.7 | 174.8 | 172.5 | 0 | 111.7 | L104 D105 A111 A112 | L104-K108 WeakPolarHBondContact O-CB 3.3Å; L104-K108 VanDerWaalsContact O-CG 3.24Å; L104-K108 WeakPolarHBondContact O-CG 3.4Å; L104-K108 PolarHBondContact O-N 3.08Å; D105-K108 PolarHBondContact O-N 3.41Å; K108-A111 PolarHBondContact O-N 3.31Å; K108-A112 VanDerWaalsContact O-CB 3.29Å; K108-A112 WeakPolarHBondContact O-CB 3.33Å; K108-A112 PolarHBondContact O-N 3.2Å |
| 109 | N | 70.5 | Confident | 67.3 | Low | 107 Ų | 107 | 99.9 Ų | 99.9 | 57% | 0.572 | 55% | 0.551 | S | S | * | * | H | α-helix | trans | -68.8 | -38.9 | 176.9 | -72.5 | -23.2 | 0 | 0 | 0 | 112.1 | D105 A106 A112 R113 | D105-N109 WeakPolarHBondContact O-CB 3.37Å; D105-N109 PolarHBondContact O-N 3.48Å; D105-N109 PolarHBondContact O-ND2 3.15Å; A106-N109 PolarHBondContact O-N 2.95Å; N109-A112 PolarHBondContact O-N 2.9Å; N109-R113 WeakPolarHBondContact O-CG 3.44Å; N109-R113 PolarHBondContact O-N 3Å |
| 110 | A | 70.6 | Confident | 68.9 | Low | 46 Ų | 46 | 102.2 Ų | 102.2 | 38% | 0.38 | 55% | 0.547 | S | S | . | . | H | α-helix | trans | -64.9 | -46.4 | 172.5 | 0 | 0 | 0 | 0 | 0 | 111.1 | A106 A107 A112 R113 Y114 | A106-A110 VanDerWaalsContact O-CB 3.31Å; A106-A110 WeakPolarHBondContact O-CB 3.45Å; A106-A110 PolarHBondContact O-N 3.31Å; A107-A110 PolarHBondContact O-N 3.33Å; A110-A112 VanDerWaalsContact C-N 3.3Å; A110-A112 PolarHBondContact O-N 3.48Å; A110-R113 PolarHBondContact O-N 3.4Å; A110-Y114 WeakPolarHBondContact O-CD2 3.29Å; A110-Y114 PolarHBondContact O-N 3.45Å |
| 111 | A | 73.4 | Confident | 70.4 | Confident | 45 Ų | 45 | 101.4 Ų | 101.4 | 37% | 0.372 | 54% | 0.539 | S | S | . | . | H | α-helix | trans | -62.2 | -36.5 | 176.3 | 0 | 0 | 0 | 0 | 0 | 112.2 | A107 K108 R115 | A107-A111 WeakPolarHBondContact O-CB 3.28Å; A107-A111 PolarHBondContact O-N 3.29Å; K108-A111 PolarHBondContact O-N 3.31Å; A111-R115 WeakPolarHBondContact O-CB 3.47Å; A111-R115 WeakPolarHBondContact O-CG 3.48Å; A111-R115 PolarHBondContact O-N 2.92Å |
| 112 | A | 70.5 | Confident | 71.7 | Confident | 42 Ų | 42 | 102.2 Ų | 102.2 | 35% | 0.347 | 53% | 0.533 | S | S | . | . | H | α-helix | trans | -63.3 | -48.4 | 173.7 | 0 | 0 | 0 | 0 | 0 | 111.2 | K108 N109 A110 Y114 R115 E116 | K108-A112 VanDerWaalsContact O-CB 3.29Å; K108-A112 WeakPolarHBondContact O-CB 3.33Å; K108-A112 PolarHBondContact O-N 3.2Å; N109-A112 PolarHBondContact O-N 2.9Å; A110-A112 VanDerWaalsContact C-N 3.3Å; A110-A112 PolarHBondContact O-N 3.48Å; A112-Y114 PolarHBondContact O-N 3.23Å; A112-R115 PolarHBondContact O-N 3.46Å; A112-E116 WeakPolarHBondContact O-CG 3.29Å; A112-E116 PolarHBondContact O-N 3.25Å |
| 113 | R | 71.3 | Confident | 72.5 | Confident | 191 Ų | 191 | 94.1 Ų | 94.1 | 72% | 0.721 | 50% | 0.504 | S | S | * | . | H | α-helix | trans | -62.9 | -39.6 | 176 | -70.7 | -172.2 | -174.3 | -175.7 | 3 | 112.9 | N109 A110 E116 A117 | N109-R113 WeakPolarHBondContact O-CG 3.44Å; N109-R113 PolarHBondContact O-N 3Å; A110-R113 PolarHBondContact O-N 3.4Å; R113-E116 PolarHBondContact O-N 2.91Å; R113-A117 WeakPolarHBondContact O-CB 3.48Å; R113-A117 PolarHBondContact O-N 3.31Å |
| 114 | Y | 74.4 | Confident | 73.4 | Confident | 173 Ų | 173 | 93 Ų | 93 | 68% | 0.678 | 50% | 0.502 | S | S | * | . | H | α-helix | trans | -64.8 | -40.9 | 174 | -92.2 | -78.7 | 0 | 0 | 0 | 111.8 | A110 A112 E116 A117 V118 | A110-Y114 WeakPolarHBondContact O-CD2 3.29Å; A110-Y114 PolarHBondContact O-N 3.45Å; A112-Y114 PolarHBondContact O-N 3.23Å; Y114-E116 VanDerWaalsContact C-N 3.34Å; Y114-E116 PolarHBondContact O-N 2.89Å; Y114-A117 PolarHBondContact O-N 2.94Å; Y114-V118 VanDerWaalsContact O-CB 3.25Å; Y114-V118 WeakPolarHBondContact O-CB 3.47Å; Y114-V118 WeakPolarHBondContact O-CG2 3.45Å; Y114-V118 PolarHBondContact O-N 3.44Å |
| 115 | R | 73.8 | Confident | 74.2 | Confident | 160 Ų | 160 | 92.8 Ų | 92.8 | 60% | 0.604 | 50% | 0.496 | S | S | * | . | H | α-helix | trans | -64 | -38.5 | 176.1 | -78.6 | 176.7 | -179.3 | -154.8 | 2.1 | 112.2 | A111 A112 G119 F236 | A111-R115 WeakPolarHBondContact O-CB 3.47Å; A111-R115 WeakPolarHBondContact O-CG 3.48Å; A111-R115 PolarHBondContact O-N 2.92Å; A112-R115 PolarHBondContact O-N 3.46Å; R115-G119 WeakPolarHBondContact O-CA 3.49Å; R115-G119 PolarHBondContact O-N 2.91Å; R115-F236 HydrophobicContact CB-CE2 4.42Å; R115-F236 HydrophobicContact CB-CZ 4.11Å; R115-F236 HydrophobicContact CG-CZ 4.06Å |
| 116 | E | 71.8 | Confident | 74.6 | Confident | 136 Ų | 136 | 92.1 Ų | 92.1 | 64% | 0.636 | 49% | 0.487 | S | S | * | . | H | α-helix | trans | -67.2 | -46.9 | 175.7 | -73.3 | 175 | -177.4 | 0 | 0 | 111.7 | A112 R113 Y114 G119 L120 | A112-E116 WeakPolarHBondContact O-CG 3.29Å; A112-E116 PolarHBondContact O-N 3.25Å; R113-E116 PolarHBondContact O-N 2.91Å; Y114-E116 VanDerWaalsContact C-N 3.34Å; Y114-E116 PolarHBondContact O-N 2.89Å; E116-G119 PolarHBondContact O-N 3.39Å; E116-L120 WeakPolarHBondContact O-CG 3.39Å; E116-L120 PolarHBondContact O-N 3.29Å |
| 117 | A | 76.4 | Confident | 74.9 | Confident | 51 Ų | 51 | 96.9 Ų | 96.9 | 42% | 0.421 | 49% | 0.491 | S | S | . | . | H | α-helix | trans | -64.7 | -44.1 | 178.4 | 0 | 0 | 0 | 0 | 0 | 112.6 | R113 Y114 G119 L120 Q121 | R113-A117 WeakPolarHBondContact O-CB 3.48Å; R113-A117 PolarHBondContact O-N 3.31Å; Y114-A117 PolarHBondContact O-N 2.94Å; A117-G119 VanDerWaalsContact C-N 3.35Å; A117-L120 PolarHBondContact O-N 2.87Å; A117-Q121 PolarHBondContact O-N 3.21Å; A117-Q121 VanDerWaalsContact O-N 3.11Å |
| 118 | V | 78.1 | Confident | 75.3 | Confident | 74 Ų | 74 | 104.4 Ų | 104.4 | 45% | 0.448 | 51% | 0.508 | S | S | . | . | H | α-helix | trans | -66.9 | -38.9 | 175.3 | 173.5 | 0 | 0 | 0 | 0 | 110.3 | Y114 L120 Q121 V122 | Y114-V118 VanDerWaalsContact O-CB 3.25Å; Y114-V118 WeakPolarHBondContact O-CB 3.47Å; Y114-V118 WeakPolarHBondContact O-CG2 3.45Å; Y114-V118 PolarHBondContact O-N 3.44Å; V118-L120 VanDerWaalsContact C-N 3.33Å; V118-L120 PolarHBondContact O-N 3.43Å; V118-Q121 PolarHBondContact O-N 2.93Å; V118-V122 HydrophobicContact CG1-CG2 3.92Å; V118-V122 WeakPolarHBondContact O-CB 3.32Å; V118-V122 WeakPolarHBondContact O-CG2 3.38Å; V118-V122 PolarHBondContact O-N 2.84Å |
| 119 | G | 75.6 | Confident | 75.9 | Confident | 22 Ų | 22 | 100 Ų | 100 | 23% | 0.227 | 49% | 0.49 | C | S | . | . | H | α-helix | trans | -57.9 | -44.2 | 175.8 | 0 | 0 | 0 | 0 | 0 | 112.4 | R115 E116 A117 V122 E123 | R115-G119 WeakPolarHBondContact O-CA 3.49Å; R115-G119 PolarHBondContact O-N 2.91Å; E116-G119 PolarHBondContact O-N 3.39Å; A117-G119 VanDerWaalsContact C-N 3.35Å; G119-V122 PolarHBondContact O-N 3.38Å; G119-E123 VanDerWaalsContact O-CB 3.29Å; G119-E123 WeakPolarHBondContact O-CB 3.48Å; G119-E123 PolarHBondContact O-N 2.91Å |
| 120 | L | 76.2 | Confident | 76.4 | Confident | 118 Ų | 118 | 100.2 Ų | 100.2 | 62% | 0.618 | 48% | 0.484 | S | S | * | . | H | α-helix | trans | -66 | -40.3 | 175.8 | -71 | 168.8 | 0 | 0 | 0 | 112.4 | E116 A117 V118 E123 A124 | E116-L120 WeakPolarHBondContact O-CG 3.39Å; E116-L120 PolarHBondContact O-N 3.29Å; A117-L120 PolarHBondContact O-N 2.87Å; V118-L120 VanDerWaalsContact C-N 3.33Å; V118-L120 PolarHBondContact O-N 3.43Å; L120-E123 PolarHBondContact O-N 3.43Å; L120-A124 WeakPolarHBondContact O-CB 3.39Å; L120-A124 PolarHBondContact O-N 3.34Å |
| 121 | Q | 79.3 | Confident | 76.9 | Confident | 144 Ų | 144 | 104.9 Ų | 104.9 | 67% | 0.673 | 50% | 0.5 | S | S | * | . | H | α-helix | trans | -68.1 | -41 | 176.1 | -73.2 | -174.5 | 0.9 | 0 | 0 | 112.5 | A117 V118 A124 F125 | A117-Q121 PolarHBondContact O-N 3.21Å; A117-Q121 VanDerWaalsContact O-N 3.11Å; V118-Q121 PolarHBondContact O-N 2.93Å; Q121-A124 PolarHBondContact O-N 2.87Å; Q121-F125 VanDerWaalsContact O-CB 3.29Å; Q121-F125 WeakPolarHBondContact O-CB 3.33Å; Q121-F125 PolarHBondContact O-N 3.47Å |
| 122 | V | 77.8 | Confident | 77.5 | Confident | 71 Ų | 71 | 108.7 Ų | 108.7 | 43% | 0.43 | 51% | 0.513 | S | S | . | . | H | α-helix | trans | -65.2 | -41.1 | 175.2 | 171.8 | 0 | 0 | 0 | 0 | 110 | V118 G119 F125 W126 | V118-V122 HydrophobicContact CG1-CG2 3.92Å; V118-V122 WeakPolarHBondContact O-CB 3.32Å; V118-V122 WeakPolarHBondContact O-CG2 3.38Å; V118-V122 PolarHBondContact O-N 2.84Å; G119-V122 PolarHBondContact O-N 3.38Å; V122-F125 PolarHBondContact O-N 3.48Å; V122-W126 VanDerWaalsContact O-CB 3.25Å; V122-W126 WeakPolarHBondContact O-CB 3.42Å; V122-W126 PolarHBondContact O-N 3.49Å |
| 123 | E | 77 | Confident | 78.2 | Confident | 48 Ų | 48 | 110.2 Ų | 110.2 | 22% | 0.224 | 52% | 0.515 | C | S | . | . | H | α-helix | trans | -63.5 | -44.2 | 175.3 | -174.8 | 174 | -177.7 | 0 | 0 | 111.7 | G119 L120 W126 R127 | G119-E123 VanDerWaalsContact O-CB 3.29Å; G119-E123 WeakPolarHBondContact O-CB 3.48Å; G119-E123 PolarHBondContact O-N 2.91Å; L120-E123 PolarHBondContact O-N 3.43Å; E123-W126 PolarHBondContact O-N 3.04Å; E123-R127 WeakPolarHBondContact O-CG 3.32Å; E123-R127 PolarHBondContact O-N 3.24Å; E123-R127 IonicContact OE1-CZ 2.62Å; E123-R127 IonicContact OE1-NE 3.81Å; E123-R127 IonicContact OE1-NH2 3.91Å; E123-R127 PolarHBondContact OE1-NH2 3.45Å |
| 124 | A | 78.5 | Confident | 78.9 | Confident | 62 Ų | 62 | 104.4 Ų | 104.4 | 51% | 0.512 | 50% | 0.501 | S | S | . | . | H | α-helix | trans | -62.7 | -44.3 | 175.9 | 0 | 0 | 0 | 0 | 0 | 111.8 | L120 Q121 R127 R128 | L120-A124 WeakPolarHBondContact O-CB 3.39Å; L120-A124 PolarHBondContact O-N 3.34Å; Q121-A124 PolarHBondContact O-N 2.87Å; A124-R127 PolarHBondContact O-N 2.92Å; A124-R128 WeakPolarHBondContact O-CB 3.32Å; A124-R128 PolarHBondContact O-N 3.44Å; A124-R128 VanDerWaalsContact O-N 3.09Å |
| 125 | F | 80.6 | Confident | 79.6 | Confident | 117 Ų | 117 | 97.9 Ų | 97.9 | 51% | 0.513 | 49% | 0.486 | S | S | . | . | H | α-helix | trans | -63.2 | -43.9 | 176.1 | -178.2 | -95.3 | 0 | 0 | 0 | 111.6 | Q121 V122 R128 N129 L133 | Q121-F125 VanDerWaalsContact O-CB 3.29Å; Q121-F125 WeakPolarHBondContact O-CB 3.33Å; Q121-F125 PolarHBondContact O-N 3.47Å; V122-F125 PolarHBondContact O-N 3.48Å; F125-R128 PolarHBondContact O-N 3.44Å; F125-N129 WeakPolarHBondContact CD2-ND2 3.34Å; F125-N129 HydrophobicContact CE1-CB 4.34Å; F125-N129 WeakPolarHBondContact CE2-ND2 3.43Å; F125-N129 HydrophobicContact CZ-CB 4.31Å; F125-N129 WeakPolarHBondContact CZ-ND2 3.29Å; F125-N129 WeakPolarHBondContact O-CB 3.39Å; F125-N129 PolarHBondContact O-N 3.08Å; F125-L133 HydrophobicContact CD1-CD1 4.27Å; F125-L133 HydrophobicContact CE1-CD1 4.05Å |
| 126 | W | 78.1 | Confident | 80.5 | Confident | 76 Ų | 76 | 93 Ų | 93 | 29% | 0.288 | 48% | 0.479 | S | S | . | . | H | α-helix | trans | -66.5 | -39.9 | -179 | -157.4 | 3.3 | 0 | 0 | 0 | 111.6 | V122 E123 Y130 L133 P231 F238 | V122-W126 VanDerWaalsContact O-CB 3.25Å; V122-W126 WeakPolarHBondContact O-CB 3.42Å; V122-W126 PolarHBondContact O-N 3.49Å; E123-W126 PolarHBondContact O-N 3.04Å; W126-Y130 WeakPolarHBondContact O-CA 3.39Å; W126-Y130 WeakPolarHBondContact O-CB 3.21Å; W126-Y130 PolarHBondContact O-N 3.31Å; W126-L133 HydrophobicContact CG-CD1 4.12Å; W126-P231 HydrophobicContact CD2-CG 4.46Å; W126-P231 HydrophobicContact CE3-CB 4.37Å; W126-P231 HydrophobicContact CZ3-CB 4.41Å; W126-F238 HydrophobicContact CE3-CE2 4.27Å; W126-F238 AromaticContact CH2-CD2 3.34Å; W126-F238 HydrophobicContact CH2-CD2 3.34Å; W126-F238 AromaticContact CH2-CE2 2.94Å; W126-F238 HydrophobicContact CH2-CE2 2.94Å; W126-F238 HydrophobicContact CH2-CG 4.36Å; W126-F238 AromaticContact CH2-CZ 3.71Å; W126-F238 HydrophobicContact CH2-CZ 3.71Å; W126-F238 HydrophobicContact CZ2-CD2 4.41Å; W126-F238 AromaticContact CZ2-CE2 3.63Å; W126-F238 HydrophobicContact CZ2-CE2 3.63Å; W126-F238 HydrophobicContact CZ2-CZ 4.02Å; W126-F238 AromaticContact CZ3-CD2 3.48Å; W126-F238 HydrophobicContact CZ3-CD2 3.48Å; W126-F238 VanDerWaalsContact CZ3-CD2 3.48Å; W126-F238 AromaticContact CZ3-CE2 3.3Å; W126-F238 HydrophobicContact CZ3-CE2 3.3Å; W126-F238 HydrophobicContact CZ3-CZ 4.42Å |
| 127 | R | 75.5 | Confident | 81.4 | Confident | 164 Ų | 164 | 88.1 Ų | 88.1 | 62% | 0.619 | 47% | 0.466 | S | S | * | . | H | α-helix | trans | -63.6 | -41.3 | 174.3 | -74.3 | -176.3 | -170.8 | -175.8 | 6.6 | 112.1 | E123 A124 | E123-R127 WeakPolarHBondContact O-CG 3.32Å; E123-R127 PolarHBondContact O-N 3.24Å; E123-R127 IonicContact OE1-CZ 2.62Å; E123-R127 IonicContact OE1-NE 3.81Å; E123-R127 IonicContact OE1-NH2 3.91Å; E123-R127 PolarHBondContact OE1-NH2 3.45Å; A124-R127 PolarHBondContact O-N 2.92Å |
| 128 | R | 80.5 | Confident | 82.1 | Confident | 214 Ų | 214 | 87.5 Ų | 87.5 | 81% | 0.808 | 46% | 0.461 | S | S | * | . | H | α-helix | trans | -69.2 | -40 | 179.5 | -172.9 | 173.1 | -178.6 | 168 | 1 | 112.6 | A124 F125 | A124-R128 WeakPolarHBondContact O-CB 3.32Å; A124-R128 PolarHBondContact O-N 3.44Å; A124-R128 VanDerWaalsContact O-N 3.09Å; F125-R128 PolarHBondContact O-N 3.44Å |
| 129 | N | 83.5 | Confident | 82.8 | Confident | 38 Ų | 38 | 88 Ų | 88 | 20% | 0.203 | 46% | 0.464 | C | S | . | . | H | α-helix | trans | -115 | 19.4 | -170.5 | -63.8 | -38.5 | 0 | 0 | 0 | 113.8 | F125 M131 L132 L133 | F125-N129 WeakPolarHBondContact CD2-ND2 3.34Å; F125-N129 HydrophobicContact CE1-CB 4.34Å; F125-N129 WeakPolarHBondContact CE2-ND2 3.43Å; F125-N129 HydrophobicContact CZ-CB 4.31Å; F125-N129 WeakPolarHBondContact CZ-ND2 3.29Å; F125-N129 WeakPolarHBondContact O-CB 3.39Å; F125-N129 PolarHBondContact O-N 3.08Å; N129-M131 VanDerWaalsContact C-N 3.27Å; N129-M131 PolarHBondContact O-N 2.89Å; N129-L132 PolarHBondContact O-N 3.28Å; N129-L133 PolarHBondContact O-N 3.47Å |
| 130 | Y | 80.9 | Confident | 83.7 | Confident | 112 Ų | 112 | 91.6 Ų | 91.6 | 44% | 0.439 | 48% | 0.481 | S | S | . | . | H | α-helix | trans | -52.7 | -43.9 | -177.8 | 153.5 | -98.5 | 0 | 0 | 0 | 112.3 | W126 L132 L133 V134 | W126-Y130 WeakPolarHBondContact O-CA 3.39Å; W126-Y130 WeakPolarHBondContact O-CB 3.21Å; W126-Y130 PolarHBondContact O-N 3.31Å; Y130-L132 PolarHBondContact O-N 2.88Å; Y130-L133 PolarHBondContact O-N 2.95Å; Y130-V134 HydrophobicContact CD2-CG2 3.68Å; Y130-V134 HydrophobicContact CE2-CG2 3.28Å; Y130-V134 HydrophobicContact CG-CG2 4.48Å; Y130-V134 WeakPolarHBondContact O-CB 3.28Å; Y130-V134 VanDerWaalsContact O-CG2 3.31Å; Y130-V134 WeakPolarHBondContact O-CG2 3.4Å; Y130-V134 PolarHBondContact O-N 3.39Å |
| 131 | M | 80.9 | Confident | 84.5 | Confident | 144 Ų | 144 | 89.6 Ų | 89.6 | 71% | 0.709 | 47% | 0.474 | S | S | * | . | H | α-helix | trans | -63.7 | -39.9 | 179.9 | -70.3 | -63.1 | -137.1 | 0 | 0 | 112.4 | N129 G135 | N129-M131 VanDerWaalsContact C-N 3.27Å; N129-M131 PolarHBondContact O-N 2.89Å; M131-G135 PolarHBondContact O-N 2.99Å |
| 132 | L | 86.7 | Confident | 85.1 | Confident | 126 Ų | 126 | 83.4 Ų | 83.4 | 66% | 0.66 | 45% | 0.446 | S | S | * | . | H | α-helix | trans | -68.6 | -42.9 | 177.5 | -68.3 | 174.1 | 0 | 0 | 0 | 111.3 | N129 Y130 G135 A136 | N129-L132 PolarHBondContact O-N 3.28Å; Y130-L132 PolarHBondContact O-N 2.88Å; L132-G135 PolarHBondContact O-N 3.13Å; L132-A136 WeakPolarHBondContact O-CB 3.33Å; L132-A136 PolarHBondContact O-N 2.91Å |
| 133 | L | 86.2 | Confident | 85.7 | Confident | 73 Ų | 73 | 83.5 Ų | 83.5 | 38% | 0.382 | 44% | 0.444 | S | S | . | . | H | α-helix | trans | -64.9 | -41.6 | 177.9 | -73.6 | 165.1 | 0 | 0 | 0 | 111.9 | F125 W126 N129 Y130 G137 | F125-L133 HydrophobicContact CD1-CD1 4.27Å; F125-L133 HydrophobicContact CE1-CD1 4.05Å; W126-L133 HydrophobicContact CG-CD1 4.12Å; N129-L133 PolarHBondContact O-N 3.47Å; Y130-L133 PolarHBondContact O-N 2.95Å; L133-G137 PolarHBondContact O-N 3.29Å |
| 134 | V | 85.5 | Confident | 86.4 | Confident | 70 Ų | 70 | 83.7 Ų | 83.7 | 42% | 0.424 | 45% | 0.454 | S | S | . | . | H | α-helix | trans | -65 | -42.5 | 173.4 | 170.4 | 0 | 0 | 0 | 0 | 111.1 | Y130 G137 A138 | Y130-V134 HydrophobicContact CD2-CG2 3.68Å; Y130-V134 HydrophobicContact CE2-CG2 3.28Å; Y130-V134 HydrophobicContact CG-CG2 4.48Å; Y130-V134 WeakPolarHBondContact O-CB 3.28Å; Y130-V134 VanDerWaalsContact O-CG2 3.31Å; Y130-V134 WeakPolarHBondContact O-CG2 3.4Å; Y130-V134 PolarHBondContact O-N 3.39Å; V134-G137 PolarHBondContact O-N 3.46Å; V134-A138 WeakPolarHBondContact O-CB 3.46Å; V134-A138 PolarHBondContact O-N 3.18Å |
| 135 | G | 89.5 | Confident | 87 | Confident | 35 Ų | 35 | 83.5 Ų | 83.5 | 36% | 0.361 | 44% | 0.443 | S | S | . | . | H | α-helix | trans | -60.6 | -49.7 | 176.3 | 0 | 0 | 0 | 0 | 0 | 112.5 | M131 L132 G137 A138 V139 | M131-G135 PolarHBondContact O-N 2.99Å; L132-G135 PolarHBondContact O-N 3.13Å; G135-G137 PolarHBondContact O-N 3.36Å; G135-A138 WeakPolarHBondContact O-CB 3.33Å; G135-A138 PolarHBondContact O-N 2.9Å; G135-V139 WeakPolarHBondContact O-CG2 3.46Å; G135-V139 PolarHBondContact O-N 2.86Å |
| 136 | A | 92.1 | Very high | 87.3 | Confident | 57 Ų | 57 | 81.1 Ų | 81.1 | 47% | 0.471 | 43% | 0.431 | S | S | . | . | H | α-helix | trans | -61.4 | -43.9 | 176.7 | 0 | 0 | 0 | 0 | 0 | 111.8 | L132 A138 V139 V140 | L132-A136 WeakPolarHBondContact O-CB 3.33Å; L132-A136 PolarHBondContact O-N 2.91Å; A136-A138 VanDerWaalsContact C-N 3.34Å; A136-A138 PolarHBondContact O-N 3.48Å; A136-V139 PolarHBondContact O-N 3.47Å; A136-V140 WeakPolarHBondContact O-CG2 3.46Å; A136-V140 PolarHBondContact O-N 2.85Å |
| 137 | G | 91.2 | Very high | 87.7 | Confident | 35 Ų | 35 | 85.2 Ų | 85.2 | 36% | 0.361 | 45% | 0.447 | S | S | . | . | H | α-helix | trans | -59.5 | -42.3 | 174.7 | 0 | 0 | 0 | 0 | 0 | 112.8 | L133 V134 G135 V139 V140 V141 | L133-G137 PolarHBondContact O-N 3.29Å; V134-G137 PolarHBondContact O-N 3.46Å; G135-G137 PolarHBondContact O-N 3.36Å; G137-V139 VanDerWaalsContact C-N 3.34Å; G137-V139 PolarHBondContact O-N 3.31Å; G137-V140 PolarHBondContact O-N 3.45Å; G137-V141 WeakPolarHBondContact O-CG2 3.27Å; G137-V141 PolarHBondContact O-N 3.37Å |
| 138 | A | 91.2 | Very high | 88.2 | Confident | 37 Ų | 37 | 81.6 Ų | 81.6 | 31% | 0.306 | 44% | 0.443 | S | S | . | . | H | α-helix | trans | -62.8 | -39.1 | 176.5 | 0 | 0 | 0 | 0 | 0 | 112.2 | V134 G135 A136 V141 C142 V176 | V134-A138 WeakPolarHBondContact O-CB 3.46Å; V134-A138 PolarHBondContact O-N 3.18Å; G135-A138 WeakPolarHBondContact O-CB 3.33Å; G135-A138 PolarHBondContact O-N 2.9Å; A136-A138 VanDerWaalsContact C-N 3.34Å; A136-A138 PolarHBondContact O-N 3.48Å; A138-V141 PolarHBondContact O-N 2.93Å; A138-C142 VanDerWaalsContact O-CB 3.31Å; A138-C142 WeakPolarHBondContact O-CB 3.36Å; A138-C142 PolarHBondContact O-N 2.84Å; A138-V176 HydrophobicContact CB-CG1 3.95Å |
| 139 | V | 93 | Very high | 88.3 | Confident | 85 Ų | 85 | 73.2 Ų | 73.2 | 52% | 0.515 | 41% | 0.413 | S | S | . | . | H | α-helix | trans | -64.3 | -44.6 | 175 | 174.2 | 0 | 0 | 0 | 0 | 111.1 | G135 A136 G137 V141 C142 I143 | G135-V139 WeakPolarHBondContact O-CG2 3.46Å; G135-V139 PolarHBondContact O-N 2.86Å; A136-V139 PolarHBondContact O-N 3.47Å; G137-V139 VanDerWaalsContact C-N 3.34Å; G137-V139 PolarHBondContact O-N 3.31Å; V139-V141 PolarHBondContact O-N 2.9Å; V139-C142 WeakPolarHBondContact O-CB 3.48Å; V139-C142 PolarHBondContact O-N 2.89Å; V139-I143 HydrophobicContact CG1-CD1 3.88Å; V139-I143 HydrophobicContact CG1-CG1 4.44Å; V139-I143 WeakPolarHBondContact O-CG1 3.44Å; V139-I143 PolarHBondContact O-N 2.89Å |
| 140 | V | 93.6 | Very high | 88.1 | Confident | 98 Ų | 98 | 74.5 Ų | 74.5 | 59% | 0.594 | 42% | 0.417 | S | S | * | . | H | α-helix | trans | -60.3 | -46 | 177.1 | 173.2 | 0 | 0 | 0 | 0 | 111.1 | A136 G137 C142 I143 A144 | A136-V140 WeakPolarHBondContact O-CG2 3.46Å; A136-V140 PolarHBondContact O-N 2.85Å; G137-V140 PolarHBondContact O-N 3.45Å; V140-C142 VanDerWaalsContact C-N 3.32Å; V140-C142 PolarHBondContact O-N 3.26Å; V140-I143 PolarHBondContact O-N 2.89Å; V140-A144 WeakPolarHBondContact O-CB 3.49Å; V140-A144 PolarHBondContact O-N 3.28Å |
| 141 | V | 92.9 | Very high | 88.1 | Confident | 76 Ų | 76 | 70.8 Ų | 70.8 | 46% | 0.461 | 41% | 0.412 | S | S | . | . | H | α-helix | trans | -62 | -40.8 | 176 | 173 | 0 | 0 | 0 | 0 | 111.1 | G137 A138 V139 A144 L145 V176 | G137-V141 WeakPolarHBondContact O-CG2 3.27Å; G137-V141 PolarHBondContact O-N 3.37Å; A138-V141 PolarHBondContact O-N 2.93Å; V139-V141 PolarHBondContact O-N 2.9Å; V141-A144 PolarHBondContact O-N 3.49Å; V141-L145 HydrophobicContact CG1-CD1 3.89Å; V141-L145 HydrophobicContact CG1-CG 4.36Å; V141-L145 WeakPolarHBondContact O-CB 3.31Å; V141-L145 WeakPolarHBondContact O-CG 3.34Å; V141-L145 PolarHBondContact O-N 3.49Å; V141-V176 HydrophobicContact CG1-CG2 4.07Å |
| 142 | C | 92 | Very high | 88.1 | Confident | 14 Ų | 14 | 68.5 Ų | 68.5 | 10% | 0.095 | 40% | 0.402 | C | S | . | . | H | α-helix | trans | -61.9 | -44.1 | 176.3 | -173.1 | 0 | 0 | 0 | 0 | 112.1 | A138 V139 V140 W146 T173 V176 | A138-C142 VanDerWaalsContact O-CB 3.31Å; A138-C142 WeakPolarHBondContact O-CB 3.36Å; A138-C142 PolarHBondContact O-N 2.84Å; V139-C142 WeakPolarHBondContact O-CB 3.48Å; V139-C142 PolarHBondContact O-N 2.89Å; V140-C142 VanDerWaalsContact C-N 3.32Å; V140-C142 PolarHBondContact O-N 3.26Å; C142-W146 VanDerWaalsContact O-CB 3.28Å; C142-W146 WeakPolarHBondContact O-CB 3.47Å; C142-W146 PolarHBondContact O-N 3.42Å; C142-T173 WeakPolarHBondContact SG-CG2 3.4Å; C142-V176 HydrophobicContact CB-CG2 4.18Å |
| 143 | I | 90.7 | Very high | 87.6 | Confident | 73 Ų | 73 | 63.7 Ų | 63.7 | 37% | 0.374 | 38% | 0.38 | S | S | . | . | H | α-helix | trans | -64.5 | -44.2 | 176.7 | -66.6 | 166.7 | 0 | 0 | 0 | 110.1 | V139 V140 W146 R147 | V139-I143 HydrophobicContact CG1-CD1 3.88Å; V139-I143 HydrophobicContact CG1-CG1 4.44Å; V139-I143 WeakPolarHBondContact O-CG1 3.44Å; V139-I143 PolarHBondContact O-N 2.89Å; V140-I143 PolarHBondContact O-N 2.89Å; I143-W146 PolarHBondContact O-N 3.34Å; I143-R147 HydrophobicContact CG2-CG 4.4Å; I143-R147 VanDerWaalsContact O-CG 3.22Å; I143-R147 WeakPolarHBondContact O-CG 3.36Å; I143-R147 PolarHBondContact O-N 2.84Å |
| 144 | A | 92.2 | Very high | 86.9 | Confident | 52 Ų | 52 | 63.9 Ų | 63.9 | 43% | 0.43 | 39% | 0.388 | S | S | . | . | H | α-helix | trans | -60.9 | -48.2 | 177.9 | 0 | 0 | 0 | 0 | 0 | 111.8 | V140 V141 W146 R147 V148 | V140-A144 WeakPolarHBondContact O-CB 3.49Å; V140-A144 PolarHBondContact O-N 3.28Å; V141-A144 PolarHBondContact O-N 3.49Å; A144-W146 PolarHBondContact O-N 2.94Å; A144-R147 PolarHBondContact O-N 2.83Å; A144-V148 WeakPolarHBondContact O-CG2 3.39Å; A144-V148 PolarHBondContact O-N 3.23Å |
| 145 | L | 90.3 | Very high | 86.1 | Confident | 57 Ų | 57 | 65.3 Ų | 65.3 | 30% | 0.298 | 40% | 0.397 | S | S | . | . | H | α-helix | trans | -60.5 | -45.5 | 176 | -77.6 | 169.6 | 0 | 0 | 0 | 111.8 | V141 R147 V148 M149 A172 V176 | V141-L145 HydrophobicContact CG1-CD1 3.89Å; V141-L145 HydrophobicContact CG1-CG 4.36Å; V141-L145 WeakPolarHBondContact O-CB 3.31Å; V141-L145 WeakPolarHBondContact O-CG 3.34Å; V141-L145 PolarHBondContact O-N 3.49Å; L145-R147 VanDerWaalsContact C-N 3.3Å; L145-R147 PolarHBondContact O-N 3.15Å; L145-V148 PolarHBondContact O-N 3.35Å; L145-M149 WeakPolarHBondContact O-CB 3.36Å; L145-M149 VanDerWaalsContact O-CG 3.25Å; L145-M149 WeakPolarHBondContact O-CG 3.29Å; L145-M149 PolarHBondContact O-N 2.92Å; L145-A172 HydrophobicContact CB-CB 4.11Å; L145-V176 HydrophobicContact CD1-CG2 3.74Å |
| 146 | W | 86.3 | Confident | 84.9 | Confident | 67 Ų | 67 | 71.5 Ų | 71.5 | 25% | 0.254 | 41% | 0.414 | S | S | . | . | H | α-helix | trans | -58 | -43.8 | 176.4 | 172.2 | 39.2 | 0 | 0 | 0 | 111.7 | C142 I143 A144 M149 F150 K165 L169 A172 | C142-W146 VanDerWaalsContact O-CB 3.28Å; C142-W146 WeakPolarHBondContact O-CB 3.47Å; C142-W146 PolarHBondContact O-N 3.42Å; I143-W146 PolarHBondContact O-N 3.34Å; A144-W146 PolarHBondContact O-N 2.94Å; W146-M149 PolarHBondContact O-N 3.32Å; W146-F150 VanDerWaalsContact O-CB 3.28Å; W146-F150 WeakPolarHBondContact O-CB 3.35Å; W146-F150 PolarHBondContact O-N 2.99Å; W146-K165 PolarHBondContact NE1-O 3.12Å; W146-L169 HydrophobicContact CB-CD1 4.18Å; W146-L169 HydrophobicContact CD2-CB 4.42Å; W146-L169 HydrophobicContact CD2-CD1 3.81Å; W146-L169 HydrophobicContact CE3-CD1 3.88Å; W146-L169 HydrophobicContact CG-CB 4.33Å; W146-L169 HydrophobicContact CG-CD1 3.95Å; W146-A172 HydrophobicContact CB-CB 4.22Å |
| 147 | R | 87.5 | Confident | 83.4 | Confident | 163 Ų | 163 | 72.7 Ų | 72.7 | 62% | 0.615 | 42% | 0.415 | S | S | * | . | H | α-helix | trans | -64.6 | -42.8 | 177.6 | -69.1 | -70 | 174.7 | 79.7 | 0.8 | 112.4 | I143 A144 L145 G151 | I143-R147 HydrophobicContact CG2-CG 4.4Å; I143-R147 VanDerWaalsContact O-CG 3.22Å; I143-R147 WeakPolarHBondContact O-CG 3.36Å; I143-R147 PolarHBondContact O-N 2.84Å; A144-R147 PolarHBondContact O-N 2.83Å; L145-R147 VanDerWaalsContact C-N 3.3Å; L145-R147 PolarHBondContact O-N 3.15Å; R147-G151 PolarHBondContact O-N 3.37Å |
| 148 | V | 85.9 | Confident | 81.9 | Confident | 88 Ų | 88 | 75.3 Ų | 75.3 | 53% | 0.533 | 44% | 0.442 | S | S | . | . | H | α-helix | trans | -63.5 | -47.9 | 176.7 | 171.8 | 0 | 0 | 0 | 0 | 110.7 | A144 L145 G151 I152 | A144-V148 WeakPolarHBondContact O-CG2 3.39Å; A144-V148 PolarHBondContact O-N 3.23Å; L145-V148 PolarHBondContact O-N 3.35Å; V148-G151 PolarHBondContact O-N 2.82Å; V148-I152 HydrophobicContact CG1-CD1 3.73Å; V148-I152 VanDerWaalsContact O-CG1 3.29Å; V148-I152 WeakPolarHBondContact O-CG1 3.48Å; V148-I152 PolarHBondContact O-N 2.88Å |
| 149 | M | 83 | Confident | 80.1 | Confident | 38 Ų | 38 | 79.5 Ų | 79.5 | 19% | 0.187 | 46% | 0.459 | C | S | . | . | H | α-helix | trans | -64.3 | -43.4 | -180 | -70.8 | 177.7 | 74.8 | 0 | 0 | 112.4 | L145 W146 G151 I152 A153 F168 L171 A172 | L145-M149 WeakPolarHBondContact O-CB 3.36Å; L145-M149 VanDerWaalsContact O-CG 3.25Å; L145-M149 WeakPolarHBondContact O-CG 3.29Å; L145-M149 PolarHBondContact O-N 2.92Å; W146-M149 PolarHBondContact O-N 3.32Å; M149-G151 VanDerWaalsContact C-N 3.35Å; M149-I152 PolarHBondContact O-N 3.49Å; M149-A153 VanDerWaalsContact O-CB 3.23Å; M149-A153 WeakPolarHBondContact O-CB 3.48Å; M149-A153 PolarHBondContact O-N 3.23Å; M149-F168 HydrophobicContact CB-CD1 4.2Å; M149-F168 HydrophobicContact CE-CD1 3.76Å; M149-F168 HydrophobicContact CE-CE1 4.44Å; M149-L171 HydrophobicContact CE-CB 4.1Å; M149-L171 HydrophobicContact CE-CD1 3.59Å; M149-L171 HydrophobicContact CE-CD2 3.61Å; M149-L171 HydrophobicContact CE-CG 3.95Å; M149-L171 HydrophobicContact SD-CD2 4.24Å; M149-A172 HydrophobicContact SD-CB 4.36Å |
| 150 | F | 78.6 | Confident | 78.3 | Confident | 65 Ų | 65 | 79.5 Ų | 79.5 | 29% | 0.285 | 46% | 0.463 | S | S | . | . | H | α-helix | trans | -66.2 | -39 | 177 | -172.1 | -102.4 | 0 | 0 | 0 | 111.6 | W146 A153 S154 K165 F168 | W146-F150 VanDerWaalsContact O-CB 3.28Å; W146-F150 WeakPolarHBondContact O-CB 3.35Å; W146-F150 PolarHBondContact O-N 2.99Å; F150-A153 PolarHBondContact O-N 3.31Å; F150-S154 VanDerWaalsContact O-CB 3.31Å; F150-S154 WeakPolarHBondContact O-CB 3.49Å; F150-S154 PolarHBondContact O-N 2.83Å; F150-S154 PolarHBondContact O-OG 3.08Å; F150-K165 HydrophobicContact CD2-CG 3.88Å; F150-K165 HydrophobicContact CE2-CD 4.12Å; F150-K165 HydrophobicContact CE2-CG 3.32Å; F150-K165 HydrophobicContact CZ-CD 4.17Å; F150-K165 HydrophobicContact CZ-CG 3.87Å; F150-F168 HydrophobicContact CD2-CD2 4.38Å |
| 151 | G | 81.6 | Confident | 77 | Confident | 33 Ų | 33 | 82.1 Ų | 82.1 | 34% | 0.34 | 47% | 0.468 | S | S | . | . | H | α-helix | trans | -59.7 | -49.1 | 174.4 | 0 | 0 | 0 | 0 | 0 | 112.3 | R147 V148 M149 S154 | R147-G151 PolarHBondContact O-N 3.37Å; V148-G151 PolarHBondContact O-N 2.82Å; M149-G151 VanDerWaalsContact C-N 3.35Å; G151-S154 PolarHBondContact O-N 3.33Å; G151-S154 PolarHBondContact O-OG 3.46Å |
| 152 | I | 80.9 | Confident | 75.7 | Confident | 97 Ų | 97 | 80.5 Ų | 80.5 | 50% | 0.497 | 47% | 0.467 | S | S | . | . | H | α-helix | trans | -67 | -40.9 | 177.6 | -60.7 | 162.9 | 0 | 0 | 0 | 111.1 | V148 M149 S154 T155 F156 | V148-I152 HydrophobicContact CG1-CD1 3.73Å; V148-I152 VanDerWaalsContact O-CG1 3.29Å; V148-I152 WeakPolarHBondContact O-CG1 3.48Å; V148-I152 PolarHBondContact O-N 2.88Å; M149-I152 PolarHBondContact O-N 3.49Å; I152-S154 VanDerWaalsContact C-N 3.3Å; I152-S154 PolarHBondContact O-N 3.09Å; I152-T155 PolarHBondContact O-N 2.93Å; I152-T155 PolarHBondContact O-OG1 3.41Å; I152-F156 HydrophobicContact CG2-CD2 4.17Å; I152-F156 HydrophobicContact CG2-CE2 4.31Å; I152-F156 WeakPolarHBondContact O-CD2 3.22Å |
| 153 | A | 74.8 | Confident | 74.4 | Confident | 24 Ų | 24 | 87.2 Ų | 87.2 | 20% | 0.198 | 50% | 0.499 | C | S | . | . | H | α-helix | trans | -64.4 | -38 | 179.5 | 0 | 0 | 0 | 0 | 0 | 112 | M149 F150 T155 F156 V157 F168 | M149-A153 VanDerWaalsContact O-CB 3.23Å; M149-A153 WeakPolarHBondContact O-CB 3.48Å; M149-A153 PolarHBondContact O-N 3.23Å; F150-A153 PolarHBondContact O-N 3.31Å; A153-T155 PolarHBondContact O-N 3.36Å; A153-F156 PolarHBondContact O-N 3.43Å; A153-V157 PolarHBondContact O-N 3Å; A153-V157 VanDerWaalsContact O-N 3.09Å; A153-F168 HydrophobicContact CB-CD2 4.4Å; A153-F168 HydrophobicContact CB-CE1 4.09Å; A153-F168 HydrophobicContact CB-CE2 3.51Å; A153-F168 HydrophobicContact CB-CZ 3.32Å |
| 154 | S | 71.6 | Confident | 73.6 | Confident | 77 Ų | 77 | 85.1 Ų | 85.1 | 54% | 0.538 | 49% | 0.493 | S | S | . | . | H | α-helix | trans | -63.9 | -21 | 179.4 | 69.9 | 0 | 0 | 0 | 0 | 113.8 | F150 G151 I152 | F150-S154 VanDerWaalsContact O-CB 3.31Å; F150-S154 WeakPolarHBondContact O-CB 3.49Å; F150-S154 PolarHBondContact O-N 2.83Å; F150-S154 PolarHBondContact O-OG 3.08Å; G151-S154 PolarHBondContact O-N 3.33Å; G151-S154 PolarHBondContact O-OG 3.46Å; I152-S154 VanDerWaalsContact C-N 3.3Å; I152-S154 PolarHBondContact O-N 3.09Å |
| 155 | T | 70 | Confident | 72.8 | Confident | 100 Ų | 100 | 85.8 Ų | 85.8 | 61% | 0.613 | 49% | 0.486 | S | S | * | . | H | α-helix | trans | -87.7 | -24.3 | 177.3 | 59.4 | 0 | 0 | 0 | 0 | 113.6 | I152 A153 | I152-T155 PolarHBondContact O-N 2.93Å; I152-T155 PolarHBondContact O-OG1 3.41Å; A153-T155 PolarHBondContact O-N 3.36Å |
| 156 | F | 64.5 | Low | 72.4 | Confident | 166 Ų | 166 | 91.2 Ų | 91.2 | 73% | 0.728 | 50% | 0.504 | S | S | * | . | H | α-helix | trans | -107.6 | -23.4 | -172.7 | -73.9 | -75.4 | 0 | 0 | 0 | 114.6 | I152 A153 | I152-F156 HydrophobicContact CG2-CD2 4.17Å; I152-F156 HydrophobicContact CG2-CE2 4.31Å; I152-F156 WeakPolarHBondContact O-CD2 3.22Å; A153-F156 PolarHBondContact O-N 3.43Å |
| 157 | V | 59.8 | Low | 72.4 | Confident | 81 Ų | 81 | 90 Ų | 90 | 49% | 0.491 | 51% | 0.512 | S | S | . | . | trans | -144.9 | 120.9 | 179.8 | -149.1 | 0 | 0 | 0 | 0 | 111.2 | A153 L159 | A153-V157 PolarHBondContact O-N 3Å; A153-V157 VanDerWaalsContact O-N 3.09Å; V157-L159 HydrophobicContact CB-CB 4.38Å; V157-L159 HydrophobicContact CB-CD1 3.96Å; V157-L159 HydrophobicContact CB-CG 4.08Å; V157-L159 HydrophobicContact CG1-CB 4.19Å; V157-L159 HydrophobicContact CG1-CD1 3.49Å; V157-L159 VanDerWaalsContact CG1-CD1 3.49Å; V157-L159 HydrophobicContact CG1-CG 3.42Å; V157-L159 VanDerWaalsContact CG1-CG 3.42Å; V157-L159 HydrophobicContact CG2-CD1 4.49Å; V157-L159 PolarHBondContact O-N 3.06Å | ||
| 158 | G | 59.5 | Low | 72.1 | Confident | 91 Ų | 91 | 85 Ų | 85 | 94% | 0.938 | 50% | 0.495 | S | S | * | . | trans | -70.2 | 43.1 | 170.3 | 0 | 0 | 0 | 0 | 0 | 113.2 | S160 | G158-S160 PolarHBondContact O-N 3.25Š| ||
| 159 | L | 54.5 | Low | 72.2 | Confident | 124 Ų | 124 | 83.3 Ų | 83.3 | 65% | 0.649 | 48% | 0.483 | S | S | * | . | trans | -82.5 | 115.9 | -176.1 | -86.9 | 169.9 | 0 | 0 | 0 | 111.3 | V157 E161 | V157-L159 HydrophobicContact CB-CB 4.38Å; V157-L159 HydrophobicContact CB-CD1 3.96Å; V157-L159 HydrophobicContact CB-CG 4.08Å; V157-L159 HydrophobicContact CG1-CB 4.19Å; V157-L159 HydrophobicContact CG1-CD1 3.49Å; V157-L159 VanDerWaalsContact CG1-CD1 3.49Å; V157-L159 HydrophobicContact CG1-CG 3.42Å; V157-L159 VanDerWaalsContact CG1-CG 3.42Å; V157-L159 HydrophobicContact CG2-CD1 4.49Å; V157-L159 PolarHBondContact O-N 3.06Å; L159-E161 PolarHBondContact O-N 3.04Å | ||
| 160 | S | 55.1 | Low | 72.5 | Confident | 86 Ų | 86 | 84.1 Ų | 84.1 | 60% | 0.601 | 50% | 0.496 | S | S | * | . | trans | 18.1 | 96 | 161.3 | -167.8 | 0 | 0 | 0 | 0 | 115.8 | G158 G162 | G158-S160 PolarHBondContact O-N 3.25Å; S160-G162 PolarHBondContact O-N 3.16Å | ||
| 161 | E | 65 | Low | 73 | Confident | 152 Ų | 152 | 84.9 Ų | 84.9 | 71% | 0.71 | 50% | 0.502 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -58.5 | -11.5 | -170 | -130.9 | -172.6 | 148.6 | 0 | 0 | 116.5 | L159 K165 | L159-E161 PolarHBondContact O-N 3.04Å; E161-K165 WeakPolarHBondContact O-CD 3.45Å; E161-K165 WeakPolarHBondContact O-CE 3.46Å; E161-K165 PolarHBondContact O-NZ 2.75Å; E161-K165 IonicContact OE1-NZ 2.69Å |
| 162 | G | 66.5 | Low | 73.4 | Confident | 42 Ų | 42 | 83.3 Ų | 83.3 | 43% | 0.433 | 49% | 0.486 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -99.9 | -51.5 | -174.1 | 0 | 0 | 0 | 0 | 0 | 114.3 | S160 Y166 | S160-G162 PolarHBondContact O-N 3.16Å; G162-Y166 VanDerWaalsContact O-CD2 3.3Å; G162-Y166 WeakPolarHBondContact O-CD2 3.44Å; G162-Y166 WeakPolarHBondContact O-CE2 3.31Å |
| 163 | M | 65.1 | Low | 74 | Confident | 156 Ų | 156 | 82 Ų | 82 | 77% | 0.768 | 48% | 0.483 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -88.5 | -33.2 | -170.2 | -69.8 | -93.1 | -79.8 | 0 | 0 | 112.6 | K165 Y166 G167 | M163-K165 VanDerWaalsContact C-N 3.26Å; M163-K165 PolarHBondContact O-N 3.28Å; M163-Y166 PolarHBondContact O-N 2.69Å; M163-G167 PolarHBondContact O-N 3.49Å |
| 164 | A | 73.4 | Confident | 74.9 | Confident | 29 Ų | 29 | 82.8 Ų | 82.8 | 24% | 0.24 | 49% | 0.489 | C | S | . | . | H | α-helix | trans | -63.7 | -32.4 | -179.4 | 0 | 0 | 0 | 0 | 0 | 112.3 | Y166 G167 F168 | A164-Y166 VanDerWaalsContact C-N 3.31Å; A164-Y166 PolarHBondContact O-N 2.89Å; A164-G167 PolarHBondContact O-N 2.94Å; A164-G167 VanDerWaalsContact O-N 3.13Å; A164-F168 HydrophobicContact CB-CD2 4.49Å; A164-F168 HydrophobicContact CB-CE2 4.21Å; A164-F168 WeakPolarHBondContact O-CD2 3.36Å; A164-F168 PolarHBondContact O-N 3.23Å |
| 165 | K | 74.4 | Confident | 75.9 | Confident | 65 Ų | 65 | 83.7 Ų | 83.7 | 28% | 0.283 | 49% | 0.486 | S | S | . | . | H | α-helix | trans | -56.3 | -43.8 | 177 | -74.1 | 175.6 | -177.9 | 152.9 | 0 | 112.2 | W146 F150 E161 M163 L169 | W146-K165 PolarHBondContact NE1-O 3.12Å; F150-K165 HydrophobicContact CD2-CG 3.88Å; F150-K165 HydrophobicContact CE2-CD 4.12Å; F150-K165 HydrophobicContact CE2-CG 3.32Å; F150-K165 HydrophobicContact CZ-CD 4.17Å; F150-K165 HydrophobicContact CZ-CG 3.87Å; E161-K165 WeakPolarHBondContact O-CD 3.45Å; E161-K165 WeakPolarHBondContact O-CE 3.46Å; E161-K165 PolarHBondContact O-NZ 2.75Å; E161-K165 IonicContact OE1-NZ 2.69Å; M163-K165 VanDerWaalsContact C-N 3.26Å; M163-K165 PolarHBondContact O-N 3.28Å; K165-L169 PolarHBondContact O-N 3.19Å; K165-L169 VanDerWaalsContact O-N 3.16Å |
| 166 | Y | 82.6 | Confident | 77 | Confident | 172 Ų | 172 | 80.2 Ų | 80.2 | 68% | 0.675 | 47% | 0.465 | S | S | * | . | H | α-helix | trans | -74.6 | -33 | 178.1 | -61 | -70.1 | 0 | 0 | 0 | 112.2 | G162 M163 A164 L169 A170 | G162-Y166 VanDerWaalsContact O-CD2 3.3Å; G162-Y166 WeakPolarHBondContact O-CD2 3.44Å; G162-Y166 WeakPolarHBondContact O-CE2 3.31Å; M163-Y166 PolarHBondContact O-N 2.69Å; A164-Y166 VanDerWaalsContact C-N 3.31Å; A164-Y166 PolarHBondContact O-N 2.89Å; Y166-L169 PolarHBondContact O-N 2.87Å; Y166-A170 WeakPolarHBondContact O-CB 3.36Å; Y166-A170 PolarHBondContact O-N 2.62Å |
| 167 | G | 85 | Confident | 78.4 | Confident | 42 Ų | 42 | 74.8 Ų | 74.8 | 43% | 0.433 | 45% | 0.45 | S | S | . | . | H | α-helix | trans | -62 | -46.5 | 173.3 | 0 | 0 | 0 | 0 | 0 | 112.8 | M163 A164 A170 L171 | M163-G167 PolarHBondContact O-N 3.49Å; A164-G167 PolarHBondContact O-N 2.94Å; A164-G167 VanDerWaalsContact O-N 3.13Å; G167-A170 WeakPolarHBondContact O-CB 3.46Å; G167-A170 PolarHBondContact O-N 3.27Å; G167-L171 PolarHBondContact O-N 3.05Å |
| 168 | F | 83 | Confident | 80.1 | Confident | 56 Ų | 56 | 77.7 Ų | 77.7 | 25% | 0.246 | 46% | 0.457 | C | S | . | . | H | α-helix | trans | -66.1 | -37.1 | 175.5 | -71.3 | -62.5 | 0 | 0 | 0 | 112.7 | M149 F150 A153 A164 L171 A172 | M149-F168 HydrophobicContact CB-CD1 4.2Å; M149-F168 HydrophobicContact CE-CD1 3.76Å; M149-F168 HydrophobicContact CE-CE1 4.44Å; F150-F168 HydrophobicContact CD2-CD2 4.38Å; A153-F168 HydrophobicContact CB-CD2 4.4Å; A153-F168 HydrophobicContact CB-CE1 4.09Å; A153-F168 HydrophobicContact CB-CE2 3.51Å; A153-F168 HydrophobicContact CB-CZ 3.32Å; A164-F168 HydrophobicContact CB-CD2 4.49Å; A164-F168 HydrophobicContact CB-CE2 4.21Å; A164-F168 WeakPolarHBondContact O-CD2 3.36Å; A164-F168 PolarHBondContact O-N 3.23Å; F168-L171 PolarHBondContact O-N 2.84Å; F168-A172 WeakPolarHBondContact O-CB 3.36Å; F168-A172 PolarHBondContact O-N 2.89Å |
| 169 | L | 87.3 | Confident | 81.6 | Confident | 53 Ų | 53 | 75.9 Ų | 75.9 | 28% | 0.277 | 43% | 0.433 | S | S | . | . | H | α-helix | trans | -62.1 | -45.9 | 172.8 | -177.8 | 66.9 | 0 | 0 | 0 | 110.8 | W146 K165 Y166 L171 A172 T173 | W146-L169 HydrophobicContact CB-CD1 4.18Å; W146-L169 HydrophobicContact CD2-CB 4.42Å; W146-L169 HydrophobicContact CD2-CD1 3.81Å; W146-L169 HydrophobicContact CE3-CD1 3.88Å; W146-L169 HydrophobicContact CG-CB 4.33Å; W146-L169 HydrophobicContact CG-CD1 3.95Å; K165-L169 PolarHBondContact O-N 3.19Å; K165-L169 VanDerWaalsContact O-N 3.16Å; Y166-L169 PolarHBondContact O-N 2.87Å; L169-L171 VanDerWaalsContact C-N 3.33Å; L169-L171 PolarHBondContact O-N 2.82Å; L169-A172 PolarHBondContact O-N 2.9Å; L169-T173 VanDerWaalsContact O-CG2 3.31Å; L169-T173 WeakPolarHBondContact O-CG2 3.46Å; L169-T173 PolarHBondContact O-N 2.74Å; L169-T173 PolarHBondContact O-OG1 3.44Å |
| 170 | A | 89.6 | Confident | 83.3 | Confident | 56 Ų | 56 | 71.9 Ų | 71.9 | 46% | 0.463 | 42% | 0.422 | S | S | . | . | H | α-helix | trans | -58.6 | -44.2 | 176.1 | 0 | 0 | 0 | 0 | 0 | 111.4 | Y166 G167 T173 A174 | Y166-A170 WeakPolarHBondContact O-CB 3.36Å; Y166-A170 PolarHBondContact O-N 2.62Å; G167-A170 WeakPolarHBondContact O-CB 3.46Å; G167-A170 PolarHBondContact O-N 3.27Å; A170-T173 WeakPolarHBondContact CA-OG1 3.39Å; A170-T173 PolarHBondContact O-N 2.84Å; A170-T173 PolarHBondContact O-OG1 2.84Å; A170-A174 WeakPolarHBondContact O-CB 3.19Å; A170-A174 PolarHBondContact O-N 3.33Å |
| 171 | L | 89.3 | Confident | 85 | Confident | 81 Ų | 81 | 73 Ų | 73 | 42% | 0.424 | 42% | 0.419 | S | S | . | . | H | α-helix | trans | -62 | -47.5 | 175.7 | -161.2 | 170.8 | 0 | 0 | 0 | 111.4 | M149 G167 F168 L169 T173 A174 M175 | M149-L171 HydrophobicContact CE-CB 4.1Å; M149-L171 HydrophobicContact CE-CD1 3.59Å; M149-L171 HydrophobicContact CE-CD2 3.61Å; M149-L171 HydrophobicContact CE-CG 3.95Å; M149-L171 HydrophobicContact SD-CD2 4.24Å; G167-L171 PolarHBondContact O-N 3.05Å; F168-L171 PolarHBondContact O-N 2.84Å; L169-L171 VanDerWaalsContact C-N 3.33Å; L169-L171 PolarHBondContact O-N 2.82Å; L171-T173 VanDerWaalsContact C-N 3.35Å; L171-T173 PolarHBondContact O-N 2.86Å; L171-A174 WeakPolarHBondContact O-CB 3.4Å; L171-A174 PolarHBondContact O-N 3.41Å; L171-A174 VanDerWaalsContact O-N 3.15Å; L171-M175 HydrophobicContact CD2-CG 3.66Å; L171-M175 HydrophobicContact CD2-SD 3.38Å; L171-M175 WeakPolarHBondContact CD2-SD 3.43Å; L171-M175 PolarHBondContact O-N 2.92Å |
| 172 | A | 89.9 | Confident | 86.2 | Confident | 0 Ų | 0 | 72.1 Ų | 72.1 | 0% | 0 | 41% | 0.41 | C | S | . | . | H | α-helix | trans | -59.2 | -44.9 | 176.9 | 0 | 0 | 0 | 0 | 0 | 111.7 | L145 W146 M149 F168 L169 A174 M175 V176 | L145-A172 HydrophobicContact CB-CB 4.11Å; W146-A172 HydrophobicContact CB-CB 4.22Å; M149-A172 HydrophobicContact SD-CB 4.36Å; F168-A172 WeakPolarHBondContact O-CB 3.36Å; F168-A172 PolarHBondContact O-N 2.89Å; L169-A172 PolarHBondContact O-N 2.9Å; A172-A174 VanDerWaalsContact C-N 3.34Å; A172-A174 PolarHBondContact O-N 3.23Å; A172-M175 PolarHBondContact O-N 2.84Å; A172-V176 WeakPolarHBondContact O-CG2 3.33Å; A172-V176 PolarHBondContact O-N 3.34Å |
| 173 | T | 92.9 | Very high | 87.1 | Confident | 70 Ų | 70 | 73.3 Ų | 73.3 | 43% | 0.429 | 41% | 0.409 | S | S | . | . | H | α-helix | trans | -62 | -41 | 175.4 | 61.4 | 0 | 0 | 0 | 0 | 111.8 | C142 L169 A170 L171 V176 A177 | C142-T173 WeakPolarHBondContact SG-CG2 3.4Å; L169-T173 VanDerWaalsContact O-CG2 3.31Å; L169-T173 WeakPolarHBondContact O-CG2 3.46Å; L169-T173 PolarHBondContact O-N 2.74Å; L169-T173 PolarHBondContact O-OG1 3.44Å; A170-T173 WeakPolarHBondContact CA-OG1 3.39Å; A170-T173 PolarHBondContact O-N 2.84Å; A170-T173 PolarHBondContact O-OG1 2.84Å; L171-T173 VanDerWaalsContact C-N 3.35Å; L171-T173 PolarHBondContact O-N 2.86Å; T173-V176 PolarHBondContact O-N 3.44Å; T173-A177 VanDerWaalsContact O-CB 3.28Å; T173-A177 WeakPolarHBondContact O-CB 3.42Å; T173-A177 PolarHBondContact O-N 3.34Å |
| 174 | A | 93.6 | Very high | 88 | Confident | 40 Ų | 40 | 74.4 Ų | 74.4 | 33% | 0.331 | 40% | 0.404 | S | S | . | . | H | α-helix | trans | -64.1 | -45.7 | 177.2 | 0 | 0 | 0 | 0 | 0 | 111.3 | A170 L171 A172 V176 A177 F178 | A170-A174 WeakPolarHBondContact O-CB 3.19Å; A170-A174 PolarHBondContact O-N 3.33Å; L171-A174 WeakPolarHBondContact O-CB 3.4Å; L171-A174 PolarHBondContact O-N 3.41Å; L171-A174 VanDerWaalsContact O-N 3.15Å; A172-A174 VanDerWaalsContact C-N 3.34Å; A172-A174 PolarHBondContact O-N 3.23Å; A174-V176 PolarHBondContact O-N 2.95Å; A174-A177 PolarHBondContact O-N 3.5Å; A174-F178 HydrophobicContact CB-CD2 4.44Å; A174-F178 WeakPolarHBondContact O-CB 3.25Å; A174-F178 WeakPolarHBondContact O-CD2 3.37Å; A174-F178 PolarHBondContact O-N 3.04Å |
| 175 | M | 93 | Very high | 88.5 | Confident | 96 Ų | 96 | 76.7 Ų | 76.7 | 47% | 0.473 | 42% | 0.419 | S | S | . | . | H | α-helix | trans | -59.7 | -46.1 | 176.6 | -76.5 | 179.7 | 78.3 | 0 | 0 | 112.1 | L171 A172 A177 F178 A179 | L171-M175 HydrophobicContact CD2-CG 3.66Å; L171-M175 HydrophobicContact CD2-SD 3.38Å; L171-M175 WeakPolarHBondContact CD2-SD 3.43Å; L171-M175 PolarHBondContact O-N 2.92Å; A172-M175 PolarHBondContact O-N 2.84Å; M175-A177 VanDerWaalsContact C-N 3.34Å; M175-F178 PolarHBondContact O-N 3.17Å; M175-A179 VanDerWaalsContact O-CB 3.25Å; M175-A179 WeakPolarHBondContact O-CB 2.97Å; M175-A179 PolarHBondContact O-N 3.01Å |
| 176 | V | 93.7 | Very high | 89 | Confident | 27 Ų | 27 | 78.7 Ų | 78.7 | 16% | 0.164 | 42% | 0.424 | C | S | . | . | H | α-helix | trans | -64.6 | -41.4 | 177.9 | 174.3 | 0 | 0 | 0 | 0 | 110.7 | A138 V141 C142 L145 A172 T173 A174 A179 G180 | A138-V176 HydrophobicContact CB-CG1 3.95Å; V141-V176 HydrophobicContact CG1-CG2 4.07Å; C142-V176 HydrophobicContact CB-CG2 4.18Å; L145-V176 HydrophobicContact CD1-CG2 3.74Å; A172-V176 WeakPolarHBondContact O-CG2 3.33Å; A172-V176 PolarHBondContact O-N 3.34Å; T173-V176 PolarHBondContact O-N 3.44Å; A174-V176 PolarHBondContact O-N 2.95Å; V176-A179 PolarHBondContact O-N 2.88Å; V176-G180 PolarHBondContact O-N 3.24Å |
| 177 | A | 93.6 | Very high | 88.9 | Confident | 52 Ų | 52 | 76 Ų | 76 | 43% | 0.43 | 42% | 0.416 | S | S | . | . | H | α-helix | trans | -62.5 | -47.4 | 175.4 | 0 | 0 | 0 | 0 | 0 | 112 | T173 A174 M175 G180 M181 | T173-A177 VanDerWaalsContact O-CB 3.28Å; T173-A177 WeakPolarHBondContact O-CB 3.42Å; T173-A177 PolarHBondContact O-N 3.34Å; A174-A177 PolarHBondContact O-N 3.5Å; M175-A177 VanDerWaalsContact C-N 3.34Å; A177-G180 PolarHBondContact O-N 2.9Å; A177-M181 WeakPolarHBondContact O-CG 3.39Å; A177-M181 PolarHBondContact O-N 2.99Å |
| 178 | F | 94.7 | Very high | 88.9 | Confident | 142 Ų | 142 | 76.3 Ų | 76.3 | 62% | 0.623 | 41% | 0.41 | S | S | * | . | H | α-helix | trans | -61.7 | -44.4 | 175.8 | -83.4 | -65.4 | 0 | 0 | 0 | 112.1 | A174 M175 G180 M181 Y182 | A174-F178 HydrophobicContact CB-CD2 4.44Å; A174-F178 WeakPolarHBondContact O-CB 3.25Å; A174-F178 WeakPolarHBondContact O-CD2 3.37Å; A174-F178 PolarHBondContact O-N 3.04Å; M175-F178 PolarHBondContact O-N 3.17Å; F178-G180 VanDerWaalsContact C-N 3.31Å; F178-G180 PolarHBondContact O-N 3.35Å; F178-M181 HydrophobicContact CD1-CE 3.71Å; F178-M181 HydrophobicContact CE1-CE 4.04Å; F178-M181 HydrophobicContact CG-CE 4.24Å; F178-M181 PolarHBondContact O-N 3.41Å; F178-Y182 VanDerWaalsContact O-CB 3.26Å; F178-Y182 WeakPolarHBondContact O-CB 3.27Å; F178-Y182 PolarHBondContact O-N 2.61Å |
| 179 | A | 92.4 | Very high | 89.2 | Confident | 53 Ų | 53 | 74.1 Ų | 74.1 | 44% | 0.438 | 40% | 0.401 | S | S | . | . | H | α-helix | trans | -61.8 | -40.6 | 175.7 | 0 | 0 | 0 | 0 | 0 | 111.5 | M175 V176 Y182 T183 | M175-A179 VanDerWaalsContact O-CB 3.25Å; M175-A179 WeakPolarHBondContact O-CB 2.97Å; M175-A179 PolarHBondContact O-N 3.01Å; V176-A179 PolarHBondContact O-N 2.88Å; A179-Y182 PolarHBondContact O-N 2.99Å; A179-T183 WeakPolarHBondContact O-CB 3.31Å; A179-T183 PolarHBondContact O-N 3.13Å; A179-T183 PolarHBondContact O-OG1 3.06Å |
| 180 | G | 90 | Very high | 89.3 | Confident | 40 Ų | 40 | 75.2 Ų | 75.2 | 41% | 0.412 | 41% | 0.407 | S | S | . | . | H | α-helix | trans | -62 | -47.9 | 174.1 | 0 | 0 | 0 | 0 | 0 | 112.5 | V176 A177 F178 T183 R184 | V176-G180 PolarHBondContact O-N 3.24Å; A177-G180 PolarHBondContact O-N 2.9Å; F178-G180 VanDerWaalsContact C-N 3.31Å; F178-G180 PolarHBondContact O-N 3.35Å; G180-T183 PolarHBondContact O-N 3.23Å; G180-R184 VanDerWaalsContact O-CB 3.26Å; G180-R184 WeakPolarHBondContact O-CB 3.3Å; G180-R184 PolarHBondContact O-N 2.9Å |
| 181 | M | 89.9 | Confident | 89.5 | Confident | 110 Ų | 110 | 73.5 Ų | 73.5 | 54% | 0.542 | 39% | 0.391 | S | S | . | . | H | α-helix | trans | -63.4 | -42.2 | 175.9 | -72.5 | -172.1 | -70.8 | 0 | 0 | 112.4 | A177 F178 R184 S185 | A177-M181 WeakPolarHBondContact O-CG 3.39Å; A177-M181 PolarHBondContact O-N 2.99Å; F178-M181 HydrophobicContact CD1-CE 3.71Å; F178-M181 HydrophobicContact CE1-CE 4.04Å; F178-M181 HydrophobicContact CG-CE 4.24Å; F178-M181 PolarHBondContact O-N 3.41Å; M181-R184 PolarHBondContact O-N 3.5Å; M181-S185 VanDerWaalsContact O-CB 3.31Å; M181-S185 WeakPolarHBondContact O-CB 3.46Å; M181-S185 PolarHBondContact O-N 2.85Å |
| 182 | Y | 89.5 | Confident | 89.7 | Confident | 132 Ų | 132 | 73.5 Ų | 73.5 | 52% | 0.518 | 39% | 0.391 | S | S | . | . | H | α-helix | trans | -63.2 | -47.2 | 177.2 | -179.2 | -97.2 | 0 | 0 | 0 | 111.8 | F178 A179 S185 R186 | F178-Y182 VanDerWaalsContact O-CB 3.26Å; F178-Y182 WeakPolarHBondContact O-CB 3.27Å; F178-Y182 PolarHBondContact O-N 2.61Å; A179-Y182 PolarHBondContact O-N 2.99Å; Y182-S185 PolarHBondContact O-N 3.41Å; Y182-R186 HydrophobicContact CD1-CG 4.45Å; Y182-R186 HydrophobicContact CE1-CG 4.25Å; Y182-R186 VanDerWaalsContact CZ-CZ 3.45Å; Y182-R186 WeakPolarHBondContact O-CG 3.3Å; Y182-R186 PolarHBondContact O-N 3.19Å; Y182-R186 PolarHBondContact OH-NH1 3.27Å; Y182-R186 PolarHBondContact OH-NH2 3.22Å |
| 183 | T | 86 | Confident | 89.8 | Confident | 68 Ų | 68 | 78.8 Ų | 78.8 | 42% | 0.417 | 41% | 0.414 | S | S | . | . | H | α-helix | trans | -59.8 | -49.9 | 175.3 | -62.9 | 0 | 0 | 0 | 0 | 110 | A179 G180 S185 R186 F187 | A179-T183 WeakPolarHBondContact O-CB 3.31Å; A179-T183 PolarHBondContact O-N 3.13Å; A179-T183 PolarHBondContact O-OG1 3.06Å; G180-T183 PolarHBondContact O-N 3.23Å; T183-S185 PolarHBondContact O-N 2.86Å; T183-R186 PolarHBondContact O-N 2.62Å; T183-F187 HydrophobicContact CG2-CD2 3.6Å; T183-F187 HydrophobicContact CG2-CE2 3.72Å; T183-F187 WeakPolarHBondContact O-CD2 3.37Å; T183-F187 PolarHBondContact O-N 2.9Å |
| 184 | R | 85.1 | Confident | 89.9 | Confident | 179 Ų | 179 | 75.5 Ų | 75.5 | 68% | 0.675 | 39% | 0.394 | S | S | * | . | H | α-helix | trans | -54.3 | -52.9 | 175.2 | -176.8 | 177 | 174.4 | 161.8 | -2.1 | 110.5 | G180 M181 R186 F187 T188 | G180-R184 VanDerWaalsContact O-CB 3.26Å; G180-R184 WeakPolarHBondContact O-CB 3.3Å; G180-R184 PolarHBondContact O-N 2.9Å; M181-R184 PolarHBondContact O-N 3.5Å; R184-R186 VanDerWaalsContact C-N 3.28Å; R184-R186 PolarHBondContact O-N 3.25Å; R184-F187 PolarHBondContact O-N 3.1Å; R184-F187 VanDerWaalsContact O-N 3.08Å; R184-T188 HydrophobicContact CG-CG2 3.58Å; R184-T188 WeakPolarHBondContact O-CB 3.16Å; R184-T188 VanDerWaalsContact O-CG2 3.3Å; R184-T188 WeakPolarHBondContact O-CG2 3.38Å; R184-T188 PolarHBondContact O-N 2.69Å; R184-T188 PolarHBondContact O-OG1 2.85Å |
| 185 | S | 83.4 | Confident | 90 | Very high | 77 Ų | 77 | 74.8 Ų | 74.8 | 54% | 0.538 | 38% | 0.383 | S | S | . | . | H | α-helix | trans | -56.7 | -38.4 | 179.3 | 179.8 | 0 | 0 | 0 | 0 | 113.3 | M181 Y182 T183 K266 | M181-S185 VanDerWaalsContact O-CB 3.31Å; M181-S185 WeakPolarHBondContact O-CB 3.46Å; M181-S185 PolarHBondContact O-N 2.85Å; Y182-S185 PolarHBondContact O-N 3.41Å; T183-S185 PolarHBondContact O-N 2.86Å; S185-K266 PolarHBondContact O-NZ 2.74Å |
| 186 | R | 83.9 | Confident | 90 | Very high | 106 Ų | 106 | 78.9 Ų | 78.9 | 40% | 0.4 | 39% | 0.393 | S | S | . | . | H | α-helix | trans | -71.5 | -32.6 | 177.3 | -76 | -78 | 174.3 | 78.6 | -2.6 | 113.3 | Y182 T183 R184 K266 | Y182-R186 HydrophobicContact CD1-CG 4.45Å; Y182-R186 HydrophobicContact CE1-CG 4.25Å; Y182-R186 VanDerWaalsContact CZ-CZ 3.45Å; Y182-R186 WeakPolarHBondContact O-CG 3.3Å; Y182-R186 PolarHBondContact O-N 3.19Å; Y182-R186 PolarHBondContact OH-NH1 3.27Å; Y182-R186 PolarHBondContact OH-NH2 3.22Å; T183-R186 PolarHBondContact O-N 2.62Å; R184-R186 VanDerWaalsContact C-N 3.28Å; R184-R186 PolarHBondContact O-N 3.25Å; R186-K266 WeakPolarHBondContact O-CE 3.15Å |
| 187 | F | 81.1 | Confident | 90.1 | Very high | 115 Ų | 115 | 80.1 Ų | 80.1 | 50% | 0.504 | 40% | 0.399 | S | S | . | . | H | α-helix | trans | -101.1 | -19.2 | -175.7 | -68 | -66 | 0 | 0 | 0 | 114.7 | T183 R184 K243 | T183-F187 HydrophobicContact CG2-CD2 3.6Å; T183-F187 HydrophobicContact CG2-CE2 3.72Å; T183-F187 WeakPolarHBondContact O-CD2 3.37Å; T183-F187 PolarHBondContact O-N 2.9Å; R184-F187 PolarHBondContact O-N 3.1Å; R184-F187 VanDerWaalsContact O-N 3.08Å; F187-K243 WeakPolarHBondContact O-CD 3.25Å |
| 188 | T | 84.7 | Confident | 90.2 | Very high | 49 Ų | 49 | 77.7 Ų | 77.7 | 30% | 0.301 | 38% | 0.378 | S | S | . | . | P | Polyproline II helix | trans | -84.3 | 135.6 | 176.7 | 55.9 | 0 | 0 | 0 | 0 | 111.3 | R184 K266 | R184-T188 HydrophobicContact CG-CG2 3.58Å; R184-T188 WeakPolarHBondContact O-CB 3.16Å; R184-T188 VanDerWaalsContact O-CG2 3.3Å; R184-T188 WeakPolarHBondContact O-CG2 3.38Å; R184-T188 PolarHBondContact O-N 2.69Å; R184-T188 PolarHBondContact O-OG1 2.85Å; T188-K266 WeakPolarHBondContact O-CD 3.38Å; T188-K266 PolarHBondContact O-NZ 2.8Å |
| 189 | I | 89.1 | Confident | 90.2 | Very high | 11 Ų | 11 | 72 Ų | 72 | 6% | 0.056 | 35% | 0.354 | C | S | . | . | P | Polyproline II helix | trans | -93.7 | 131.5 | 172 | -56.1 | -173.4 | 0 | 0 | 0 | 107.1 | V194 M226 K243 C245 K266 Y271 | I189-V194 HydrophobicContact CG2-CG2 3.83Å; I189-M226 HydrophobicContact CB-CE 4.29Å; I189-K243 HydrophobicContact CD1-CB 3.71Å; I189-K243 WeakPolarHBondContact CD1-O 3.25Å; I189-K243 HydrophobicContact CG1-CB 4.02Å; I189-C245 HydrophobicContact CB-CB 4.44Å; I189-C245 HydrophobicContact CD1-CB 4.07Å; I189-C245 HydrophobicContact CG2-CB 3.7Å; I189-K266 HydrophobicContact CD1-CB 3.81Å; I189-K266 HydrophobicContact CG1-CB 3.65Å; I189-K266 HydrophobicContact CG1-CD 4.04Å; I189-Y271 HydrophobicContact CB-CE1 4.43Å; I189-Y271 HydrophobicContact CG2-CD1 4.34Å; I189-Y271 HydrophobicContact CG2-CE1 3.71Å |
| 190 | N | 90.7 | Very high | 90.3 | Very high | 76 Ų | 76 | 73.9 Ų | 73.9 | 41% | 0.406 | 36% | 0.36 | S | S | . | . | P | Polyproline II helix | trans | -98.5 | 117.4 | 169.2 | -178 | -27.4 | 0 | 0 | 0 | 108.2 | D192 K193 V194 Y271 | N190-D192 VanDerWaalsContact C-N 3.32Å; N190-D192 PolarHBondContact O-N 2.86Å; N190-D192 WeakPolarHBondContact OD1-CB 3.37Å; N190-D192 PolarHBondContact OD1-N 2.85Å; N190-K193 HydrophobicContact CB-CB 4.17Å; N190-K193 PolarHBondContact O-N 2.84Å; N190-V194 PolarHBondContact O-N 2.88Å; N190-Y271 PolarHBondContact N-OH 2.86Å |
| 191 | P | 92.4 | Very high | 90.6 | Very high | 19 Ų | 19 | 76 Ų | 76 | 12% | 0.123 | 36% | 0.358 | C | S | . | . | H | α-helix | trans | -63.3 | -33.9 | -179 | 26.7 | -34 | 0 | 0 | 0 | 112.7 | K193 V194 Y195 Y224 | P191-K193 VanDerWaalsContact C-N 3.3Å; P191-K193 PolarHBondContact O-N 2.79Å; P191-V194 CarbonylContact O-C 3.53Å; P191-V194 WeakPolarHBondContact O-CA 3.37Å; P191-V194 WeakPolarHBondContact O-CB 3.49Å; P191-V194 PolarHBondContact O-N 3.07Å; P191-V194 VanDerWaalsContact O-N 3.07Å; P191-Y195 PolarHBondContact O-N 3.3Å; P191-Y224 HydrophobicContact CB-CD1 3.96Å; P191-Y224 HydrophobicContact CB-CD2 4.24Å; P191-Y224 HydrophobicContact CB-CE1 4.4Å; P191-Y224 HydrophobicContact CB-CG 3.88Å; P191-Y224 HydrophobicContact CG-CD1 4.04Å; P191-Y224 HydrophobicContact CG-CD2 4.23Å; P191-Y224 HydrophobicContact CG-CE1 3.97Å; P191-Y224 HydrophobicContact CG-CE2 4.16Å; P191-Y224 HydrophobicContact CG-CG 4.18Å |
| 192 | D | 93.4 | Very high | 90.8 | Very high | 81 Ų | 81 | 70.8 Ų | 70.8 | 43% | 0.433 | 33% | 0.332 | S | S | . | . | H | α-helix | trans | -65.4 | -36.6 | 177.8 | -58.5 | -40.3 | 0 | 0 | 0 | 111.8 | N190 V194 Y195 R196 | N190-D192 VanDerWaalsContact C-N 3.32Å; N190-D192 PolarHBondContact O-N 2.86Å; N190-D192 WeakPolarHBondContact OD1-CB 3.37Å; N190-D192 PolarHBondContact OD1-N 2.85Å; D192-V194 VanDerWaalsContact C-N 3.33Å; D192-Y195 PolarHBondContact O-N 3.3Å; D192-R196 WeakPolarHBondContact O-CG 3.06Å; D192-R196 PolarHBondContact O-N 3.21Å |
| 193 | K | 93 | Very high | 91 | Very high | 112 Ų | 112 | 67.4 Ų | 67.4 | 49% | 0.487 | 32% | 0.323 | S | S | . | . | H | α-helix | trans | -67.3 | -38.1 | 174 | -175.2 | 160.7 | -179.7 | 170.4 | 0 | 111 | N190 P191 I197 Y271 | N190-K193 HydrophobicContact CB-CB 4.17Å; N190-K193 PolarHBondContact O-N 2.84Å; P191-K193 VanDerWaalsContact C-N 3.3Å; P191-K193 PolarHBondContact O-N 2.79Å; K193-I197 HydrophobicContact CG-CD1 4.01Å; K193-I197 WeakPolarHBondContact O-CD1 3.13Å; K193-I197 WeakPolarHBondContact O-CG1 3.32Å; K193-I197 PolarHBondContact O-N 3.43Å; K193-I197 VanDerWaalsContact O-N 3.12Å; K193-Y271 HydrophobicContact CD-CE2 3.6Å; K193-Y271 HydrophobicContact CG-CE2 3.97Å |
| 194 | V | 94.1 | Very high | 91.3 | Very high | 1 Ų | 1 | 69.4 Ų | 69.4 | 1% | 0.006 | 34% | 0.335 | C | S | . | . | H | α-helix | trans | -63.2 | -46.6 | 174.4 | 171.1 | 0 | 0 | 0 | 0 | 110.5 | I189 N190 P191 D192 R196 I197 A198 L247 V262 V264 Y271 | I189-V194 HydrophobicContact CG2-CG2 3.83Å; N190-V194 PolarHBondContact O-N 2.88Å; P191-V194 CarbonylContact O-C 3.53Å; P191-V194 WeakPolarHBondContact O-CA 3.37Å; P191-V194 WeakPolarHBondContact O-CB 3.49Å; P191-V194 PolarHBondContact O-N 3.07Å; P191-V194 VanDerWaalsContact O-N 3.07Å; D192-V194 VanDerWaalsContact C-N 3.33Å; V194-R196 PolarHBondContact O-N 2.85Å; V194-I197 PolarHBondContact O-N 3.4Å; V194-A198 WeakPolarHBondContact O-CB 3.49Å; V194-A198 PolarHBondContact O-N 3.25Å; V194-L247 HydrophobicContact CG1-CD2 4Å; V194-V262 HydrophobicContact CG1-CG1 4.13Å; V194-V264 HydrophobicContact CB-CG2 4.44Å; V194-V264 HydrophobicContact CG1-CB 4.21Å; V194-V264 HydrophobicContact CG1-CG2 3.43Å; V194-V264 VanDerWaalsContact CG1-CG2 3.43Å; V194-V264 HydrophobicContact CG2-CB 4.19Å; V194-V264 HydrophobicContact CG2-CG1 4.24Å; V194-V264 HydrophobicContact CG2-CG2 4.2Å; V194-Y271 HydrophobicContact CG2-CD1 3.86Å; V194-Y271 HydrophobicContact CG2-CE1 3.91Å |
| 195 | Y | 95.4 | Very high | 91.7 | Very high | 25 Ų | 25 | 62.1 Ų | 62.1 | 10% | 0.098 | 31% | 0.312 | C | S | . | . | H | α-helix | trans | -55.8 | -50.4 | 175.7 | 171.6 | -102.7 | 0 | 0 | 0 | 111.8 | P191 D192 I197 A198 M199 G218 R222 F249 | P191-Y195 PolarHBondContact O-N 3.3Å; D192-Y195 PolarHBondContact O-N 3.3Å; Y195-I197 PolarHBondContact O-N 3.31Å; Y195-A198 WeakPolarHBondContact O-CB 3.43Å; Y195-A198 PolarHBondContact O-N 3.14Å; Y195-A198 VanDerWaalsContact O-N 3.16Å; Y195-M199 WeakPolarHBondContact O-CB 3.24Å; Y195-M199 PolarHBondContact O-N 3.08Å; Y195-G218 WeakPolarHBondContact OH-CA 3.45Å; Y195-R222 VanDerWaalsContact CZ-CZ 3.42Å; Y195-R222 PolarHBondContact OH-NH2 3.25Å; Y195-F249 AromaticContact CD2-CD1 3.94Å; Y195-F249 HydrophobicContact CD2-CD1 3.94Å; Y195-F249 HydrophobicContact CD2-CD2 4.03Å; Y195-F249 AromaticContact CD2-CE1 3.9Å; Y195-F249 HydrophobicContact CD2-CE1 3.9Å; Y195-F249 AromaticContact CD2-CE2 3.99Å; Y195-F249 HydrophobicContact CD2-CE2 3.99Å; Y195-F249 AromaticContact CD2-CG 3.99Å; Y195-F249 HydrophobicContact CD2-CG 3.99Å; Y195-F249 AromaticContact CD2-CZ 3.91Å; Y195-F249 HydrophobicContact CD2-CZ 3.91Å; Y195-F249 HydrophobicContact CE2-CD1 4.36Å; Y195-F249 AromaticContact CE2-CD2 3.62Å; Y195-F249 HydrophobicContact CE2-CD2 3.62Å; Y195-F249 HydrophobicContact CE2-CE1 4.4Å; Y195-F249 AromaticContact CE2-CE2 3.66Å; Y195-F249 HydrophobicContact CE2-CE2 3.66Å; Y195-F249 AromaticContact CE2-CG 3.97Å; Y195-F249 HydrophobicContact CE2-CG 3.97Å; Y195-F249 HydrophobicContact CE2-CZ 4.06Å |
| 196 | R | 94.8 | Very high | 92.2 | Very high | 181 Ų | 181 | 61.1 Ų | 61.1 | 68% | 0.683 | 31% | 0.308 | S | S | * | . | H | α-helix | trans | -58.6 | -46.4 | 178.3 | -71.8 | 179.4 | -168.6 | -177 | 3.2 | 112.2 | D192 V194 A198 M199 T200 | D192-R196 WeakPolarHBondContact O-CG 3.06Å; D192-R196 PolarHBondContact O-N 3.21Å; V194-R196 PolarHBondContact O-N 2.85Å; R196-A198 VanDerWaalsContact C-N 3.32Å; R196-A198 PolarHBondContact O-N 3.14Å; R196-M199 PolarHBondContact O-N 2.82Å; R196-T200 PolarHBondContact O-N 3.35Å; R196-T200 PolarHBondContact O-OG1 2.93Å |
| 197 | I | 95.1 | Very high | 92.5 | Very high | 54 Ų | 54 | 58.6 Ų | 58.6 | 28% | 0.277 | 31% | 0.31 | S | S | . | . | H | α-helix | trans | -64 | -40.1 | 178.6 | -60.8 | 163.7 | 0 | 0 | 0 | 110.4 | K193 V194 Y195 K201 Y271 M273 | K193-I197 HydrophobicContact CG-CD1 4.01Å; K193-I197 WeakPolarHBondContact O-CD1 3.13Å; K193-I197 WeakPolarHBondContact O-CG1 3.32Å; K193-I197 PolarHBondContact O-N 3.43Å; K193-I197 VanDerWaalsContact O-N 3.12Å; V194-I197 PolarHBondContact O-N 3.4Å; Y195-I197 PolarHBondContact O-N 3.31Å; I197-K201 PolarHBondContact O-N 3.31Å; I197-K201 VanDerWaalsContact O-N 3.12Å; I197-Y271 HydrophobicContact CD1-CD2 4.04Å; I197-Y271 HydrophobicContact CD1-CG 4.3Å; I197-M273 HydrophobicContact CB-CE 3.8Å; I197-M273 HydrophobicContact CG2-CE 3.39Å; I197-M273 HydrophobicContact CG2-SD 4.22Å |
| 198 | A | 95.7 | Very high | 93.1 | Very high | 0 Ų | 0 | 53.1 Ų | 53.1 | 0% | 0 | 29% | 0.286 | C | S | . | . | H | α-helix | trans | -62.9 | -48.1 | 176.6 | 0 | 0 | 0 | 0 | 0 | 110.7 | V194 Y195 R196 T200 K201 L202 F249 V262 M273 L276 | V194-A198 WeakPolarHBondContact O-CB 3.49Å; V194-A198 PolarHBondContact O-N 3.25Å; Y195-A198 WeakPolarHBondContact O-CB 3.43Å; Y195-A198 PolarHBondContact O-N 3.14Å; Y195-A198 VanDerWaalsContact O-N 3.16Å; R196-A198 VanDerWaalsContact C-N 3.32Å; R196-A198 PolarHBondContact O-N 3.14Å; A198-T200 VanDerWaalsContact C-N 3.33Å; A198-T200 PolarHBondContact O-N 2.86Å; A198-K201 PolarHBondContact O-N 3.12Å; A198-K201 VanDerWaalsContact O-N 3.07Å; A198-L202 VanDerWaalsContact O-CG 3.26Å; A198-L202 WeakPolarHBondContact O-CG 3.34Å; A198-L202 PolarHBondContact O-N 3.47Å; A198-F249 HydrophobicContact CB-CE1 4.32Å; A198-F249 HydrophobicContact CB-CZ 4.15Å; A198-V262 HydrophobicContact CB-CG2 4.12Å; A198-M273 HydrophobicContact CB-CE 4.08Å; A198-L276 HydrophobicContact CB-CD1 4.23Å |
| 199 | M | 94.8 | Very high | 93.5 | Very high | 23 Ų | 23 | 52.8 Ų | 52.8 | 11% | 0.113 | 28% | 0.282 | C | S | . | . | H | α-helix | trans | -61.8 | -38.7 | 179.5 | -160.3 | 65.1 | -174.3 | 0 | 0 | 112.7 | Y195 R196 L202 N203 L216 G218 F249 I251 | Y195-M199 WeakPolarHBondContact O-CB 3.24Å; Y195-M199 PolarHBondContact O-N 3.08Å; R196-M199 PolarHBondContact O-N 2.82Å; M199-L202 PolarHBondContact O-N 2.81Å; M199-L202 HydrophobicContact SD-CD1 4.47Å; M199-N203 WeakPolarHBondContact O-CB 3.37Å; M199-N203 PolarHBondContact O-N 2.72Å; M199-N203 PolarHBondContact O-ND2 2.81Å; M199-L216 HydrophobicContact CE-CB 3.88Å; M199-L216 WeakPolarHBondContact CE-O 3.3Å; M199-G218 VanDerWaalsContact CE-N 3.3Å; M199-F249 HydrophobicContact SD-CE2 4.45Å; M199-I251 HydrophobicContact CE-CD1 3.81Å; M199-I251 HydrophobicContact CE-CG1 4.17Å; M199-I251 HydrophobicContact SD-CD1 3.81Å |
| 200 | T | 95 | Very high | 93.6 | Very high | 92 Ų | 92 | 59.2 Ų | 59.2 | 56% | 0.564 | 31% | 0.312 | S | S | * | . | H | α-helix | trans | -61.4 | -45 | 172.8 | -57.5 | 0 | 0 | 0 | 0 | 111.2 | R196 A198 T204 | R196-T200 PolarHBondContact O-N 3.35Å; R196-T200 PolarHBondContact O-OG1 2.93Å; A198-T200 VanDerWaalsContact C-N 3.33Å; A198-T200 PolarHBondContact O-N 2.86Å; T200-T204 WeakPolarHBondContact O-CB 3.46Å; T200-T204 PolarHBondContact O-N 3.21Å; T200-T204 VanDerWaalsContact O-N 3.16Å; T200-T204 PolarHBondContact O-OG1 3.16Å |
| 201 | K | 94.8 | Very high | 93.6 | Very high | 85 Ų | 85 | 57.2 Ų | 57.2 | 37% | 0.37 | 30% | 0.302 | S | S | . | . | H | α-helix | trans | -65.9 | -40.4 | 178.4 | -74.2 | -168 | 178.7 | -173.7 | 0 | 112.9 | I197 A198 T204 S205 M273 L276 L292 | I197-K201 PolarHBondContact O-N 3.31Å; I197-K201 VanDerWaalsContact O-N 3.12Å; A198-K201 PolarHBondContact O-N 3.12Å; A198-K201 VanDerWaalsContact O-N 3.07Å; K201-T204 PolarHBondContact O-N 3.07Å; K201-S205 PolarHBondContact O-N 2.84Å; K201-M273 HydrophobicContact CD-CE 4.44Å; K201-M273 HydrophobicContact CD-SD 3.57Å; K201-M273 VanDerWaalsContact CD-SD 3.57Å; K201-M273 VanDerWaalsContact CE-SD 3.53Å; K201-M273 PolarHBondContact NZ-SD 2.78Å; K201-L276 HydrophobicContact CB-CD2 3.87Å; K201-L276 HydrophobicContact CD-CD2 4.1Å; K201-L292 HydrophobicContact CB-CD2 4.49Å |
| 202 | L | 94.6 | Very high | 93.6 | Very high | 0 Ų | 0 | 56.3 Ų | 56.3 | 0% | 0 | 30% | 0.297 | C | S | . | . | H | α-helix | trans | -63.2 | -47.2 | 177.8 | -66.5 | 169.1 | 0 | 0 | 0 | 111 | A198 M199 T204 S205 I208 L216 F249 I251 V260 L276 V278 L292 | A198-L202 VanDerWaalsContact O-CG 3.26Å; A198-L202 WeakPolarHBondContact O-CG 3.34Å; A198-L202 PolarHBondContact O-N 3.47Å; M199-L202 PolarHBondContact O-N 2.81Å; M199-L202 HydrophobicContact SD-CD1 4.47Å; L202-T204 PolarHBondContact O-N 3.22Å; L202-S205 PolarHBondContact O-N 3.19Å; L202-I208 HydrophobicContact CD2-CD1 3.32Å; L202-L216 HydrophobicContact CB-CD1 3.99Å; L202-F249 HydrophobicContact CD1-CE2 4.23Å; L202-F249 HydrophobicContact CD1-CZ 4.02Å; L202-I251 HydrophobicContact CB-CD1 4.37Å; L202-I251 HydrophobicContact CD1-CD1 3.7Å; L202-V260 HydrophobicContact CD1-CG1 3.94Å; L202-V260 HydrophobicContact CD1-CG2 3.82Å; L202-L276 HydrophobicContact CD2-CD1 4.2Å; L202-L276 HydrophobicContact CD2-CD2 4.45Å; L202-L276 HydrophobicContact CD2-CG 4.38Å; L202-L276 HydrophobicContact CG-CD1 4.45Å; L202-V278 HydrophobicContact CD2-CG2 3.54Å; L202-L292 HydrophobicContact CD2-CD2 4.22Å |
| 203 | N | 93.6 | Very high | 93.5 | Very high | 62 Ų | 62 | 52.7 Ų | 52.7 | 33% | 0.332 | 28% | 0.278 | S | S | . | . | H | α-helix | trans | -70.9 | -9.1 | 177.5 | -82.2 | -55.2 | 0 | 0 | 0 | 114.6 | M199 L216 | M199-N203 WeakPolarHBondContact O-CB 3.37Å; M199-N203 PolarHBondContact O-N 2.72Å; M199-N203 PolarHBondContact O-ND2 2.81Å; N203-L216 VanDerWaalsContact OD1-CB 3.28Å; N203-L216 WeakPolarHBondContact OD1-CB 3.25Å; N203-L216 PolarHBondContact OD1-N 2.85Å |
| 204 | T | 93.3 | Very high | 93.3 | Very high | 109 Ų | 109 | 50.3 Ų | 50.3 | 67% | 0.669 | 28% | 0.279 | S | S | * | . | H | α-helix | trans | -99.5 | -14.1 | 176.3 | -51.5 | 0 | 0 | 0 | 0 | 111.7 | T200 K201 L202 | T200-T204 WeakPolarHBondContact O-CB 3.46Å; T200-T204 PolarHBondContact O-N 3.21Å; T200-T204 VanDerWaalsContact O-N 3.16Å; T200-T204 PolarHBondContact O-OG1 3.16Å; K201-T204 PolarHBondContact O-N 3.07Å; L202-T204 PolarHBondContact O-N 3.22Å |
| 205 | S | 93 | Very high | 93.2 | Very high | 26 Ų | 26 | 55.1 Ų | 55.1 | 18% | 0.182 | 31% | 0.31 | C | S | . | . | trans | -91.8 | 117.3 | -173.4 | -176.2 | 0 | 0 | 0 | 0 | 112.5 | K201 L202 A207 I208 L209 L292 | K201-S205 PolarHBondContact O-N 2.84Å; L202-S205 PolarHBondContact O-N 3.19Å; S205-A207 PolarHBondContact O-N 3.37Å; S205-I208 PolarHBondContact O-N 2.83Å; S205-L209 VanDerWaalsContact O-CG 3.29Å; S205-L209 WeakPolarHBondContact O-CG 3.18Å; S205-L209 PolarHBondContact O-N 2.95Å; S205-L209 VanDerWaalsContact O-N 3.14Å; S205-L292 WeakPolarHBondContact OG-CD1 3.46Å | ||
| 206 | A | 93.1 | Very high | 93 | Very high | 57 Ų | 57 | 54.3 Ų | 54.3 | 47% | 0.471 | 31% | 0.308 | S | S | . | . | H | α-helix | trans | -55.9 | -46.4 | 177.3 | 0 | 0 | 0 | 0 | 0 | 112.5 | I208 L209 E210 | A206-I208 PolarHBondContact O-N 3.47Å; A206-I208 VanDerWaalsContact O-N 3.14Å; A206-L209 PolarHBondContact O-N 2.82Å; A206-L209 VanDerWaalsContact O-N 3.08Å; A206-E210 WeakPolarHBondContact O-CB 3.13Å; A206-E210 VanDerWaalsContact O-CG 3.29Å; A206-E210 WeakPolarHBondContact O-CG 3.43Å; A206-E210 PolarHBondContact O-N 2.83Å |
| 207 | A | 91.3 | Very high | 92.9 | Very high | 52 Ų | 52 | 48.2 Ų | 48.2 | 43% | 0.43 | 30% | 0.296 | S | S | . | . | H | α-helix | trans | -58.8 | -32.3 | -176.9 | 0 | 0 | 0 | 0 | 0 | 113.8 | S205 V211 | S205-A207 PolarHBondContact O-N 3.37Å; A207-V211 WeakPolarHBondContact O-CG2 3.41Å |
| 208 | I | 92.3 | Very high | 92.7 | Very high | 0 Ų | 0 | 46.9 Ų | 46.9 | 0% | 0 | 30% | 0.295 | C | S | . | . | H | α-helix | trans | -81.9 | -42 | 177 | -68.1 | 179.6 | 0 | 0 | 0 | 110.6 | L202 S205 A206 E210 V211 M212 L216 V278 L292 | L202-I208 HydrophobicContact CD2-CD1 3.32Å; S205-I208 PolarHBondContact O-N 2.83Å; A206-I208 PolarHBondContact O-N 3.47Å; A206-I208 VanDerWaalsContact O-N 3.14Å; I208-E210 VanDerWaalsContact C-N 3.28Å; I208-E210 PolarHBondContact O-N 3.4Å; I208-V211 PolarHBondContact O-N 2.72Å; I208-M212 HydrophobicContact CG2-CE 3.19Å; I208-M212 HydrophobicContact CG2-CG 4.37Å; I208-M212 HydrophobicContact CG2-SD 4.42Å; I208-M212 WeakPolarHBondContact O-CB 3.29Å; I208-M212 PolarHBondContact O-N 2.98Å; I208-L216 HydrophobicContact CG2-CD1 3.73Å; I208-V278 HydrophobicContact CD1-CG2 3.73Å; I208-L292 HydrophobicContact CD1-CD1 3.27Å; I208-L292 HydrophobicContact CD1-CD2 3.61Å; I208-L292 HydrophobicContact CD1-CG 3.96Å; I208-L292 HydrophobicContact CG1-CD1 3.63Å |
| 209 | L | 93.1 | Very high | 92.3 | Very high | 43 Ų | 43 | 48.6 Ų | 48.6 | 23% | 0.225 | 31% | 0.306 | C | S | . | . | H | α-helix | trans | -64.8 | -33.6 | 179.5 | -66.4 | 174.4 | 0 | 0 | 0 | 112.2 | S205 A206 V211 G213 A214 L216 | S205-L209 VanDerWaalsContact O-CG 3.29Å; S205-L209 WeakPolarHBondContact O-CG 3.18Å; S205-L209 PolarHBondContact O-N 2.95Å; S205-L209 VanDerWaalsContact O-N 3.14Å; A206-L209 PolarHBondContact O-N 2.82Å; A206-L209 VanDerWaalsContact O-N 3.08Å; L209-V211 VanDerWaalsContact C-N 3.34Å; L209-G213 WeakPolarHBondContact O-CA 3.21Å; L209-G213 PolarHBondContact O-N 2.81Å; L209-A214 HydrophobicContact CD2-CB 4.01Å; L209-L216 HydrophobicContact CD2-CD1 3.82Å; L209-L216 HydrophobicContact CD2-CD2 4.19Å; L209-L216 HydrophobicContact CD2-CG 3.64Å |
| 210 | E | 91.8 | Very high | 91.9 | Very high | 146 Ų | 146 | 54.3 Ų | 54.3 | 68% | 0.682 | 34% | 0.337 | S | S | * | . | H | α-helix | trans | -65.5 | -35.1 | 175.4 | -76.7 | 170.8 | -168.1 | 0 | 0 | 112.6 | A206 I208 | A206-E210 WeakPolarHBondContact O-CB 3.13Å; A206-E210 VanDerWaalsContact O-CG 3.29Å; A206-E210 WeakPolarHBondContact O-CG 3.43Å; A206-E210 PolarHBondContact O-N 2.83Å; I208-E210 VanDerWaalsContact C-N 3.28Å; I208-E210 PolarHBondContact O-N 3.4Å |
| 211 | V | 91.1 | Very high | 91.7 | Very high | 34 Ų | 34 | 51.4 Ų | 51.4 | 21% | 0.206 | 32% | 0.319 | C | S | . | . | H | α-helix | trans | -92.6 | -31.7 | -175.9 | -176.3 | 0 | 0 | 0 | 0 | 112.6 | A207 I208 L209 I280 L290 | A207-V211 WeakPolarHBondContact O-CG2 3.41Å; I208-V211 PolarHBondContact O-N 2.72Å; L209-V211 VanDerWaalsContact C-N 3.34Å; V211-I280 HydrophobicContact CB-CD1 4.12Å; V211-I280 HydrophobicContact CG1-CD1 3.49Å; V211-I280 VanDerWaalsContact CG1-CD1 3.49Å; V211-L290 HydrophobicContact CB-CD1 4.17Å; V211-L290 HydrophobicContact CG1-CD1 4.43Å; V211-L290 HydrophobicContact CG2-CD1 4.07Å |
| 212 | M | 91.3 | Very high | 91.5 | Very high | 0 Ų | 0 | 51.3 Ų | 51.3 | 0% | 0 | 32% | 0.316 | C | S | . | . | H | α-helix | trans | -100.2 | -20.3 | -178.4 | -64.3 | -154.9 | -62 | 0 | 0 | 113.8 | I208 L216 I251 G253 S254 E255 R256 V278 I280 | I208-M212 HydrophobicContact CG2-CE 3.19Å; I208-M212 HydrophobicContact CG2-CG 4.37Å; I208-M212 HydrophobicContact CG2-SD 4.42Å; I208-M212 WeakPolarHBondContact O-CB 3.29Å; I208-M212 PolarHBondContact O-N 2.98Å; M212-L216 HydrophobicContact CB-CD2 3.77Å; M212-L216 HydrophobicContact CE-CD1 3.69Å; M212-L216 HydrophobicContact CE-CD2 3.46Å; M212-L216 VanDerWaalsContact CE-CD2 3.46Å; M212-L216 HydrophobicContact CE-CG 4.17Å; M212-I251 HydrophobicContact CE-CD1 4.11Å; M212-I251 HydrophobicContact CE-CG1 4.32Å; M212-I251 HydrophobicContact CE-CG2 3.66Å; M212-I251 HydrophobicContact SD-CG2 3.84Å; M212-G253 CarbonylContact O-C 3.58Å; M212-G253 VanDerWaalsContact O-CA 3.3Å; M212-G253 WeakPolarHBondContact O-CA 3.46Å; M212-S254 PolarHBondContact O-N 3.45Å; M212-E255 WeakPolarHBondContact O-CB 3.03Å; M212-E255 PolarHBondContact O-N 2.9Å; M212-R256 PolarHBondContact O-N 2.88Å; M212-V278 HydrophobicContact CE-CG1 4.18Å; M212-V278 HydrophobicContact SD-CG1 3.89Å; M212-I280 HydrophobicContact CG-CD1 3.64Å; M212-I280 HydrophobicContact CG-CG1 4.26Å; M212-I280 HydrophobicContact SD-CD1 4.22Å; M212-I280 HydrophobicContact SD-CG1 4.26Å |
| 213 | G | 91.8 | Very high | 91.4 | Very high | 5 Ų | 5 | 52.3 Ų | 52.3 | 5% | 0.052 | 33% | 0.325 | C | S | . | . | trans | 79.2 | 139.3 | -172 | 0 | 0 | 0 | 0 | 0 | 113 | L209 L216 G253 S254 | L209-G213 WeakPolarHBondContact O-CA 3.21Å; L209-G213 PolarHBondContact O-N 2.81Å; G213-L216 WeakPolarHBondContact O-CD2 3.38Å; G213-G253 WeakPolarHBondContact O-CA 3.48Å; G213-S254 WeakPolarHBondContact CA-OG 3.39Å; G213-S254 PolarHBondContact O-N 3.24Å | ||
| 214 | A | 89.9 | Confident | 91.4 | Very high | 61 Ų | 61 | 55.3 Ų | 55.3 | 50% | 0.504 | 33% | 0.332 | S | S | . | . | S | Bend | trans | -83.8 | 151.4 | 174 | 0 | 0 | 0 | 0 | 0 | 111.3 | L209 S254 | L209-A214 HydrophobicContact CD2-CB 4.01Å; A214-S254 PolarHBondContact N-OG 2.8Å; A214-S254 WeakPolarHBondContact O-CB 3.37Å; A214-S254 PolarHBondContact O-OG 2.88Å |
| 215 | P | 90.3 | Very high | 91.3 | Very high | 102 Ų | 102 | 52.4 Ų | 52.4 | 66% | 0.662 | 31% | 0.314 | S | S | * | . | S | Bend | cis | -80.4 | 154.6 | -7.9 | 33.5 | -34.5 | 0 | 0 | 0 | 112.1 | ||
| 216 | L | 92.7 | Very high | 91.1 | Very high | 9 Ų | 9 | 55.4 Ų | 55.4 | 5% | 0.047 | 33% | 0.327 | C | S | . | . | P | Polyproline II helix | trans | -88 | 127.8 | 169.9 | -49.7 | 176.1 | 0 | 0 | 0 | 109.9 | M199 L202 N203 I208 L209 M212 G213 I251 | M199-L216 HydrophobicContact CE-CB 3.88Å; M199-L216 WeakPolarHBondContact CE-O 3.3Å; L202-L216 HydrophobicContact CB-CD1 3.99Å; N203-L216 VanDerWaalsContact OD1-CB 3.28Å; N203-L216 WeakPolarHBondContact OD1-CB 3.25Å; N203-L216 PolarHBondContact OD1-N 2.85Å; I208-L216 HydrophobicContact CG2-CD1 3.73Å; L209-L216 HydrophobicContact CD2-CD1 3.82Å; L209-L216 HydrophobicContact CD2-CD2 4.19Å; L209-L216 HydrophobicContact CD2-CG 3.64Å; M212-L216 HydrophobicContact CB-CD2 3.77Å; M212-L216 HydrophobicContact CE-CD1 3.69Å; M212-L216 HydrophobicContact CE-CD2 3.46Å; M212-L216 VanDerWaalsContact CE-CD2 3.46Å; M212-L216 HydrophobicContact CE-CG 4.17Å; G213-L216 WeakPolarHBondContact O-CD2 3.38Å; L216-I251 HydrophobicContact CB-CD1 3.72Å; L216-I251 HydrophobicContact CB-CG1 4Å; L216-I251 HydrophobicContact CD1-CD1 3.93Å; L216-I251 HydrophobicContact CG-CD1 4.33Å |
| 217 | A | 92.9 | Very high | 90.7 | Very high | 53 Ų | 53 | 54.9 Ų | 54.9 | 44% | 0.438 | 32% | 0.32 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -114.7 | 129.6 | 172.8 | 0 | 0 | 0 | 0 | 0 | 109.6 | K252 | A217-K252 PolarHBondContact N-O 3.16Å; A217-K252 PolarHBondContact O-N 3.27Å |
| 218 | G | 89.6 | Confident | 90.1 | Very high | 25 Ų | 25 | 55.1 Ų | 55.1 | 26% | 0.258 | 33% | 0.327 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -87.3 | 156.7 | 170.6 | 0 | 0 | 0 | 0 | 0 | 110.2 | Y195 M199 | Y195-G218 WeakPolarHBondContact OH-CA 3.45Å; M199-G218 VanDerWaalsContact CE-N 3.3Å |
| 219 | T | 87.8 | Confident | 89.2 | Confident | 36 Ų | 36 | 56 Ų | 56 | 22% | 0.221 | 34% | 0.336 | C | S | . | . | trans | -90 | 172.6 | 174 | 65.8 | 0 | 0 | 0 | 0 | 111.5 | V221 R222 P250 | T219-V221 VanDerWaalsContact C-N 3.3Å; T219-R222 PolarHBondContact O-NE 3.4Å; T219-R222 PolarHBondContact O-NH2 3.22Å; T219-P250 HydrophobicContact CG2-CB 4.04Å; T219-P250 HydrophobicContact CG2-CG 4.48Å; T219-P250 PolarHBondContact N-O 2.68Å; T219-P250 WeakPolarHBondContact OG1-CB 3.46Å; T219-P250 VanDerWaalsContact OG1-CD 3.25Å; T219-P250 WeakPolarHBondContact OG1-CD 3.39Å; T219-P250 WeakPolarHBondContact OG1-CG 3.4Å | ||
| 220 | D | 86.9 | Confident | 88.1 | Confident | 143 Ų | 143 | 55.4 Ų | 55.4 | 77% | 0.765 | 34% | 0.34 | S | S | * | . | S | Bend | trans | -78.4 | -18.9 | 175.7 | -72.2 | -30.4 | 0 | 0 | 0 | 112.6 | R222 | D220-R222 PolarHBondContact O-N 3.24Š|
| 221 | V | 89.5 | Confident | 87 | Confident | 32 Ų | 32 | 49.7 Ų | 49.7 | 19% | 0.194 | 32% | 0.315 | C | S | . | . | trans | -75 | 116 | 176.5 | -177.8 | 0 | 0 | 0 | 0 | 110.5 | T219 P250 I313 A316 E320 | T219-V221 VanDerWaalsContact C-N 3.3Å; V221-P250 WeakPolarHBondContact O-CD 3.03Å; V221-I313 HydrophobicContact CG1-CD1 3.6Å; V221-A316 HydrophobicContact CG1-CB 3.96Å; V221-E320 VanDerWaalsContact CG2-OE2 3.32Å; V221-E320 WeakPolarHBondContact CG2-OE2 3.22Å | ||
| 222 | R | 92.5 | Very high | 86 | Confident | 82 Ų | 82 | 54.1 Ų | 54.1 | 31% | 0.309 | 33% | 0.332 | S | S | . | . | trans | -142.3 | 136.4 | 178.9 | -53.3 | 179.6 | -168.8 | 141 | 13.7 | 110.1 | Y195 T219 D220 L247 F249 | Y195-R222 VanDerWaalsContact CZ-CZ 3.42Å; Y195-R222 PolarHBondContact OH-NH2 3.25Å; T219-R222 PolarHBondContact O-NE 3.4Å; T219-R222 PolarHBondContact O-NH2 3.22Å; D220-R222 PolarHBondContact O-N 3.24Å; R222-L247 HydrophobicContact CB-CD1 4.44Å; R222-F249 HydrophobicContact CB-CB 4.38Å; R222-F249 HydrophobicContact CG-CB 3.95Å | ||
| 223 | A | 92.6 | Very high | 85 | Confident | 21 Ų | 21 | 57.4 Ų | 57.4 | 17% | 0.174 | 35% | 0.349 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -119 | 138.3 | 171.6 | 0 | 0 | 0 | 0 | 0 | 110.5 | L247 I248 L309 I313 | A223-L247 WeakPolarHBondContact O-CA 3.32Å; A223-I248 HydrophobicContact CB-CG2 3.84Å; A223-I248 PolarHBondContact N-O 2.87Å; A223-I248 PolarHBondContact O-N 2.88Å; A223-L309 HydrophobicContact CB-CB 4.48Å; A223-L309 HydrophobicContact CB-CD2 4.14Å; A223-I313 HydrophobicContact CB-CD1 3.55Å; A223-I313 HydrophobicContact CB-CG1 3.63Å |
| 224 | Y | 92.6 | Very high | 83.9 | Confident | 126 Ų | 126 | 64.3 Ų | 64.3 | 49% | 0.494 | 38% | 0.378 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -136.6 | 146.9 | 175.4 | 64.5 | -88.7 | 0 | 0 | 0 | 111.7 | P191 M226 F246 | P191-Y224 HydrophobicContact CB-CD1 3.96Å; P191-Y224 HydrophobicContact CB-CD2 4.24Å; P191-Y224 HydrophobicContact CB-CE1 4.4Å; P191-Y224 HydrophobicContact CB-CG 3.88Å; P191-Y224 HydrophobicContact CG-CD1 4.04Å; P191-Y224 HydrophobicContact CG-CD2 4.23Å; P191-Y224 HydrophobicContact CG-CE1 3.97Å; P191-Y224 HydrophobicContact CG-CE2 4.16Å; P191-Y224 HydrophobicContact CG-CG 4.18Å; Y224-M226 HydrophobicContact CD2-CG 4.47Å; Y224-F246 CarbonylContact C-O 3.5Å; Y224-F246 WeakPolarHBondContact CA-O 3.5Å; Y224-F246 WeakPolarHBondContact CB-O 2.97Å |
| 225 | V | 90.8 | Very high | 82.9 | Confident | 47 Ų | 47 | 67.5 Ų | 67.5 | 29% | 0.285 | 39% | 0.386 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -127.1 | 130 | 171 | 170.2 | 0 | 0 | 0 | 0 | 109 | F246 L305 L309 | V225-F246 PolarHBondContact N-O 3.01Å; V225-F246 PolarHBondContact O-N 3.36Å; V225-L305 HydrophobicContact CG1-CD1 4.5Å; V225-L305 HydrophobicContact CG1-CD2 4.34Å; V225-L309 HydrophobicContact CB-CD1 4.12Å; V225-L309 HydrophobicContact CG2-CD1 3.76Å; V225-L309 HydrophobicContact CG2-CD2 3.52Å; V225-L309 HydrophobicContact CG2-CG 4.01Å |
| 226 | M | 89 | Confident | 81.9 | Confident | 90 Ų | 90 | 69.5 Ų | 69.5 | 44% | 0.443 | 39% | 0.385 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -92.2 | 123 | 172.5 | -64.1 | -169.1 | 68.3 | 0 | 0 | 109.6 | I189 Y224 K243 R244 | I189-M226 HydrophobicContact CB-CE 4.29Å; Y224-M226 HydrophobicContact CD2-CG 4.47Å; M226-K243 HydrophobicContact CE-CD 3.87Å; M226-R244 WeakPolarHBondContact CA-O 3.47Å |
| 227 | S | 83.9 | Confident | 80.9 | Confident | 46 Ų | 46 | 76.3 Ų | 76.3 | 32% | 0.322 | 41% | 0.414 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -117.9 | 143.9 | 175.8 | -173.4 | 0 | 0 | 0 | 0 | 111.3 | R244 | S227-R244 PolarHBondContact N-O 2.88Å; S227-R244 PolarHBondContact O-N 2.82Å |
| 228 | G | 79.8 | Confident | 79.7 | Confident | 56 Ų | 56 | 78.6 Ų | 78.6 | 58% | 0.577 | 41% | 0.414 | S | S | * | . | trans | 76.1 | -154.6 | -179.1 | 0 | 0 | 0 | 0 | 0 | 113.6 | G230 | G228-G230 VanDerWaalsContact C-N 3.26Å; G228-G230 PolarHBondContact O-N 3.38Å | ||
| 229 | G | 73.3 | Confident | 78.8 | Confident | 19 Ų | 19 | 86.2 Ų | 86.2 | 20% | 0.196 | 44% | 0.435 | C | S | . | . | trans | 82.1 | -5.9 | -176.5 | 0 | 0 | 0 | 0 | 0 | 116.8 | G241 | G229-G241 WeakPolarHBondContact CA-O 3.47Å; G229-G241 PolarHBondContact N-O 3.27Å | ||
| 230 | G | 70.2 | Confident | 78.2 | Confident | 30 Ų | 30 | 89.5 Ų | 89.5 | 31% | 0.309 | 45% | 0.451 | S | S | . | . | S | Bend | trans | -76.4 | 149.2 | 177 | 0 | 0 | 0 | 0 | 0 | 112.1 | G228 K232 G241 | G228-G230 VanDerWaalsContact C-N 3.26Å; G228-G230 PolarHBondContact O-N 3.38Å; G230-K232 PolarHBondContact O-N 2.7Å; G230-G241 PolarHBondContact O-N 3.38Å |
| 231 | P | 69.6 | Low | 77.5 | Confident | 26 Ų | 26 | 84.1 Ų | 84.1 | 17% | 0.169 | 43% | 0.429 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -59.8 | 123.9 | 161 | 26.4 | -31.3 | 0 | 0 | 0 | 108.9 | W126 F238 | W126-P231 HydrophobicContact CD2-CG 4.46Å; W126-P231 HydrophobicContact CE3-CB 4.37Å; W126-P231 HydrophobicContact CZ3-CB 4.41Å; P231-F238 HydrophobicContact CB-CD2 4.21Å; P231-F238 HydrophobicContact CB-CE2 3.25Å; P231-F238 HydrophobicContact CB-CZ 3.81Å |
| 232 | K | 70 | Confident | 77 | Confident | 128 Ų | 128 | 84.2 Ų | 84.2 | 56% | 0.557 | 44% | 0.437 | S | S | * | . | E | Extended strand (participates in β ladder) | trans | -112.1 | 127.4 | 171 | -68.3 | -167.8 | 174.2 | -171.1 | 0 | 108.5 | G230 R239 | G230-K232 PolarHBondContact O-N 2.7Å; K232-R239 PolarHBondContact N-O 3.46Å; K232-R239 PolarHBondContact O-N 2.91Å |
| 233 | L | 69.6 | Low | 76.7 | Confident | 68 Ų | 68 | 83.3 Ų | 83.3 | 36% | 0.356 | 44% | 0.435 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -99.6 | 91.7 | 172.3 | -153.8 | 81.2 | 0 | 0 | 0 | 107.6 | F238 | L233-F238 HydrophobicContact CD1-CB 4.35Å; L233-F238 HydrophobicContact CD1-CD2 4.46Å |
| 234 | K | 68.4 | Low | 76.6 | Confident | 150 Ų | 150 | 86.7 Ų | 86.7 | 65% | 0.652 | 44% | 0.443 | S | S | * | . | E | Extended strand (participates in β ladder) | trans | -105.6 | 121.9 | 171.2 | -172.1 | 176.1 | 176.3 | 176.6 | 0 | 107.3 | F236 K237 | K234-F236 PolarHBondContact O-N 3.24Å; K234-K237 WeakPolarHBondContact O-CB 3.42Å; K234-K237 PolarHBondContact O-N 3.48Å |
| 235 | D | 69.8 | Low | 76.5 | Confident | 128 Ų | 128 | 80.7 Ų | 80.7 | 68% | 0.684 | 42% | 0.42 | S | S | * | . | T | Hydrogen-bonded Turn | trans | 56.2 | 43.1 | 178.7 | -46.3 | -43.4 | 0 | 0 | 0 | 113.9 | K237 | D235-K237 PolarHBondContact O-N 2.82Š|
| 236 | F | 67.9 | Low | 76.6 | Confident | 144 Ų | 144 | 78.9 Ų | 78.9 | 63% | 0.632 | 41% | 0.408 | S | S | * | . | T | Hydrogen-bonded Turn | trans | 57.7 | 7.4 | -174.1 | -70.3 | -90.7 | 0 | 0 | 0 | 115.3 | R115 K234 | R115-F236 HydrophobicContact CB-CE2 4.42Å; R115-F236 HydrophobicContact CB-CZ 4.11Å; R115-F236 HydrophobicContact CG-CZ 4.06Å; K234-F236 PolarHBondContact O-N 3.24Å |
| 237 | K | 71.7 | Confident | 76.8 | Confident | 152 Ų | 152 | 74.8 Ų | 74.8 | 66% | 0.661 | 39% | 0.388 | S | S | * | . | E | Extended strand (participates in β ladder) | trans | -93.9 | 110.5 | 172.9 | -68.1 | 179 | -179.1 | 174.7 | 0 | 108.9 | K234 D235 R239 | K234-K237 WeakPolarHBondContact O-CB 3.42Å; K234-K237 PolarHBondContact O-N 3.48Å; D235-K237 PolarHBondContact O-N 2.82Å; K237-R239 PolarHBondContact O-N 2.9Å; K237-R239 VanDerWaalsContact O-N 3.1Å |
| 238 | F | 69 | Low | 77.3 | Confident | 101 Ų | 101 | 72.6 Ų | 72.6 | 44% | 0.443 | 37% | 0.373 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -65.5 | 108 | 172.9 | -176.2 | -112 | 0 | 0 | 0 | 109.8 | W126 P231 L233 L240 | W126-F238 HydrophobicContact CE3-CE2 4.27Å; W126-F238 AromaticContact CH2-CD2 3.34Å; W126-F238 HydrophobicContact CH2-CD2 3.34Å; W126-F238 AromaticContact CH2-CE2 2.94Å; W126-F238 HydrophobicContact CH2-CE2 2.94Å; W126-F238 HydrophobicContact CH2-CG 4.36Å; W126-F238 AromaticContact CH2-CZ 3.71Å; W126-F238 HydrophobicContact CH2-CZ 3.71Å; W126-F238 HydrophobicContact CZ2-CD2 4.41Å; W126-F238 AromaticContact CZ2-CE2 3.63Å; W126-F238 HydrophobicContact CZ2-CE2 3.63Å; W126-F238 HydrophobicContact CZ2-CZ 4.02Å; W126-F238 AromaticContact CZ3-CD2 3.48Å; W126-F238 HydrophobicContact CZ3-CD2 3.48Å; W126-F238 VanDerWaalsContact CZ3-CD2 3.48Å; W126-F238 AromaticContact CZ3-CE2 3.3Å; W126-F238 HydrophobicContact CZ3-CE2 3.3Å; W126-F238 HydrophobicContact CZ3-CZ 4.42Å; P231-F238 HydrophobicContact CB-CD2 4.21Å; P231-F238 HydrophobicContact CB-CE2 3.25Å; P231-F238 HydrophobicContact CB-CZ 3.81Å; L233-F238 HydrophobicContact CD1-CB 4.35Å; L233-F238 HydrophobicContact CD1-CD2 4.46Å; F238-L240 HydrophobicContact CD1-CD1 3.88Å; F238-L240 HydrophobicContact CE1-CD1 3.26Å; F238-L240 HydrophobicContact CE1-CG 4.03Å; F238-L240 HydrophobicContact CZ-CD1 3.91Å; F238-L240 HydrophobicContact CZ-CG 4.18Å |
| 239 | R | 70.5 | Confident | 78 | Confident | 185 Ų | 185 | 69.9 Ų | 69.9 | 70% | 0.698 | 35% | 0.345 | S | S | * | . | E | Extended strand (participates in β ladder) | trans | -116.6 | 117.9 | 173.7 | -62.6 | -167.6 | 77.7 | 172.6 | 4.9 | 109.1 | K232 K237 G241 | K232-R239 PolarHBondContact N-O 3.46Å; K232-R239 PolarHBondContact O-N 2.91Å; K237-R239 PolarHBondContact O-N 2.9Å; K237-R239 VanDerWaalsContact O-N 3.1Å; R239-G241 PolarHBondContact O-N 3.07Å |
| 240 | L | 73.9 | Confident | 79 | Confident | 105 Ų | 105 | 69.3 Ų | 69.3 | 55% | 0.55 | 34% | 0.338 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -72.6 | 116.3 | 164.5 | -69.2 | 94.1 | 0 | 0 | 0 | 108.3 | F238 | F238-L240 HydrophobicContact CD1-CD1 3.88Å; F238-L240 HydrophobicContact CE1-CD1 3.26Å; F238-L240 HydrophobicContact CE1-CG 4.03Å; F238-L240 HydrophobicContact CZ-CD1 3.91Å; F238-L240 HydrophobicContact CZ-CG 4.18Å |
| 241 | G | 73.6 | Confident | 80.2 | Confident | 30 Ų | 30 | 68 Ų | 68 | 31% | 0.309 | 32% | 0.324 | S | S | . | . | P | Polyproline II helix | trans | -63.9 | 136.3 | 170.5 | 0 | 0 | 0 | 0 | 0 | 109.9 | G229 G230 R239 K243 | G229-G241 WeakPolarHBondContact CA-O 3.47Å; G229-G241 PolarHBondContact N-O 3.27Å; G230-G241 PolarHBondContact O-N 3.38Å; R239-G241 PolarHBondContact O-N 3.07Å; G241-K243 PolarHBondContact O-N 3.12Å |
| 242 | G | 78.2 | Confident | 81.3 | Confident | 34 Ų | 34 | 72.5 Ų | 72.5 | 35% | 0.351 | 34% | 0.341 | S | S | . | . | P | Polyproline II helix | trans | -61.7 | 132.9 | 169.5 | 0 | 0 | 0 | 0 | 0 | 110 | ||
| 243 | K | 86.4 | Confident | 82.4 | Confident | 64 Ų | 64 | 66.8 Ų | 66.8 | 28% | 0.278 | 32% | 0.318 | S | S | . | . | P | Polyproline II helix | trans | -65.3 | 140.2 | 171.3 | -72.8 | -173.5 | -168 | -177.9 | 0 | 109.4 | F187 I189 M226 G241 K266 | F187-K243 WeakPolarHBondContact O-CD 3.25Å; I189-K243 HydrophobicContact CD1-CB 3.71Å; I189-K243 WeakPolarHBondContact CD1-O 3.25Å; I189-K243 HydrophobicContact CG1-CB 4.02Å; M226-K243 HydrophobicContact CE-CD 3.87Å; G241-K243 PolarHBondContact O-N 3.12Å; K243-K266 PolarHBondContact O-N 3.34Å |
| 244 | R | 89.8 | Confident | 83.5 | Confident | 91 Ų | 91 | 67.4 Ų | 67.4 | 34% | 0.343 | 33% | 0.329 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -118.7 | 146.4 | 169.7 | -61 | -176.1 | -173.2 | -146.7 | 9.8 | 108.3 | M226 S227 F246 E263 V264 K265 | M226-R244 WeakPolarHBondContact CA-O 3.47Å; S227-R244 PolarHBondContact N-O 2.88Å; S227-R244 PolarHBondContact O-N 2.82Å; R244-F246 HydrophobicContact CB-CE2 4.09Å; R244-E263 WeakPolarHBondContact CD-OE1 3.5Å; R244-E263 IonicContact CZ-OE1 2.78Å; R244-E263 IonicContact NE-OE1 3.05Å; R244-E263 IonicContact NH1-OE1 3.94Å; R244-E263 PolarHBondContact NH1-OE1 2.86Å; R244-V264 CarbonylContact C-O 3.59Å; R244-V264 VanDerWaalsContact CA-O 3.27Å; R244-V264 WeakPolarHBondContact CA-O 3.2Å; R244-K265 HydrophobicContact CG-CB 4.34Å; R244-K265 HydrophobicContact CG-CD 4.44Å; R244-K265 HydrophobicContact CG-CG 4.21Å |
| 245 | C | 91.5 | Very high | 84.6 | Confident | 1 Ų | 1 | 66.8 Ų | 66.8 | 1% | 0.007 | 33% | 0.328 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -126.4 | 122.5 | 174.2 | -175.8 | 0 | 0 | 0 | 0 | 107.2 | I189 V264 | I189-C245 HydrophobicContact CB-CB 4.44Å; I189-C245 HydrophobicContact CD1-CB 4.07Å; I189-C245 HydrophobicContact CG2-CB 3.7Å; C245-V264 PolarHBondContact N-O 3.37Å; C245-V264 PolarHBondContact O-N 3.2Å |
| 246 | F | 92.7 | Very high | 85.6 | Confident | 9 Ų | 9 | 65.3 Ų | 65.3 | 4% | 0.039 | 31% | 0.313 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -97.2 | 125.2 | 168.7 | -60.7 | -86.7 | 0 | 0 | 0 | 105.9 | Y224 V225 R244 V262 E263 L305 I306 | Y224-F246 CarbonylContact C-O 3.5Å; Y224-F246 WeakPolarHBondContact CA-O 3.5Å; Y224-F246 WeakPolarHBondContact CB-O 2.97Å; V225-F246 PolarHBondContact N-O 3.01Å; V225-F246 PolarHBondContact O-N 3.36Å; R244-F246 HydrophobicContact CB-CE2 4.09Å; F246-V262 CarbonylContact C-O 3.52Å; F246-V262 WeakPolarHBondContact CA-O 3.21Å; F246-E263 HydrophobicContact CD1-CB 4.02Å; F246-E263 HydrophobicContact CD1-CG 3.9Å; F246-E263 HydrophobicContact CE1-CB 3.94Å; F246-E263 HydrophobicContact CE1-CG 3.45Å; F246-E263 VanDerWaalsContact CE1-CG 3.45Å; F246-E263 WeakPolarHBondContact CE1-OE2 3.27Å; F246-E263 HydrophobicContact CZ-CG 3.97Å; F246-L305 HydrophobicContact CD2-CB 4.22Å; F246-L305 HydrophobicContact CD2-CD1 3.66Å; F246-L305 HydrophobicContact CE2-CD1 3.47Å; F246-L305 VanDerWaalsContact CE2-CD1 3.47Å; F246-L305 HydrophobicContact CG-CB 4.25Å; F246-L305 HydrophobicContact CG-CD1 4.49Å; F246-L305 HydrophobicContact CZ-CD1 4.16Å; F246-I306 HydrophobicContact CB-CG1 4.33Å; F246-I306 HydrophobicContact CD1-CD1 4.01Å; F246-I306 HydrophobicContact CD1-CG1 3.83Å; F246-I306 HydrophobicContact CG-CG1 4.48Å |
| 247 | L | 93.4 | Very high | 86.7 | Confident | 3 Ų | 3 | 65 Ų | 65 | 2% | 0.016 | 31% | 0.311 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -127.7 | 132.4 | -179.9 | 174.6 | 76.3 | 0 | 0 | 0 | 107.2 | V194 R222 A223 F249 V262 | V194-L247 HydrophobicContact CG1-CD2 4Å; R222-L247 HydrophobicContact CB-CD1 4.44Å; A223-L247 WeakPolarHBondContact O-CA 3.32Å; L247-F249 HydrophobicContact CD2-CD1 3.83Å; L247-F249 HydrophobicContact CD2-CE1 3.84Å; L247-F249 HydrophobicContact CG-CD1 3.91Å; L247-F249 HydrophobicContact CG-CE1 4.33Å; L247-V262 HydrophobicContact CB-CB 4.28Å; L247-V262 PolarHBondContact N-O 3.38Å; L247-V262 PolarHBondContact O-N 3Å |
| 248 | I | 93.8 | Very high | 87.7 | Confident | 0 Ų | 0 | 58.1 Ų | 58.1 | 0% | 0 | 28% | 0.283 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -127.2 | 136.6 | 173 | -168.1 | 168.3 | 0 | 0 | 0 | 109 | A223 L259 V260 I306 L309 R310 I313 | A223-I248 HydrophobicContact CB-CG2 3.84Å; A223-I248 PolarHBondContact N-O 2.87Å; A223-I248 PolarHBondContact O-N 2.88Å; I248-L259 HydrophobicContact CD1-CD2 3.54Å; I248-L259 HydrophobicContact CD1-CG 4.07Å; I248-L259 HydrophobicContact CG1-CD2 4.05Å; I248-L259 HydrophobicContact CG1-CG 4Å; I248-V260 VanDerWaalsContact CA-O 3.25Å; I248-V260 WeakPolarHBondContact CA-O 3.36Å; I248-V260 WeakPolarHBondContact CG1-O 3.28Å; I248-I306 HydrophobicContact CD1-CG2 4.21Å; I248-L309 HydrophobicContact CG2-CB 3.5Å; I248-L309 VanDerWaalsContact CG2-CB 3.5Å; I248-L309 HydrophobicContact CG2-CD1 4.18Å; I248-L309 HydrophobicContact CG2-CG 4.45Å; I248-R310 HydrophobicContact CD1-CB 4.46Å; I248-R310 HydrophobicContact CD1-CG 3.58Å; I248-I313 HydrophobicContact CG2-CG1 3.91Å |
| 249 | F | 94.8 | Very high | 88.9 | Confident | 0 Ų | 0 | 54 Ų | 54 | 0% | 0 | 27% | 0.266 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -154.6 | 149.2 | 178.4 | 59.3 | -86.6 | 0 | 0 | 0 | 111.6 | Y195 A198 M199 L202 R222 L247 V260 V262 | Y195-F249 AromaticContact CD2-CD1 3.94Å; Y195-F249 HydrophobicContact CD2-CD1 3.94Å; Y195-F249 HydrophobicContact CD2-CD2 4.03Å; Y195-F249 AromaticContact CD2-CE1 3.9Å; Y195-F249 HydrophobicContact CD2-CE1 3.9Å; Y195-F249 AromaticContact CD2-CE2 3.99Å; Y195-F249 HydrophobicContact CD2-CE2 3.99Å; Y195-F249 AromaticContact CD2-CG 3.99Å; Y195-F249 HydrophobicContact CD2-CG 3.99Å; Y195-F249 AromaticContact CD2-CZ 3.91Å; Y195-F249 HydrophobicContact CD2-CZ 3.91Å; Y195-F249 HydrophobicContact CE2-CD1 4.36Å; Y195-F249 AromaticContact CE2-CD2 3.62Å; Y195-F249 HydrophobicContact CE2-CD2 3.62Å; Y195-F249 HydrophobicContact CE2-CE1 4.4Å; Y195-F249 AromaticContact CE2-CE2 3.66Å; Y195-F249 HydrophobicContact CE2-CE2 3.66Å; Y195-F249 AromaticContact CE2-CG 3.97Å; Y195-F249 HydrophobicContact CE2-CG 3.97Å; Y195-F249 HydrophobicContact CE2-CZ 4.06Å; A198-F249 HydrophobicContact CB-CE1 4.32Å; A198-F249 HydrophobicContact CB-CZ 4.15Å; M199-F249 HydrophobicContact SD-CE2 4.45Å; L202-F249 HydrophobicContact CD1-CE2 4.23Å; L202-F249 HydrophobicContact CD1-CZ 4.02Å; R222-F249 HydrophobicContact CB-CB 4.38Å; R222-F249 HydrophobicContact CG-CB 3.95Å; L247-F249 HydrophobicContact CD2-CD1 3.83Å; L247-F249 HydrophobicContact CD2-CE1 3.84Å; L247-F249 HydrophobicContact CG-CD1 3.91Å; L247-F249 HydrophobicContact CG-CE1 4.33Å; F249-V260 HydrophobicContact CD1-CB 4.23Å; F249-V260 HydrophobicContact CD2-CB 4.13Å; F249-V260 HydrophobicContact CD2-CG2 4.14Å; F249-V260 HydrophobicContact CE1-CB 3.91Å; F249-V260 HydrophobicContact CE1-CG1 3.82Å; F249-V260 HydrophobicContact CE2-CB 3.8Å; F249-V260 HydrophobicContact CE2-CG1 4.22Å; F249-V260 HydrophobicContact CE2-CG2 3.68Å; F249-V260 HydrophobicContact CG-CB 4.35Å; F249-V260 HydrophobicContact CZ-CB 3.69Å; F249-V260 HydrophobicContact CZ-CG1 3.63Å; F249-V260 HydrophobicContact CZ-CG2 3.98Å; F249-V260 PolarHBondContact N-O 2.91Å; F249-V260 VanDerWaalsContact N-O 3.16Å; F249-V260 PolarHBondContact O-N 3.23Å; F249-V262 HydrophobicContact CE1-CG2 3.82Å |
| 250 | P | 94.8 | Very high | 90 | Very high | 6 Ų | 6 | 45.2 Ų | 45.2 | 4% | 0.039 | 23% | 0.233 | C | C | . | . | E | Extended strand (participates in β ladder) | trans | -72.7 | 146.8 | 172 | -9.6 | 26.4 | 0 | 0 | 0 | 111.8 | T219 V221 L259 I313 M317 | T219-P250 HydrophobicContact CG2-CB 4.04Å; T219-P250 HydrophobicContact CG2-CG 4.48Å; T219-P250 PolarHBondContact N-O 2.68Å; T219-P250 WeakPolarHBondContact OG1-CB 3.46Å; T219-P250 VanDerWaalsContact OG1-CD 3.25Å; T219-P250 WeakPolarHBondContact OG1-CD 3.39Å; T219-P250 WeakPolarHBondContact OG1-CG 3.4Å; V221-P250 WeakPolarHBondContact O-CD 3.03Å; P250-L259 HydrophobicContact CG-CD1 4.47Å; P250-I313 HydrophobicContact CG-CG2 4.24Å; P250-M317 HydrophobicContact CB-CG 4.36Å; P250-M317 HydrophobicContact CB-SD 3.49Å; P250-M317 WeakPolarHBondContact CB-SD 3.17Å; P250-M317 HydrophobicContact CG-CG 3.69Å; P250-M317 HydrophobicContact CG-SD 3.37Å; P250-M317 WeakPolarHBondContact CG-SD 3.31Å |
| 251 | I | 94.7 | Very high | 91 | Very high | 3 Ų | 3 | 40.2 Ų | 40.2 | 2% | 0.015 | 21% | 0.206 | C | C | . | . | E | Extended strand (participates in β ladder) | trans | -131 | 144.6 | 171.5 | -163.8 | 163.3 | 0 | 0 | 0 | 109.8 | M199 L202 M212 L216 K257 G258 V260 V278 | M199-I251 HydrophobicContact CE-CD1 3.81Å; M199-I251 HydrophobicContact CE-CG1 4.17Å; M199-I251 HydrophobicContact SD-CD1 3.81Å; L202-I251 HydrophobicContact CB-CD1 4.37Å; L202-I251 HydrophobicContact CD1-CD1 3.7Å; M212-I251 HydrophobicContact CE-CD1 4.11Å; M212-I251 HydrophobicContact CE-CG1 4.32Å; M212-I251 HydrophobicContact CE-CG2 3.66Å; M212-I251 HydrophobicContact SD-CG2 3.84Å; L216-I251 HydrophobicContact CB-CD1 3.72Å; L216-I251 HydrophobicContact CB-CG1 4Å; L216-I251 HydrophobicContact CD1-CD1 3.93Å; L216-I251 HydrophobicContact CG-CD1 4.33Å; I251-K257 CarbonylContact O-C 3.51Å; I251-K257 WeakPolarHBondContact O-CA 3.41Å; I251-G258 PolarHBondContact N-O 3.43Å; I251-G258 PolarHBondContact O-N 2.95Å; I251-V260 HydrophobicContact CB-CG2 3.87Å; I251-V260 HydrophobicContact CD1-CG2 4.28Å; I251-V260 HydrophobicContact CG2-CG2 3.58Å; I251-V278 HydrophobicContact CG2-CG1 4.38Å |
| 252 | K | 93.6 | Very high | 91.9 | Very high | 120 Ų | 120 | 38.8 Ų | 38.8 | 52% | 0.522 | 19% | 0.192 | S | C | . | . | E | Extended strand (participates in β ladder) | trans | -123.1 | 119.2 | 178.2 | -178.6 | 179.2 | 177.9 | -175.1 | 0 | 108.1 | A217 K257 | A217-K252 PolarHBondContact N-O 3.16Å; A217-K252 PolarHBondContact O-N 3.27Å; K252-K257 HydrophobicContact CG-CG 4.31Å |
| 253 | G | 92.8 | Very high | 92.6 | Very high | 9 Ų | 9 | 37.5 Ų | 37.5 | 9% | 0.093 | 18% | 0.177 | C | C | . | . | trans | -94.2 | -177.2 | 163.6 | 0 | 0 | 0 | 0 | 0 | 111.2 | M212 G213 E255 R256 | M212-G253 CarbonylContact O-C 3.58Å; M212-G253 VanDerWaalsContact O-CA 3.3Å; M212-G253 WeakPolarHBondContact O-CA 3.46Å; G213-G253 WeakPolarHBondContact O-CA 3.48Å; G253-E255 VanDerWaalsContact C-N 3.31Å; G253-R256 PolarHBondContact N-O 2.82Å | ||
| 254 | S | 92.3 | Very high | 93 | Very high | 81 Ų | 81 | 34.5 Ų | 34.5 | 57% | 0.566 | 16% | 0.163 | S | C | * | . | S | Bend | trans | -71.4 | -26 | 176.9 | 45.6 | 0 | 0 | 0 | 0 | 113.1 | M212 G213 A214 | M212-S254 PolarHBondContact O-N 3.45Å; G213-S254 WeakPolarHBondContact CA-OG 3.39Å; G213-S254 PolarHBondContact O-N 3.24Å; A214-S254 PolarHBondContact N-OG 2.8Å; A214-S254 WeakPolarHBondContact O-CB 3.37Å; A214-S254 PolarHBondContact O-OG 2.88Å |
| 255 | E | 90.8 | Very high | 93.1 | Very high | 136 Ų | 136 | 32.6 Ų | 32.6 | 64% | 0.636 | 16% | 0.158 | S | C | * | . | S | Bend | trans | -104 | -44.7 | -179.1 | -59.4 | -176.5 | -179 | 0 | 0 | 112.4 | M212 G253 | M212-E255 WeakPolarHBondContact O-CB 3.03Å; M212-E255 PolarHBondContact O-N 2.9Å; G253-E255 VanDerWaalsContact C-N 3.31Å |
| 256 | R | 91.5 | Very high | 92.9 | Very high | 97 Ų | 97 | 33.6 Ų | 33.6 | 37% | 0.366 | 16% | 0.162 | S | C | . | . | trans | -136.3 | 154.7 | -171.6 | -59.8 | -173.6 | -175.1 | 179.2 | 3 | 113 | M212 G253 I280 M282 | M212-R256 PolarHBondContact O-N 2.88Å; G253-R256 PolarHBondContact N-O 2.82Å; R256-I280 HydrophobicContact CB-CG2 4.13Å; R256-M282 PolarHBondContact NH1-SD 3.3Å | ||
| 257 | K | 91.8 | Very high | 92.6 | Very high | 138 Ų | 138 | 37.7 Ų | 37.7 | 60% | 0.6 | 18% | 0.18 | S | C | * | . | E | Extended strand (participates in β ladder) | trans | -94 | 155.4 | 167.8 | -63.2 | -178 | -179.3 | -174.9 | 0 | 109.2 | I251 K252 P281 | I251-K257 CarbonylContact O-C 3.51Å; I251-K257 WeakPolarHBondContact O-CA 3.41Å; K252-K257 HydrophobicContact CG-CG 4.31Å; K257-P281 WeakPolarHBondContact O-CD 3.44Å |
| 258 | G | 92.4 | Very high | 92.1 | Very high | 7 Ų | 7 | 47.4 Ų | 47.4 | 7% | 0.072 | 22% | 0.222 | C | C | . | . | E | Extended strand (participates in β ladder) | trans | -153.7 | 169.9 | 176.2 | 0 | 0 | 0 | 0 | 0 | 112.6 | I251 D279 | I251-G258 PolarHBondContact N-O 3.43Å; I251-G258 PolarHBondContact O-N 2.95Å; G258-D279 CarbonylContact C-O 3.44Å; G258-D279 WeakPolarHBondContact CA-O 2.94Å |
| 259 | L | 93.2 | Very high | 91.5 | Very high | 16 Ų | 16 | 48.5 Ų | 48.5 | 8% | 0.084 | 23% | 0.233 | C | C | . | . | E | Extended strand (participates in β ladder) | trans | -117.3 | 121.7 | 177.6 | -154.6 | 76.2 | 0 | 0 | 0 | 109.2 | I248 P250 V278 D279 R310 I313 M317 | I248-L259 HydrophobicContact CD1-CD2 3.54Å; I248-L259 HydrophobicContact CD1-CG 4.07Å; I248-L259 HydrophobicContact CG1-CD2 4.05Å; I248-L259 HydrophobicContact CG1-CG 4Å; P250-L259 HydrophobicContact CG-CD1 4.47Å; L259-V278 WeakPolarHBondContact O-CA 3.41Å; L259-D279 HydrophobicContact CB-CB 4.48Å; L259-D279 PolarHBondContact N-O 3.44Å; L259-D279 PolarHBondContact O-N 3.02Å; L259-R310 HydrophobicContact CD2-CG 4.13Å; L259-I313 HydrophobicContact CD1-CG2 3.87Å; L259-M317 HydrophobicContact CD1-CE 3.92Å; L259-M317 HydrophobicContact CD1-SD 4.39Å |
| 260 | V | 94.5 | Very high | 91.2 | Very high | 0 Ų | 0 | 55.8 Ų | 55.8 | 0% | 0 | 27% | 0.267 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -95.5 | 126.4 | -177.5 | -173.7 | 0 | 0 | 0 | 0 | 109.6 | L202 I248 F249 I251 V262 L276 A277 V278 | L202-V260 HydrophobicContact CD1-CG1 3.94Å; L202-V260 HydrophobicContact CD1-CG2 3.82Å; I248-V260 VanDerWaalsContact CA-O 3.25Å; I248-V260 WeakPolarHBondContact CA-O 3.36Å; I248-V260 WeakPolarHBondContact CG1-O 3.28Å; F249-V260 HydrophobicContact CD1-CB 4.23Å; F249-V260 HydrophobicContact CD2-CB 4.13Å; F249-V260 HydrophobicContact CD2-CG2 4.14Å; F249-V260 HydrophobicContact CE1-CB 3.91Å; F249-V260 HydrophobicContact CE1-CG1 3.82Å; F249-V260 HydrophobicContact CE2-CB 3.8Å; F249-V260 HydrophobicContact CE2-CG1 4.22Å; F249-V260 HydrophobicContact CE2-CG2 3.68Å; F249-V260 HydrophobicContact CG-CB 4.35Å; F249-V260 HydrophobicContact CZ-CB 3.69Å; F249-V260 HydrophobicContact CZ-CG1 3.63Å; F249-V260 HydrophobicContact CZ-CG2 3.98Å; F249-V260 PolarHBondContact N-O 2.91Å; F249-V260 VanDerWaalsContact N-O 3.16Å; F249-V260 PolarHBondContact O-N 3.23Å; I251-V260 HydrophobicContact CB-CG2 3.87Å; I251-V260 HydrophobicContact CD1-CG2 4.28Å; I251-V260 HydrophobicContact CG2-CG2 3.58Å; V260-V262 HydrophobicContact CG1-CG2 3.72Å; V260-L276 HydrophobicContact CG1-CD1 3.8Å; V260-A277 CarbonylContact C-O 3.39Å; V260-A277 WeakPolarHBondContact CA-O 3.5Å; V260-V278 HydrophobicContact CG2-CG2 4.17Å |
| 261 | S | 93.7 | Very high | 91 | Very high | 0 Ų | 0 | 57.9 Ų | 57.9 | 0% | 0 | 28% | 0.275 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -108.7 | 122.1 | 174 | -60.4 | 0 | 0 | 0 | 0 | 110.1 | A277 I306 R310 | S261-A277 PolarHBondContact N-O 3.01Å; S261-A277 PolarHBondContact O-N 3.44Å; S261-I306 WeakPolarHBondContact OG-CG2 3.22Å; S261-R310 PolarHBondContact OG-NH2 3.47Å |
| 262 | V | 94.1 | Very high | 90.9 | Very high | 0 Ų | 0 | 60 Ų | 60 | 0% | 0 | 29% | 0.286 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -126.4 | 129.9 | -176.7 | -166.7 | 0 | 0 | 0 | 0 | 111.2 | V194 A198 F246 L247 F249 V260 V264 L275 L276 | V194-V262 HydrophobicContact CG1-CG1 4.13Å; A198-V262 HydrophobicContact CB-CG2 4.12Å; F246-V262 CarbonylContact C-O 3.52Å; F246-V262 WeakPolarHBondContact CA-O 3.21Å; L247-V262 HydrophobicContact CB-CB 4.28Å; L247-V262 PolarHBondContact N-O 3.38Å; L247-V262 PolarHBondContact O-N 3Å; F249-V262 HydrophobicContact CE1-CG2 3.82Å; V260-V262 HydrophobicContact CG1-CG2 3.72Å; V262-V264 HydrophobicContact CG1-CG2 3.67Å; V262-L275 WeakPolarHBondContact CA-O 3.35Å; V262-L276 HydrophobicContact CG2-CD1 3.73Å |
| 263 | E | 93 | Very high | 90.9 | Very high | 7 Ų | 7 | 55 Ų | 55 | 3% | 0.033 | 27% | 0.265 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -114.4 | 124.3 | 164.9 | -176.4 | -177.7 | 165 | 0 | 0 | 109.9 | R244 F246 K274 L275 | R244-E263 WeakPolarHBondContact CD-OE1 3.5Å; R244-E263 IonicContact CZ-OE1 2.78Å; R244-E263 IonicContact NE-OE1 3.05Å; R244-E263 IonicContact NH1-OE1 3.94Å; R244-E263 PolarHBondContact NH1-OE1 2.86Å; F246-E263 HydrophobicContact CD1-CB 4.02Å; F246-E263 HydrophobicContact CD1-CG 3.9Å; F246-E263 HydrophobicContact CE1-CB 3.94Å; F246-E263 HydrophobicContact CE1-CG 3.45Å; F246-E263 VanDerWaalsContact CE1-CG 3.45Å; F246-E263 WeakPolarHBondContact CE1-OE2 3.27Å; F246-E263 HydrophobicContact CZ-CG 3.97Å; E263-K274 HydrophobicContact CB-CB 4.21Å; E263-K274 HydrophobicContact CG-CB 4.07Å; E263-K274 PolarHBondContact O-N 2.82Å; E263-L275 HydrophobicContact CB-CB 3.73Å; E263-L275 PolarHBondContact N-O 3.46Å; E263-L275 PolarHBondContact O-N 3.07Å |
| 264 | V | 93.4 | Very high | 90.8 | Very high | 0 Ų | 0 | 57.1 Ų | 57.1 | 0% | 0 | 27% | 0.271 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -126 | 134.8 | 175.3 | -174.7 | 0 | 0 | 0 | 0 | 111.4 | V194 R244 C245 V262 Y271 M273 | V194-V264 HydrophobicContact CB-CG2 4.44Å; V194-V264 HydrophobicContact CG1-CB 4.21Å; V194-V264 HydrophobicContact CG1-CG2 3.43Å; V194-V264 VanDerWaalsContact CG1-CG2 3.43Å; V194-V264 HydrophobicContact CG2-CB 4.19Å; V194-V264 HydrophobicContact CG2-CG1 4.24Å; V194-V264 HydrophobicContact CG2-CG2 4.2Å; R244-V264 CarbonylContact C-O 3.59Å; R244-V264 VanDerWaalsContact CA-O 3.27Å; R244-V264 WeakPolarHBondContact CA-O 3.2Å; C245-V264 PolarHBondContact N-O 3.37Å; C245-V264 PolarHBondContact O-N 3.2Å; V262-V264 HydrophobicContact CG1-CG2 3.67Å; V264-Y271 HydrophobicContact CG1-CD1 3.78Å; V264-Y271 HydrophobicContact CG1-CG 4.29Å; V264-M273 HydrophobicContact CG2-CG 3.81Å |
| 265 | K | 91.4 | Very high | 90.9 | Very high | 51 Ų | 51 | 53.2 Ų | 53.2 | 22% | 0.222 | 24% | 0.244 | C | C | . | . | E | Extended strand (participates in β ladder) | trans | -111.6 | 130.4 | 171.5 | -173 | 170.9 | 178.4 | 177.9 | 0 | 109.8 | R244 K267 D272 K274 | R244-K265 HydrophobicContact CG-CB 4.34Å; R244-K265 HydrophobicContact CG-CD 4.44Å; R244-K265 HydrophobicContact CG-CG 4.21Å; K265-K267 HydrophobicContact CG-CG 4.31Å; K265-D272 PolarHBondContact N-O 2.89Å; K265-D272 WeakPolarHBondContact O-CB 3.29Å; K265-D272 PolarHBondContact O-N 3.31Å; K265-K274 HydrophobicContact CB-CG 4.45Å |
| 266 | K | 88.8 | Confident | 91.1 | Very high | 23 Ų | 23 | 46.8 Ų | 46.8 | 10% | 0.1 | 21% | 0.214 | C | C | . | . | E | Extended strand (participates in β ladder) | trans | -92.9 | 120.4 | 175.7 | -168.3 | 168.2 | -176.2 | 176.5 | 0 | 110.7 | S185 R186 T188 I189 K243 Q270 Y271 | S185-K266 PolarHBondContact O-NZ 2.74Å; R186-K266 WeakPolarHBondContact O-CE 3.15Å; T188-K266 WeakPolarHBondContact O-CD 3.38Å; T188-K266 PolarHBondContact O-NZ 2.8Å; I189-K266 HydrophobicContact CD1-CB 3.81Å; I189-K266 HydrophobicContact CG1-CB 3.65Å; I189-K266 HydrophobicContact CG1-CD 4.04Å; K243-K266 PolarHBondContact O-N 3.34Å; K266-Q270 WeakPolarHBondContact CA-O 3.42Å; K266-Y271 HydrophobicContact CD-CE1 4.05Å; K266-Y271 PolarHBondContact NZ-OH 2.82Å |
| 267 | K | 85.7 | Confident | 91.2 | Very high | 95 Ų | 95 | 42.2 Ų | 42.2 | 41% | 0.413 | 20% | 0.197 | S | C | . | . | E | Extended strand (participates in β ladder) | trans | -125.7 | 125.9 | 178.9 | -67.9 | 176.8 | -177.6 | 160.1 | 0 | 109.2 | K265 G269 Q270 D272 | K265-K267 HydrophobicContact CG-CG 4.31Å; K267-G269 PolarHBondContact O-N 3.16Å; K267-Q270 PolarHBondContact N-O 3.49Å; K267-Q270 PolarHBondContact O-N 3.4Å; K267-D272 WeakPolarHBondContact CE-OD2 3.46Å; K267-D272 IonicContact NZ-OD2 3.23Å; K267-D272 PolarHBondContact NZ-OD2 3.12Å |
| 268 | K | 82.1 | Confident | 91.3 | Very high | 207 Ų | 207 | 35.7 Ų | 35.7 | 90% | 0.9 | 17% | 0.169 | S | C | * | . | T | Hydrogen-bonded Turn | trans | 49.4 | 30 | 177.6 | -58.9 | -177 | 179.5 | -178.5 | 0 | 114.4 | ||
| 269 | G | 82.5 | Confident | 91.3 | Very high | 23 Ų | 23 | 35.4 Ų | 35.4 | 24% | 0.237 | 17% | 0.166 | C | C | . | . | T | Hydrogen-bonded Turn | trans | 91.6 | -11.2 | -178.2 | 0 | 0 | 0 | 0 | 0 | 116.1 | K267 | K267-G269 PolarHBondContact O-N 3.16Š|
| 270 | Q | 87.9 | Confident | 91.2 | Very high | 153 Ų | 153 | 34.7 Ų | 34.7 | 72% | 0.715 | 16% | 0.162 | S | C | * | . | E | Extended strand (participates in β ladder) | trans | -95.7 | 148.2 | 176.7 | -65.7 | 179.1 | -5.1 | 0 | 0 | 111.3 | K266 K267 | K266-Q270 WeakPolarHBondContact CA-O 3.42Å; K267-Q270 PolarHBondContact N-O 3.49Å; K267-Q270 PolarHBondContact O-N 3.4Å |
| 271 | Y | 91.7 | Very high | 90.9 | Very high | 49 Ų | 49 | 38.2 Ų | 38.2 | 19% | 0.192 | 19% | 0.185 | C | C | . | . | E | Extended strand (participates in β ladder) | trans | -91.1 | 112.8 | 176.1 | -66.1 | -85 | 0 | 0 | 0 | 108.9 | I189 N190 K193 V194 I197 V264 K266 | I189-Y271 HydrophobicContact CB-CE1 4.43Å; I189-Y271 HydrophobicContact CG2-CD1 4.34Å; I189-Y271 HydrophobicContact CG2-CE1 3.71Å; N190-Y271 PolarHBondContact N-OH 2.86Å; K193-Y271 HydrophobicContact CD-CE2 3.6Å; K193-Y271 HydrophobicContact CG-CE2 3.97Å; V194-Y271 HydrophobicContact CG2-CD1 3.86Å; V194-Y271 HydrophobicContact CG2-CE1 3.91Å; I197-Y271 HydrophobicContact CD1-CD2 4.04Å; I197-Y271 HydrophobicContact CD1-CG 4.3Å; V264-Y271 HydrophobicContact CG1-CD1 3.78Å; V264-Y271 HydrophobicContact CG1-CG 4.29Å; K266-Y271 HydrophobicContact CD-CE1 4.05Å; K266-Y271 PolarHBondContact NZ-OH 2.82Å |
| 272 | D | 92.1 | Very high | 90.5 | Very high | 48 Ų | 48 | 41.2 Ų | 41.2 | 26% | 0.257 | 20% | 0.2 | S | C | . | . | E | Extended strand (participates in β ladder) | trans | -100 | 102.6 | 176.3 | 178.1 | 13.5 | 0 | 0 | 0 | 107.4 | K265 K267 K274 | K265-D272 PolarHBondContact N-O 2.89Å; K265-D272 WeakPolarHBondContact O-CB 3.29Å; K265-D272 PolarHBondContact O-N 3.31Å; K267-D272 WeakPolarHBondContact CE-OD2 3.46Å; K267-D272 IonicContact NZ-OD2 3.23Å; K267-D272 PolarHBondContact NZ-OD2 3.12Å; D272-K274 PolarHBondContact O-N 2.93Å; D272-K274 IonicContact OD1-NZ 3.63Å; D272-K274 PolarHBondContact OD1-NZ 3.24Å; D272-K274 WeakPolarHBondContact OD2-CE 3.33Å; D272-K274 IonicContact OD2-NZ 3.76Å; D272-K274 PolarHBondContact OD2-NZ 2.96Å |
| 273 | M | 92.5 | Very high | 89.9 | Confident | 16 Ų | 16 | 46.8 Ų | 46.8 | 8% | 0.079 | 25% | 0.245 | C | C | . | . | E | Extended strand (participates in β ladder) | trans | -70.6 | 121 | 175.2 | -74.9 | 173.5 | 164.5 | 0 | 0 | 108.6 | I197 A198 K201 V264 V293 | I197-M273 HydrophobicContact CB-CE 3.8Å; I197-M273 HydrophobicContact CG2-CE 3.39Å; I197-M273 HydrophobicContact CG2-SD 4.22Å; A198-M273 HydrophobicContact CB-CE 4.08Å; K201-M273 HydrophobicContact CD-CE 4.44Å; K201-M273 HydrophobicContact CD-SD 3.57Å; K201-M273 VanDerWaalsContact CD-SD 3.57Å; K201-M273 VanDerWaalsContact CE-SD 3.53Å; K201-M273 PolarHBondContact NZ-SD 2.78Å; V264-M273 HydrophobicContact CG2-CG 3.81Å; M273-V293 HydrophobicContact CB-CG1 4.44Å |
| 274 | K | 92.2 | Very high | 89.2 | Confident | 52 Ų | 52 | 51.9 Ų | 51.9 | 23% | 0.226 | 28% | 0.282 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -90.5 | -50 | 175.3 | -69.5 | -77.6 | 145.9 | -103.6 | 0 | 108.9 | E263 K265 D272 G294 | E263-K274 HydrophobicContact CB-CB 4.21Å; E263-K274 HydrophobicContact CG-CB 4.07Å; E263-K274 PolarHBondContact O-N 2.82Å; K265-K274 HydrophobicContact CB-CG 4.45Å; D272-K274 PolarHBondContact O-N 2.93Å; D272-K274 IonicContact OD1-NZ 3.63Å; D272-K274 PolarHBondContact OD1-NZ 3.24Å; D272-K274 WeakPolarHBondContact OD2-CE 3.33Å; D272-K274 IonicContact OD2-NZ 3.76Å; D272-K274 PolarHBondContact OD2-NZ 2.96Å; K274-G294 WeakPolarHBondContact O-CA 3.27Å; K274-G294 PolarHBondContact O-N 3.4Å |
| 275 | L | 93.4 | Very high | 88.4 | Confident | 0 Ų | 0 | 54.3 Ų | 54.3 | 0% | 0 | 31% | 0.307 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -125.9 | 135.6 | -179.4 | -176.7 | 69 | 0 | 0 | 0 | 110.3 | V262 E263 A277 F291 V293 Y299 I306 | V262-L275 WeakPolarHBondContact CA-O 3.35Å; E263-L275 HydrophobicContact CB-CB 3.73Å; E263-L275 PolarHBondContact N-O 3.46Å; E263-L275 PolarHBondContact O-N 3.07Å; L275-A277 HydrophobicContact CD1-CB 4.24Å; L275-A277 HydrophobicContact CG-CB 4.49Å; L275-F291 HydrophobicContact CD1-CD1 4.08Å; L275-F291 HydrophobicContact CD1-CE1 4.19Å; L275-V293 CarbonylContact C-O 3.57Å; L275-V293 WeakPolarHBondContact CA-O 3.4Å; L275-Y299 HydrophobicContact CD1-CD2 4.36Å; L275-Y299 HydrophobicContact CD2-CD2 3.87Å; L275-Y299 HydrophobicContact CD2-CG 4.41Å; L275-I306 HydrophobicContact CD2-CD1 3.68Å |
| 276 | L | 94.6 | Very high | 88.1 | Confident | 0 Ų | 0 | 57.5 Ų | 57.5 | 0% | 0 | 33% | 0.333 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -141.8 | 100.6 | 164.5 | 178.5 | 59.4 | 0 | 0 | 0 | 106.9 | A198 K201 L202 V260 V262 L292 V293 | A198-L276 HydrophobicContact CB-CD1 4.23Å; K201-L276 HydrophobicContact CB-CD2 3.87Å; K201-L276 HydrophobicContact CD-CD2 4.1Å; L202-L276 HydrophobicContact CD2-CD1 4.2Å; L202-L276 HydrophobicContact CD2-CD2 4.45Å; L202-L276 HydrophobicContact CD2-CG 4.38Å; L202-L276 HydrophobicContact CG-CD1 4.45Å; V260-L276 HydrophobicContact CG1-CD1 3.8Å; V262-L276 HydrophobicContact CG2-CD1 3.73Å; L276-L292 HydrophobicContact CB-CB 4.26Å; L276-L292 HydrophobicContact CD2-CB 3.97Å; L276-L292 HydrophobicContact CD2-CD2 3.75Å; L276-L292 HydrophobicContact CG-CB 3.98Å; L276-L292 HydrophobicContact CG-CD2 4.39Å; L276-L292 PolarHBondContact O-N 3Å; L276-V293 HydrophobicContact CB-CB 3.95Å; L276-V293 HydrophobicContact CB-CG2 4.11Å; L276-V293 PolarHBondContact N-O 3.4Å; L276-V293 PolarHBondContact O-N 3.37Å |
| 277 | A | 93.7 | Very high | 87.9 | Confident | 1 Ų | 1 | 60.7 Ų | 60.7 | 1% | 0.008 | 35% | 0.351 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -123.7 | 148.7 | -179.3 | 0 | 0 | 0 | 0 | 0 | 110.5 | V260 S261 L275 R289 L290 F291 Y299 | V260-A277 CarbonylContact C-O 3.39Å; V260-A277 WeakPolarHBondContact CA-O 3.5Å; S261-A277 PolarHBondContact N-O 3.01Å; S261-A277 PolarHBondContact O-N 3.44Å; L275-A277 HydrophobicContact CD1-CB 4.24Å; L275-A277 HydrophobicContact CG-CB 4.49Å; A277-R289 HydrophobicContact CB-CG 4.35Å; A277-L290 CarbonylContact C-O 3.57Å; A277-L290 VanDerWaalsContact CA-O 3.24Å; A277-L290 WeakPolarHBondContact CA-O 3.45Å; A277-F291 HydrophobicContact CB-CD1 3.67Å; A277-F291 HydrophobicContact CB-CE1 3.85Å; A277-Y299 HydrophobicContact CB-CD2 4.08Å; A277-Y299 HydrophobicContact CB-CE2 4.46Å |
| 278 | V | 94 | Very high | 88.1 | Confident | 1 Ų | 1 | 59.9 Ų | 59.9 | 1% | 0.006 | 35% | 0.349 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -122.3 | 124.4 | 173.6 | -174.2 | 0 | 0 | 0 | 0 | 108.4 | L202 I208 M212 I251 L259 V260 I280 R289 L290 | L202-V278 HydrophobicContact CD2-CG2 3.54Å; I208-V278 HydrophobicContact CD1-CG2 3.73Å; M212-V278 HydrophobicContact CE-CG1 4.18Å; M212-V278 HydrophobicContact SD-CG1 3.89Å; I251-V278 HydrophobicContact CG2-CG1 4.38Å; L259-V278 WeakPolarHBondContact O-CA 3.41Å; V260-V278 HydrophobicContact CG2-CG2 4.17Å; V278-I280 HydrophobicContact CG1-CG1 4Å; V278-R289 WeakPolarHBondContact O-CA 3.44Å; V278-L290 PolarHBondContact N-O 3.46Å; V278-L290 PolarHBondContact O-N 3.36Å |
| 279 | D | 92.1 | Very high | 88.6 | Confident | 2 Ų | 2 | 53.8 Ų | 53.8 | 1% | 0.011 | 32% | 0.32 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -98.3 | 121.7 | 172 | -61.2 | -92.3 | 0 | 0 | 0 | 109 | G258 L259 R289 R310 | G258-D279 CarbonylContact C-O 3.44Å; G258-D279 WeakPolarHBondContact CA-O 2.94Å; L259-D279 HydrophobicContact CB-CB 4.48Å; L259-D279 PolarHBondContact N-O 3.44Å; L259-D279 PolarHBondContact O-N 3.02Å; D279-R289 IonicContact OD1-CZ 2.62Å; D279-R289 VanDerWaalsContact OD1-CZ 3.23Å; D279-R289 IonicContact OD1-NE 3.97Å; D279-R289 PolarHBondContact OD1-NE 3.22Å; D279-R289 IonicContact OD1-NH2 2.75Å; D279-R289 PolarHBondContact OD1-NH2 2.67Å; D279-R289 IonicContact OD2-NE 3.27Å; D279-R310 VanDerWaalsContact CG-NH2 3.33Å; D279-R310 IonicContact OD1-NH1 2.74Å; D279-R310 IonicContact OD1-NH2 2.9Å; D279-R310 IonicContact OD2-CZ 2.82Å; D279-R310 IonicContact OD2-NH1 3.9Å; D279-R310 IonicContact OD2-NH2 3.45Å; D279-R310 PolarHBondContact OD2-NH2 2.79Å |
| 280 | I | 91.9 | Very high | 89 | Confident | 0 Ų | 0 | 54.4 Ų | 54.4 | 0% | 0 | 32% | 0.318 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -110.5 | 111 | -179 | -56.5 | 175 | 0 | 0 | 0 | 106.9 | V211 M212 R256 V278 M282 Q288 L290 | V211-I280 HydrophobicContact CB-CD1 4.12Å; V211-I280 HydrophobicContact CG1-CD1 3.49Å; V211-I280 VanDerWaalsContact CG1-CD1 3.49Å; M212-I280 HydrophobicContact CG-CD1 3.64Å; M212-I280 HydrophobicContact CG-CG1 4.26Å; M212-I280 HydrophobicContact SD-CD1 4.22Å; M212-I280 HydrophobicContact SD-CG1 4.26Å; R256-I280 HydrophobicContact CB-CG2 4.13Å; V278-I280 HydrophobicContact CG1-CG1 4Å; I280-M282 PolarHBondContact O-N 3.44Å; I280-Q288 PolarHBondContact N-O 3.41Å; I280-Q288 PolarHBondContact O-N 2.98Å; I280-L290 HydrophobicContact CD1-CD1 3.83Å; I280-L290 HydrophobicContact CD1-CG 4.49Å |
| 281 | P | 88.8 | Confident | 89.3 | Confident | 75 Ų | 75 | 50.6 Ų | 50.6 | 49% | 0.487 | 30% | 0.299 | S | S | . | . | trans | -62.8 | 125 | 173.8 | 26.1 | -33.7 | 0 | 0 | 0 | 109.7 | K257 D287 | K257-P281 WeakPolarHBondContact O-CD 3.44Å; P281-D287 WeakPolarHBondContact CA-OD1 3.41Å | ||
| 282 | M | 85.3 | Confident | 89.4 | Confident | 63 Ų | 63 | 50.7 Ų | 50.7 | 31% | 0.31 | 30% | 0.303 | S | S | . | . | trans | -91.2 | 140.7 | 176.8 | -64.4 | -64.4 | -68.3 | 0 | 0 | 109.4 | R256 I280 S284 P286 Q288 | R256-M282 PolarHBondContact NH1-SD 3.3Å; I280-M282 PolarHBondContact O-N 3.44Å; M282-S284 PolarHBondContact O-N 3.01Å; M282-P286 WeakPolarHBondContact CG-O 3.26Å; M282-Q288 HydrophobicContact CG-CB 4.13Å; M282-Q288 HydrophobicContact SD-CB 4.16Å | ||
| 283 | A | 80.3 | Confident | 89.4 | Confident | 116 Ų | 116 | 50.4 Ų | 50.4 | 96% | 0.959 | 30% | 0.303 | S | S | * | . | S | Bend | trans | -63.5 | -29.3 | 178 | 0 | 0 | 0 | 0 | 0 | 112.8 | ||
| 284 | S | 78.1 | Confident | 89.3 | Confident | 114 Ų | 114 | 51.3 Ų | 51.3 | 80% | 0.797 | 32% | 0.316 | S | S | * | . | S | Bend | trans | -142.2 | 116.8 | 173.4 | -175.5 | 0 | 0 | 0 | 0 | 108.3 | M282 | M282-S284 PolarHBondContact O-N 3.01Š|
| 285 | G | 77.6 | Confident | 89.1 | Confident | 51 Ų | 51 | 52.1 Ų | 52.1 | 53% | 0.526 | 32% | 0.323 | S | S | . | . | S | Bend | trans | 117.6 | 176.7 | -179.4 | 0 | 0 | 0 | 0 | 0 | 114.1 | ||
| 286 | P | 84.7 | Confident | 88.9 | Confident | 119 Ų | 119 | 56.8 Ų | 56.8 | 77% | 0.773 | 34% | 0.344 | S | S | * | . | S | Bend | trans | -66.9 | 152.2 | 175.3 | 29.8 | -34.6 | 0 | 0 | 0 | 110.9 | M282 Q288 | M282-P286 WeakPolarHBondContact CG-O 3.26Å; P286-Q288 PolarHBondContact O-N 3.45Å |
| 287 | D | 85.8 | Confident | 88.5 | Confident | 89 Ų | 89 | 63.7 Ų | 63.7 | 48% | 0.476 | 38% | 0.377 | S | S | . | . | P | Polyproline II helix | trans | -52.9 | 130.9 | 173.7 | -65.4 | -10.2 | 0 | 0 | 0 | 111 | P281 R289 | P281-D287 WeakPolarHBondContact CA-OD1 3.41Å; D287-R289 PolarHBondContact O-N 2.91Å |
| 288 | Q | 89.5 | Confident | 87.9 | Confident | 78 Ų | 78 | 67 Ų | 67 | 36% | 0.364 | 39% | 0.392 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -82.8 | 118.1 | 175 | -174.4 | 174.3 | 17 | 0 | 0 | 109 | I280 M282 P286 L290 | I280-Q288 PolarHBondContact N-O 3.41Å; I280-Q288 PolarHBondContact O-N 2.98Å; M282-Q288 HydrophobicContact CG-CB 4.13Å; M282-Q288 HydrophobicContact SD-CB 4.16Å; P286-Q288 PolarHBondContact O-N 3.45Å; Q288-L290 HydrophobicContact CG-CD2 4.25Å |
| 289 | R | 91.5 | Very high | 87.5 | Confident | 80 Ų | 80 | 67.8 Ų | 67.8 | 30% | 0.302 | 40% | 0.395 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -101.2 | 120.7 | 176.3 | -173.8 | 176.5 | -67.1 | 134 | 14.9 | 111 | A277 V278 D279 D287 F291 Y299 | A277-R289 HydrophobicContact CB-CG 4.35Å; V278-R289 WeakPolarHBondContact O-CA 3.44Å; D279-R289 IonicContact OD1-CZ 2.62Å; D279-R289 VanDerWaalsContact OD1-CZ 3.23Å; D279-R289 IonicContact OD1-NE 3.97Å; D279-R289 PolarHBondContact OD1-NE 3.22Å; D279-R289 IonicContact OD1-NH2 2.75Å; D279-R289 PolarHBondContact OD1-NH2 2.67Å; D279-R289 IonicContact OD2-NE 3.27Å; D287-R289 PolarHBondContact O-N 2.91Å; R289-F291 HydrophobicContact CG-CE1 3.99Å; R289-F291 HydrophobicContact CG-CE2 3.96Å; R289-F291 HydrophobicContact CG-CZ 3.69Å; R289-Y299 VanDerWaalsContact NH1-CD1 3.34Å; R289-Y299 PolarHBondContact NH2-OH 3.48Å |
| 290 | L | 92.4 | Very high | 87.1 | Confident | 36 Ų | 36 | 74.1 Ų | 74.1 | 19% | 0.188 | 42% | 0.422 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -105.8 | 128.1 | 175.3 | -59.1 | 178.3 | 0 | 0 | 0 | 109.7 | V211 A277 V278 I280 Q288 | V211-L290 HydrophobicContact CB-CD1 4.17Å; V211-L290 HydrophobicContact CG1-CD1 4.43Å; V211-L290 HydrophobicContact CG2-CD1 4.07Å; A277-L290 CarbonylContact C-O 3.57Å; A277-L290 VanDerWaalsContact CA-O 3.24Å; A277-L290 WeakPolarHBondContact CA-O 3.45Å; V278-L290 PolarHBondContact N-O 3.46Å; V278-L290 PolarHBondContact O-N 3.36Å; I280-L290 HydrophobicContact CD1-CD1 3.83Å; I280-L290 HydrophobicContact CD1-CG 4.49Å; Q288-L290 HydrophobicContact CG-CD2 4.25Å |
| 291 | F | 93.2 | Very high | 86.3 | Confident | 73 Ų | 73 | 80 Ų | 80 | 32% | 0.32 | 46% | 0.458 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -102.9 | 119.8 | 176.9 | -61.8 | -78.3 | 0 | 0 | 0 | 110.1 | L275 A277 R289 E296 Y299 | L275-F291 HydrophobicContact CD1-CD1 4.08Å; L275-F291 HydrophobicContact CD1-CE1 4.19Å; A277-F291 HydrophobicContact CB-CD1 3.67Å; A277-F291 HydrophobicContact CB-CE1 3.85Å; R289-F291 HydrophobicContact CG-CE1 3.99Å; R289-F291 HydrophobicContact CG-CE2 3.96Å; R289-F291 HydrophobicContact CG-CZ 3.69Å; F291-E296 HydrophobicContact CE2-CB 4.26Å; F291-E296 HydrophobicContact CZ-CB 4.04Å; F291-E296 HydrophobicContact CZ-CG 4.23Å; F291-Y299 HydrophobicContact CE1-CD2 4.05Å; F291-Y299 HydrophobicContact CE1-CG 4.02Å; F291-Y299 HydrophobicContact CZ-CG 4.4Å |
| 292 | L | 93 | Very high | 85.2 | Confident | 51 Ų | 51 | 76.6 Ų | 76.6 | 27% | 0.267 | 44% | 0.436 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -91.6 | -37 | 171.3 | -124.6 | 61.1 | 0 | 0 | 0 | 111.8 | K201 L202 S205 I208 L276 | K201-L292 HydrophobicContact CB-CD2 4.49Å; L202-L292 HydrophobicContact CD2-CD2 4.22Å; S205-L292 WeakPolarHBondContact OG-CD1 3.46Å; I208-L292 HydrophobicContact CD1-CD1 3.27Å; I208-L292 HydrophobicContact CD1-CD2 3.61Å; I208-L292 HydrophobicContact CD1-CG 3.96Å; I208-L292 HydrophobicContact CG1-CD1 3.63Å; L276-L292 HydrophobicContact CB-CB 4.26Å; L276-L292 HydrophobicContact CD2-CB 3.97Å; L276-L292 HydrophobicContact CD2-CD2 3.75Å; L276-L292 HydrophobicContact CG-CB 3.98Å; L276-L292 HydrophobicContact CG-CD2 4.39Å; L276-L292 PolarHBondContact O-N 3Å |
| 293 | V | 92.6 | Very high | 84.1 | Confident | 42 Ų | 42 | 74 Ų | 74 | 26% | 0.255 | 43% | 0.426 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -141.2 | 134.5 | 176.6 | -173.5 | 0 | 0 | 0 | 0 | 107.4 | M273 L275 L276 | M273-V293 HydrophobicContact CB-CG1 4.44Å; L275-V293 CarbonylContact C-O 3.57Å; L275-V293 WeakPolarHBondContact CA-O 3.4Å; L276-V293 HydrophobicContact CB-CB 3.95Å; L276-V293 HydrophobicContact CB-CG2 4.11Å; L276-V293 PolarHBondContact N-O 3.4Å; L276-V293 PolarHBondContact O-N 3.37Å |
| 294 | G | 90.1 | Very high | 83.9 | Confident | 34 Ų | 34 | 70.8 Ų | 70.8 | 35% | 0.351 | 40% | 0.404 | S | S | . | . | S | Bend | trans | 88.4 | -175.2 | -177.3 | 0 | 0 | 0 | 0 | 0 | 113 | K274 E298 | K274-G294 WeakPolarHBondContact O-CA 3.27Å; K274-G294 PolarHBondContact O-N 3.4Å; G294-E298 WeakPolarHBondContact CA-OE2 3.35Å |
| 295 | D | 89.3 | Confident | 84 | Confident | 70 Ų | 70 | 68.3 Ų | 68.3 | 37% | 0.374 | 38% | 0.381 | S | S | . | . | trans | -131.7 | -179.8 | -177.7 | 65.9 | 9.9 | 0 | 0 | 0 | 111.6 | Q297 E298 Y299 | D295-Q297 PolarHBondContact O-N 3.25Å; D295-Q297 WeakPolarHBondContact OD1-CB 3.15Å; D295-Q297 PolarHBondContact OD1-N 3.2Å; D295-E298 PolarHBondContact O-N 3.44Å; D295-E298 WeakPolarHBondContact OD1-CB 3.36Å; D295-E298 WeakPolarHBondContact OD1-CG 3.47Å; D295-E298 PolarHBondContact OD1-N 2.95Å; D295-Y299 WeakPolarHBondContact O-CB 3.45Å; D295-Y299 PolarHBondContact O-N 2.85Å | ||
| 296 | E | 87.9 | Confident | 84.3 | Confident | 98 Ų | 98 | 65.9 Ų | 65.9 | 46% | 0.458 | 36% | 0.356 | S | S | . | . | H | α-helix | trans | -63.9 | -27 | 177.7 | -159.5 | -167.3 | 155.2 | 0 | 0 | 112.4 | F291 K300 | F291-E296 HydrophobicContact CE2-CB 4.26Å; F291-E296 HydrophobicContact CZ-CB 4.04Å; F291-E296 HydrophobicContact CZ-CG 4.23Å; E296-K300 VanDerWaalsContact O-CG 3.32Å; E296-K300 WeakPolarHBondContact O-CG 3.44Å; E296-K300 PolarHBondContact O-N 2.78Å; E296-K300 WeakPolarHBondContact OE1-CE 3.36Å; E296-K300 IonicContact OE1-NZ 3.91Å; E296-K300 PolarHBondContact OE1-NZ 2.9Å |
| 297 | Q | 86.3 | Confident | 84.2 | Confident | 145 Ų | 145 | 62.9 Ų | 62.9 | 68% | 0.678 | 34% | 0.338 | S | S | * | . | H | α-helix | trans | -73.8 | -46.2 | 179.1 | -61.2 | -173.6 | 15.9 | 0 | 0 | 111.1 | D295 Y299 K300 V301 | D295-Q297 PolarHBondContact O-N 3.25Å; D295-Q297 WeakPolarHBondContact OD1-CB 3.15Å; D295-Q297 PolarHBondContact OD1-N 3.2Å; Q297-Y299 PolarHBondContact O-N 3.28Å; Q297-K300 PolarHBondContact O-N 2.83Å; Q297-K300 VanDerWaalsContact O-N 3.1Å; Q297-V301 WeakPolarHBondContact O-CB 3.41Å; Q297-V301 VanDerWaalsContact O-CG2 3.27Å; Q297-V301 WeakPolarHBondContact O-CG2 3.33Å; Q297-V301 PolarHBondContact O-N 2.8Å |
| 298 | E | 82.7 | Confident | 84.1 | Confident | 70 Ų | 70 | 65.2 Ų | 65.2 | 33% | 0.327 | 35% | 0.346 | S | S | . | . | H | α-helix | trans | -60.2 | -38.2 | 172.3 | -72.7 | -171.6 | 157.3 | 0 | 0 | 110.7 | G294 D295 V301 G302 | G294-E298 WeakPolarHBondContact CA-OE2 3.35Å; D295-E298 PolarHBondContact O-N 3.44Å; D295-E298 WeakPolarHBondContact OD1-CB 3.36Å; D295-E298 WeakPolarHBondContact OD1-CG 3.47Å; D295-E298 PolarHBondContact OD1-N 2.95Å; E298-V301 PolarHBondContact O-N 3.45Å; E298-G302 PolarHBondContact O-N 3.48Å |
| 299 | Y | 84.7 | Confident | 83.9 | Confident | 18 Ų | 18 | 62.5 Ų | 62.5 | 7% | 0.071 | 33% | 0.334 | C | S | . | . | H | α-helix | trans | -63 | -41.5 | 171.8 | -176.9 | -82.3 | 0 | 0 | 0 | 113 | L275 A277 R289 F291 D295 Q297 G303 R310 | L275-Y299 HydrophobicContact CD1-CD2 4.36Å; L275-Y299 HydrophobicContact CD2-CD2 3.87Å; L275-Y299 HydrophobicContact CD2-CG 4.41Å; A277-Y299 HydrophobicContact CB-CD2 4.08Å; A277-Y299 HydrophobicContact CB-CE2 4.46Å; R289-Y299 VanDerWaalsContact NH1-CD1 3.34Å; R289-Y299 PolarHBondContact NH2-OH 3.48Å; F291-Y299 HydrophobicContact CE1-CD2 4.05Å; F291-Y299 HydrophobicContact CE1-CG 4.02Å; F291-Y299 HydrophobicContact CZ-CG 4.4Å; D295-Y299 WeakPolarHBondContact O-CB 3.45Å; D295-Y299 PolarHBondContact O-N 2.85Å; Q297-Y299 PolarHBondContact O-N 3.28Å; Y299-G303 WeakPolarHBondContact O-CA 3.37Å; Y299-G303 PolarHBondContact O-N 3.44Å; Y299-R310 PolarHBondContact OH-NE 2.84Å; Y299-R310 PolarHBondContact OH-NH2 2.84Å |
| 300 | K | 83.9 | Confident | 83.6 | Confident | 135 Ų | 135 | 60.7 Ų | 60.7 | 59% | 0.587 | 33% | 0.327 | S | S | * | . | H | α-helix | trans | -68.9 | -41.2 | 175.9 | -76.6 | 170.6 | -176.7 | 167.2 | 0 | 112.2 | E296 Q297 G303 | E296-K300 VanDerWaalsContact O-CG 3.32Å; E296-K300 WeakPolarHBondContact O-CG 3.44Å; E296-K300 PolarHBondContact O-N 2.78Å; E296-K300 WeakPolarHBondContact OE1-CE 3.36Å; E296-K300 IonicContact OE1-NZ 3.91Å; E296-K300 PolarHBondContact OE1-NZ 2.9Å; Q297-K300 PolarHBondContact O-N 2.83Å; Q297-K300 VanDerWaalsContact O-N 3.1Å; K300-G303 WeakPolarHBondContact O-CA 3.45Å; K300-G303 PolarHBondContact O-N 3.49Å |
| 301 | V | 74.8 | Confident | 83.4 | Confident | 123 Ų | 123 | 64.9 Ų | 64.9 | 75% | 0.745 | 35% | 0.35 | S | S | * | . | H | α-helix | trans | -70 | -45 | -179.7 | 173.4 | 0 | 0 | 0 | 0 | 111.5 | Q297 E298 | Q297-V301 WeakPolarHBondContact O-CB 3.41Å; Q297-V301 VanDerWaalsContact O-CG2 3.27Å; Q297-V301 WeakPolarHBondContact O-CG2 3.33Å; Q297-V301 PolarHBondContact O-N 2.8Å; E298-V301 PolarHBondContact O-N 3.45Å |
| 302 | G | 65.5 | Low | 83.3 | Confident | 3 Ų | 3 | 65 Ų | 65 | 3% | 0.031 | 36% | 0.358 | C | S | . | . | H | α-helix | trans | -71.9 | -20.9 | 170.1 | 0 | 0 | 0 | 0 | 0 | 112.6 | E298 G304 L305 I306 | E298-G302 PolarHBondContact O-N 3.48Å; G302-G304 PolarHBondContact O-N 2.87Å; G302-L305 PolarHBondContact O-N 3.23Å; G302-L305 VanDerWaalsContact O-N 3.12Å; G302-I306 WeakPolarHBondContact O-CG1 3.47Å; G302-I306 PolarHBondContact O-N 3.39Å |
| 303 | G | 63.2 | Low | 83.1 | Confident | 10 Ų | 10 | 62.9 Ų | 62.9 | 10% | 0.103 | 35% | 0.347 | C | S | . | . | H | α-helix | trans | -58.9 | -27.9 | -175.7 | 0 | 0 | 0 | 0 | 0 | 113.9 | Y299 K300 L305 I306 S307 | Y299-G303 WeakPolarHBondContact O-CA 3.37Å; Y299-G303 PolarHBondContact O-N 3.44Å; K300-G303 WeakPolarHBondContact O-CA 3.45Å; K300-G303 PolarHBondContact O-N 3.49Å; G303-L305 VanDerWaalsContact C-N 3.28Å; G303-L305 PolarHBondContact O-N 3.43Å; G303-I306 PolarHBondContact O-N 2.86Å; G303-S307 WeakPolarHBondContact O-CB 3.36Å; G303-S307 PolarHBondContact O-N 3.49Å; G303-S307 PolarHBondContact O-OG 2.88Å |
| 304 | G | 76.4 | Confident | 82.9 | Confident | 47 Ų | 47 | 64.5 Ų | 64.5 | 49% | 0.485 | 36% | 0.357 | S | S | . | . | H | α-helix | trans | -59 | -37.3 | 175.2 | 0 | 0 | 0 | 0 | 0 | 113.3 | G302 S307 E308 | G302-G304 PolarHBondContact O-N 2.87Å; G304-S307 PolarHBondContact O-OG 3.2Å; G304-E308 WeakPolarHBondContact O-CG 3.39Å |
| 305 | L | 79.4 | Confident | 82.9 | Confident | 62 Ų | 62 | 70.7 Ų | 70.7 | 33% | 0.325 | 37% | 0.374 | S | S | . | . | H | α-helix | trans | -92.9 | -27.3 | 176.6 | -72.1 | 172.3 | 0 | 0 | 0 | 112.8 | V225 F246 G302 G303 L309 | V225-L305 HydrophobicContact CG1-CD1 4.5Å; V225-L305 HydrophobicContact CG1-CD2 4.34Å; F246-L305 HydrophobicContact CD2-CB 4.22Å; F246-L305 HydrophobicContact CD2-CD1 3.66Å; F246-L305 HydrophobicContact CE2-CD1 3.47Å; F246-L305 VanDerWaalsContact CE2-CD1 3.47Å; F246-L305 HydrophobicContact CG-CB 4.25Å; F246-L305 HydrophobicContact CG-CD1 4.49Å; F246-L305 HydrophobicContact CZ-CD1 4.16Å; G302-L305 PolarHBondContact O-N 3.23Å; G302-L305 VanDerWaalsContact O-N 3.12Å; G303-L305 VanDerWaalsContact C-N 3.28Å; G303-L305 PolarHBondContact O-N 3.43Å; L305-L309 WeakPolarHBondContact O-CG 3.35Å |
| 306 | I | 82.7 | Confident | 82.9 | Confident | 1 Ų | 1 | 69.1 Ų | 69.1 | 1% | 0.005 | 37% | 0.371 | C | S | . | . | H | α-helix | trans | -74.3 | -40.1 | 179.6 | -64.7 | 167.7 | 0 | 0 | 0 | 110.7 | F246 I248 S261 L275 G302 G303 E308 L309 R310 | F246-I306 HydrophobicContact CB-CG1 4.33Å; F246-I306 HydrophobicContact CD1-CD1 4.01Å; F246-I306 HydrophobicContact CD1-CG1 3.83Å; F246-I306 HydrophobicContact CG-CG1 4.48Å; I248-I306 HydrophobicContact CD1-CG2 4.21Å; S261-I306 WeakPolarHBondContact OG-CG2 3.22Å; L275-I306 HydrophobicContact CD2-CD1 3.68Å; G302-I306 WeakPolarHBondContact O-CG1 3.47Å; G302-I306 PolarHBondContact O-N 3.39Å; G303-I306 PolarHBondContact O-N 2.86Å; I306-E308 VanDerWaalsContact C-N 3.34Å; I306-E308 PolarHBondContact O-N 2.86Å; I306-L309 PolarHBondContact O-N 3.45Å; I306-R310 PolarHBondContact O-N 2.82Å |
| 307 | S | 82.6 | Confident | 82.8 | Confident | 55 Ų | 55 | 67.3 Ų | 67.3 | 39% | 0.385 | 36% | 0.363 | S | S | . | . | H | α-helix | trans | -59.9 | -43.5 | 177 | 53.7 | 0 | 0 | 0 | 0 | 111.8 | G303 G304 L309 R310 | G303-S307 WeakPolarHBondContact O-CB 3.36Å; G303-S307 PolarHBondContact O-N 3.49Å; G303-S307 PolarHBondContact O-OG 2.88Å; G304-S307 PolarHBondContact O-OG 3.2Å; S307-L309 PolarHBondContact O-N 2.96Å; S307-L309 VanDerWaalsContact O-N 3.13Å; S307-R310 WeakPolarHBondContact O-CB 3.36Å; S307-R310 PolarHBondContact O-N 3.11Å |
| 308 | E | 84.2 | Confident | 82.9 | Confident | 139 Ų | 139 | 62.9 Ų | 62.9 | 65% | 0.65 | 35% | 0.351 | S | S | * | . | H | α-helix | trans | -59.1 | -24.5 | 174.5 | -63.9 | -70.5 | 162.1 | 0 | 0 | 113.5 | G304 I306 P312 | G304-E308 WeakPolarHBondContact O-CG 3.39Å; I306-E308 VanDerWaalsContact C-N 3.34Å; I306-E308 PolarHBondContact O-N 2.86Å; E308-P312 VanDerWaalsContact O-CD 3.3Å; E308-P312 WeakPolarHBondContact O-CD 3.48Å |
| 309 | L | 85.6 | Confident | 83.2 | Confident | 21 Ų | 21 | 61 Ų | 61 | 11% | 0.11 | 35% | 0.347 | C | S | . | . | H | α-helix | trans | -92.6 | -11.3 | 177.5 | -61 | 171.1 | 0 | 0 | 0 | 113.6 | A223 V225 I248 L305 I306 S307 I313 | A223-L309 HydrophobicContact CB-CB 4.48Å; A223-L309 HydrophobicContact CB-CD2 4.14Å; V225-L309 HydrophobicContact CB-CD1 4.12Å; V225-L309 HydrophobicContact CG2-CD1 3.76Å; V225-L309 HydrophobicContact CG2-CD2 3.52Å; V225-L309 HydrophobicContact CG2-CG 4.01Å; I248-L309 HydrophobicContact CG2-CB 3.5Å; I248-L309 VanDerWaalsContact CG2-CB 3.5Å; I248-L309 HydrophobicContact CG2-CD1 4.18Å; I248-L309 HydrophobicContact CG2-CG 4.45Å; L305-L309 WeakPolarHBondContact O-CG 3.35Å; I306-L309 PolarHBondContact O-N 3.45Å; S307-L309 PolarHBondContact O-N 2.96Å; S307-L309 VanDerWaalsContact O-N 3.13Å; L309-I313 WeakPolarHBondContact O-CB 3.32Å; L309-I313 VanDerWaalsContact O-CG1 3.25Å; L309-I313 WeakPolarHBondContact O-CG1 3.29Å; L309-I313 PolarHBondContact O-N 3.37Å |
| 310 | R | 86.2 | Confident | 83.4 | Confident | 41 Ų | 41 | 63.3 Ų | 63.3 | 16% | 0.155 | 36% | 0.359 | C | S | . | . | H | α-helix | trans | -67.3 | -55.1 | 179.6 | -75.2 | -178.5 | 174.2 | -110.3 | -28.4 | 111.3 | I248 L259 S261 D279 Y299 I306 S307 I313 V314 | I248-R310 HydrophobicContact CD1-CB 4.46Å; I248-R310 HydrophobicContact CD1-CG 3.58Å; L259-R310 HydrophobicContact CD2-CG 4.13Å; S261-R310 PolarHBondContact OG-NH2 3.47Å; D279-R310 VanDerWaalsContact CG-NH2 3.33Å; D279-R310 IonicContact OD1-NH1 2.74Å; D279-R310 IonicContact OD1-NH2 2.9Å; D279-R310 IonicContact OD2-CZ 2.82Å; D279-R310 IonicContact OD2-NH1 3.9Å; D279-R310 IonicContact OD2-NH2 3.45Å; D279-R310 PolarHBondContact OD2-NH2 2.79Å; Y299-R310 PolarHBondContact OH-NE 2.84Å; Y299-R310 PolarHBondContact OH-NH2 2.84Å; I306-R310 PolarHBondContact O-N 2.82Å; S307-R310 WeakPolarHBondContact O-CB 3.36Å; S307-R310 PolarHBondContact O-N 3.11Å; R310-I313 PolarHBondContact O-N 2.8Å; R310-V314 WeakPolarHBondContact O-CG2 3.48Å; R310-V314 PolarHBondContact O-N 3.43Å |
| 311 | D | 88 | Confident | 83.6 | Confident | 124 Ų | 124 | 64 Ų | 64 | 66% | 0.663 | 36% | 0.362 | S | S | * | . | H | α-helix | trans | -61.6 | -44.6 | -171.4 | -55.4 | -17.5 | 0 | 0 | 0 | 112.6 | I313 V314 K315 | D311-I313 VanDerWaalsContact C-N 3.27Å; D311-I313 PolarHBondContact O-N 3.39Å; D311-V314 PolarHBondContact O-N 3.22Å; D311-K315 VanDerWaalsContact O-CB 3.31Å; D311-K315 WeakPolarHBondContact O-CB 3.2Å; D311-K315 PolarHBondContact O-N 3.42Å |
| 312 | P | 90.6 | Very high | 84.2 | Confident | 77 Ų | 77 | 64.3 Ų | 64.3 | 50% | 0.5 | 36% | 0.355 | S | S | . | . | H | α-helix | trans | -60.6 | -36.6 | 174.9 | -24.3 | 35.6 | 0 | 0 | 0 | 113.1 | E308 A316 | E308-P312 VanDerWaalsContact O-CD 3.3Å; E308-P312 WeakPolarHBondContact O-CD 3.48Å; P312-A316 VanDerWaalsContact O-CB 3.3Å; P312-A316 WeakPolarHBondContact O-CB 3.41Å; P312-A316 PolarHBondContact O-N 3.29Å |
| 313 | I | 89.3 | Confident | 85.3 | Confident | 6 Ų | 6 | 70.1 Ų | 70.1 | 3% | 0.031 | 38% | 0.38 | C | S | . | . | H | α-helix | trans | -74.2 | -42.9 | -179.7 | -73 | -74.2 | 0 | 0 | 0 | 111.6 | V221 A223 I248 P250 L259 L309 R310 D311 K315 A316 M317 | V221-I313 HydrophobicContact CG1-CD1 3.6Å; A223-I313 HydrophobicContact CB-CD1 3.55Å; A223-I313 HydrophobicContact CB-CG1 3.63Å; I248-I313 HydrophobicContact CG2-CG1 3.91Å; P250-I313 HydrophobicContact CG-CG2 4.24Å; L259-I313 HydrophobicContact CD1-CG2 3.87Å; L309-I313 WeakPolarHBondContact O-CB 3.32Å; L309-I313 VanDerWaalsContact O-CG1 3.25Å; L309-I313 WeakPolarHBondContact O-CG1 3.29Å; L309-I313 PolarHBondContact O-N 3.37Å; R310-I313 PolarHBondContact O-N 2.8Å; D311-I313 VanDerWaalsContact C-N 3.27Å; D311-I313 PolarHBondContact O-N 3.39Å; I313-K315 VanDerWaalsContact C-N 3.28Å; I313-K315 PolarHBondContact O-N 3.49Å; I313-A316 PolarHBondContact O-N 2.83Å; I313-M317 HydrophobicContact CG2-CE 4.38Å; I313-M317 WeakPolarHBondContact O-CG 3.27Å; I313-M317 PolarHBondContact O-N 3.4Å |
| 314 | V | 87.5 | Confident | 86.7 | Confident | 76 Ų | 76 | 73.7 Ų | 73.7 | 46% | 0.461 | 40% | 0.396 | S | S | . | . | H | α-helix | trans | -62.3 | -41.3 | 176.2 | 175.4 | 0 | 0 | 0 | 0 | 110.4 | R310 D311 M317 A318 | R310-V314 WeakPolarHBondContact O-CG2 3.48Å; R310-V314 PolarHBondContact O-N 3.43Å; D311-V314 PolarHBondContact O-N 3.22Å; V314-M317 HydrophobicContact CB-CE 4.26Å; V314-M317 HydrophobicContact CG2-CE 3.92Å; V314-M317 PolarHBondContact O-N 3.09Å; V314-A318 PolarHBondContact O-N 2.77Å |
| 315 | K | 90.2 | Very high | 87.4 | Confident | 163 Ų | 163 | 78.5 Ų | 78.5 | 71% | 0.709 | 40% | 0.401 | S | S | * | . | H | α-helix | trans | -62.8 | -42.6 | 172.9 | -172.8 | 175.3 | -178.1 | 176.4 | 0 | 112.4 | D311 I313 A318 A319 | D311-K315 VanDerWaalsContact O-CB 3.31Å; D311-K315 WeakPolarHBondContact O-CB 3.2Å; D311-K315 PolarHBondContact O-N 3.42Å; I313-K315 VanDerWaalsContact C-N 3.28Å; I313-K315 PolarHBondContact O-N 3.49Å; K315-A318 PolarHBondContact O-N 2.95Å; K315-A319 PolarHBondContact O-N 2.88Å |
| 316 | A | 89.4 | Confident | 88 | Confident | 38 Ų | 38 | 78.3 Ų | 78.3 | 31% | 0.314 | 40% | 0.4 | S | S | . | . | H | α-helix | trans | -64.2 | -40.8 | 177.3 | 0 | 0 | 0 | 0 | 0 | 112.3 | V221 P312 I313 A318 A319 E320 | V221-A316 HydrophobicContact CG1-CB 3.96Å; P312-A316 VanDerWaalsContact O-CB 3.3Å; P312-A316 WeakPolarHBondContact O-CB 3.41Å; P312-A316 PolarHBondContact O-N 3.29Å; I313-A316 PolarHBondContact O-N 2.83Å; A316-A318 VanDerWaalsContact C-N 3.34Å; A316-A318 PolarHBondContact O-N 2.96Å; A316-A319 PolarHBondContact O-N 2.82Å; A316-E320 WeakPolarHBondContact O-CB 3.25Å; A316-E320 PolarHBondContact O-N 3.38Å |
| 317 | M | 85.9 | Confident | 88.5 | Confident | 60 Ų | 60 | 82.2 Ų | 82.2 | 30% | 0.296 | 42% | 0.421 | S | S | . | . | H | α-helix | trans | -63.9 | -38.1 | 174.8 | -72 | -170.2 | -64.9 | 0 | 0 | 112.7 | P250 L259 I313 V314 K321 | P250-M317 HydrophobicContact CB-CG 4.36Å; P250-M317 HydrophobicContact CB-SD 3.49Å; P250-M317 WeakPolarHBondContact CB-SD 3.17Å; P250-M317 HydrophobicContact CG-CG 3.69Å; P250-M317 HydrophobicContact CG-SD 3.37Å; P250-M317 WeakPolarHBondContact CG-SD 3.31Å; L259-M317 HydrophobicContact CD1-CE 3.92Å; L259-M317 HydrophobicContact CD1-SD 4.39Å; I313-M317 HydrophobicContact CG2-CE 4.38Å; I313-M317 WeakPolarHBondContact O-CG 3.27Å; I313-M317 PolarHBondContact O-N 3.4Å; V314-M317 HydrophobicContact CB-CE 4.26Å; V314-M317 HydrophobicContact CG2-CE 3.92Å; V314-M317 PolarHBondContact O-N 3.09Å; M317-K321 PolarHBondContact O-N 3.02Å |
| 318 | A | 88.5 | Confident | 89 | Confident | 51 Ų | 51 | 85.9 Ų | 85.9 | 42% | 0.421 | 43% | 0.432 | S | S | . | . | H | α-helix | trans | -65.6 | -44.1 | 176 | 0 | 0 | 0 | 0 | 0 | 110.8 | V314 K315 A316 K321 E322 | V314-A318 PolarHBondContact O-N 2.77Å; K315-A318 PolarHBondContact O-N 2.95Å; A316-A318 VanDerWaalsContact C-N 3.34Å; A316-A318 PolarHBondContact O-N 2.96Å; A318-K321 PolarHBondContact O-N 3.49Å; A318-E322 WeakPolarHBondContact O-CG 3.17Å; A318-E322 PolarHBondContact O-N 2.88Å; A318-E322 VanDerWaalsContact O-N 3.09Å |
| 319 | A | 89.8 | Confident | 89.5 | Confident | 30 Ų | 30 | 84.6 Ų | 84.6 | 25% | 0.248 | 42% | 0.421 | C | S | . | . | H | α-helix | trans | -64 | -42.6 | 176.4 | 0 | 0 | 0 | 0 | 0 | 112.4 | K315 A316 K321 E322 F323 | K315-A319 PolarHBondContact O-N 2.88Å; A316-A319 PolarHBondContact O-N 2.82Å; A319-K321 VanDerWaalsContact C-N 3.29Å; A319-K321 PolarHBondContact O-N 2.93Å; A319-E322 WeakPolarHBondContact O-CB 3.34Å; A319-E322 PolarHBondContact O-N 2.96Å; A319-F323 HydrophobicContact CB-CD2 4.44Å; A319-F323 HydrophobicContact CB-CE2 4.07Å; A319-F323 WeakPolarHBondContact O-CD2 3.44Å; A319-F323 PolarHBondContact O-N 2.68Å |
| 320 | E | 87.5 | Confident | 89.9 | Confident | 67 Ų | 67 | 88.2 Ų | 88.2 | 31% | 0.313 | 44% | 0.438 | S | S | . | . | H | α-helix | trans | -54.8 | -45.4 | 175.2 | -173.1 | 177.5 | -166.6 | 0 | 0 | 111.1 | V221 A316 E322 F323 D324 | V221-E320 VanDerWaalsContact CG2-OE2 3.32Å; V221-E320 WeakPolarHBondContact CG2-OE2 3.22Å; A316-E320 WeakPolarHBondContact O-CB 3.25Å; A316-E320 PolarHBondContact O-N 3.38Å; E320-E322 VanDerWaalsContact C-N 3.33Å; E320-E322 PolarHBondContact O-N 3.31Å; E320-F323 PolarHBondContact O-N 2.76Å; E320-D324 VanDerWaalsContact O-CG 3.26Å; E320-D324 PolarHBondContact O-N 2.92Å |
| 321 | K | 87.9 | Confident | 90.3 | Very high | 151 Ų | 151 | 91 Ų | 91 | 66% | 0.657 | 46% | 0.456 | S | S | * | . | H | α-helix | trans | -66.2 | -33.2 | 176.5 | -169.6 | -176.4 | 177.4 | -167.3 | 0 | 113.4 | M317 A318 A319 Y325 | M317-K321 PolarHBondContact O-N 3.02Å; A318-K321 PolarHBondContact O-N 3.49Å; A319-K321 VanDerWaalsContact C-N 3.29Å; A319-K321 PolarHBondContact O-N 2.93Å; K321-Y325 PolarHBondContact O-N 3.29Å |
| 322 | E | 88.8 | Confident | 90.7 | Very high | 129 Ų | 129 | 87.8 Ų | 87.8 | 60% | 0.603 | 45% | 0.446 | S | S | * | . | H | α-helix | trans | -68.9 | -39.5 | 174.8 | -72.6 | 172.9 | -175.4 | 0 | 0 | 111.1 | A318 A319 E320 Y325 L326 | A318-E322 WeakPolarHBondContact O-CG 3.17Å; A318-E322 PolarHBondContact O-N 2.88Å; A318-E322 VanDerWaalsContact O-N 3.09Å; A319-E322 WeakPolarHBondContact O-CB 3.34Å; A319-E322 PolarHBondContact O-N 2.96Å; E320-E322 VanDerWaalsContact C-N 3.33Å; E320-E322 PolarHBondContact O-N 3.31Å; E322-Y325 PolarHBondContact O-N 3.23Å; E322-L326 VanDerWaalsContact O-CG 3.29Å; E322-L326 WeakPolarHBondContact O-CG 3.35Å; E322-L326 PolarHBondContact O-N 3.1Å; E322-L326 VanDerWaalsContact O-N 3.08Å |
| 323 | F | 88.2 | Confident | 90.9 | Very high | 124 Ų | 124 | 88.2 Ų | 88.2 | 54% | 0.544 | 44% | 0.442 | S | S | . | . | H | α-helix | trans | -66.1 | -45.4 | 174.3 | -68.7 | -60.3 | 0 | 0 | 0 | 111.8 | A319 E320 Y325 L326 D327 | A319-F323 HydrophobicContact CB-CD2 4.44Å; A319-F323 HydrophobicContact CB-CE2 4.07Å; A319-F323 WeakPolarHBondContact O-CD2 3.44Å; A319-F323 PolarHBondContact O-N 2.68Å; E320-F323 PolarHBondContact O-N 2.76Å; F323-Y325 PolarHBondContact O-N 3.01Å; F323-L326 PolarHBondContact O-N 2.86Å; F323-D327 PolarHBondContact O-N 2.89Å |
| 324 | D | 91.1 | Very high | 91.2 | Very high | 85 Ų | 85 | 91.8 Ų | 91.8 | 46% | 0.455 | 46% | 0.461 | S | S | . | . | H | α-helix | trans | -54.9 | -42 | 176.2 | -66.5 | -19.8 | 0 | 0 | 0 | 111.7 | E320 E328 | E320-D324 VanDerWaalsContact O-CG 3.26Å; E320-D324 PolarHBondContact O-N 2.92Å; D324-E328 WeakPolarHBondContact O-CB 3.16Å; D324-E328 VanDerWaalsContact O-CG 3.31Å; D324-E328 WeakPolarHBondContact O-CG 3.24Å; D324-E328 PolarHBondContact O-N 3.08Å |
| 325 | Y | 91.6 | Very high | 91.6 | Very high | 148 Ų | 148 | 92.9 Ų | 92.9 | 58% | 0.58 | 46% | 0.461 | S | S | * | . | H | α-helix | trans | -70.1 | -34.8 | 178 | 179.3 | -100.6 | 0 | 0 | 0 | 113.2 | K321 E322 F323 R329 | K321-Y325 PolarHBondContact O-N 3.29Å; E322-Y325 PolarHBondContact O-N 3.23Å; F323-Y325 PolarHBondContact O-N 3.01Å; Y325-R329 WeakPolarHBondContact O-CB 3.37Å; Y325-R329 PolarHBondContact O-N 2.73Å; Y325-R329 VanDerWaalsContact O-N 3.16Å |
| 326 | L | 91.9 | Very high | 91.8 | Very high | 58 Ų | 58 | 87.5 Ų | 87.5 | 30% | 0.304 | 45% | 0.447 | S | S | . | . | H | α-helix | trans | -69.2 | -44.8 | 175.6 | -72.7 | 171.1 | 0 | 0 | 0 | 110.7 | E322 F323 R329 E330 | E322-L326 VanDerWaalsContact O-CG 3.29Å; E322-L326 WeakPolarHBondContact O-CG 3.35Å; E322-L326 PolarHBondContact O-N 3.1Å; E322-L326 VanDerWaalsContact O-N 3.08Å; F323-L326 PolarHBondContact O-N 2.86Å; L326-R329 PolarHBondContact O-N 2.97Å; L326-R329 VanDerWaalsContact O-N 3.15Å; L326-E330 WeakPolarHBondContact O-CB 3.29Å; L326-E330 WeakPolarHBondContact O-CG 3.22Å; L326-E330 PolarHBondContact O-N 3.44Å |
| 327 | D | 93.3 | Very high | 92.1 | Very high | 83 Ų | 83 | 91.1 Ų | 91.1 | 44% | 0.444 | 45% | 0.452 | S | S | . | . | H | α-helix | trans | -60.1 | -46.9 | 176.7 | -68.9 | -2.9 | 0 | 0 | 0 | 110.3 | F323 R329 E330 D331 | F323-D327 PolarHBondContact O-N 2.89Å; D327-R329 VanDerWaalsContact C-N 3.27Å; D327-R329 PolarHBondContact O-N 2.96Å; D327-E330 PolarHBondContact O-N 3.35Å; D327-D331 WeakPolarHBondContact O-CB 3.25Å; D327-D331 PolarHBondContact O-N 3.25Å |
| 328 | E | 93.9 | Very high | 92.5 | Very high | 133 Ų | 133 | 95 Ų | 95 | 62% | 0.621 | 47% | 0.47 | S | S | * | . | H | α-helix | trans | -58.4 | -37.1 | 175.1 | -77.8 | 176.5 | -177.4 | 0 | 0 | 112.9 | D324 A332 | D324-E328 WeakPolarHBondContact O-CB 3.16Å; D324-E328 VanDerWaalsContact O-CG 3.31Å; D324-E328 WeakPolarHBondContact O-CG 3.24Å; D324-E328 PolarHBondContact O-N 3.08Å; E328-A332 WeakPolarHBondContact O-CB 3.1Å; E328-A332 PolarHBondContact O-N 3.41Å; E328-A332 VanDerWaalsContact O-N 3.12Å |
| 329 | R | 93.8 | Very high | 92.8 | Very high | 111 Ų | 111 | 99.6 Ų | 99.6 | 42% | 0.419 | 48% | 0.476 | S | S | . | . | H | α-helix | trans | -74.4 | -42 | 177.8 | -171.3 | -172.9 | 67.5 | -169.5 | -3.3 | 111.5 | Y325 L326 D327 A332 E333 | Y325-R329 WeakPolarHBondContact O-CB 3.37Å; Y325-R329 PolarHBondContact O-N 2.73Å; Y325-R329 VanDerWaalsContact O-N 3.16Å; L326-R329 PolarHBondContact O-N 2.97Å; L326-R329 VanDerWaalsContact O-N 3.15Å; D327-R329 VanDerWaalsContact C-N 3.27Å; D327-R329 PolarHBondContact O-N 2.96Å; R329-A332 PolarHBondContact O-N 3.07Å; R329-E333 IonicContact NE-OE1 3.66Å; R329-E333 WeakPolarHBondContact O-CB 3.29Å; R329-E333 WeakPolarHBondContact O-CG 3.5Å; R329-E333 PolarHBondContact O-N 3.23Å |
| 330 | E | 94 | Very high | 93.1 | Very high | 97 Ų | 97 | 104 Ų | 104 | 45% | 0.453 | 49% | 0.492 | S | S | . | . | H | α-helix | trans | -62.4 | -45.2 | 176.8 | -74.9 | -179.4 | -171.3 | 0 | 0 | 110.6 | L326 D327 A332 E333 D334 | L326-E330 WeakPolarHBondContact O-CB 3.29Å; L326-E330 WeakPolarHBondContact O-CG 3.22Å; L326-E330 PolarHBondContact O-N 3.44Å; D327-E330 PolarHBondContact O-N 3.35Å; E330-A332 PolarHBondContact O-N 2.88Å; E330-E333 PolarHBondContact O-N 3.41Å; E330-D334 WeakPolarHBondContact O-CB 3.2Å; E330-D334 PolarHBondContact O-N 2.8Å |
| 331 | D | 95.7 | Very high | 93.5 | Very high | 101 Ų | 101 | 104.7 Ų | 104.7 | 54% | 0.54 | 50% | 0.495 | S | S | . | . | H | α-helix | trans | -59.3 | -44.6 | 174.4 | -74.6 | -16.1 | 0 | 0 | 0 | 111.3 | D327 E333 D334 E335 | D327-D331 WeakPolarHBondContact O-CB 3.25Å; D327-D331 PolarHBondContact O-N 3.25Å; D331-E333 PolarHBondContact O-N 3.33Å; D331-D334 PolarHBondContact O-N 3.29Å; D331-E335 WeakPolarHBondContact O-CB 3.3Å; D331-E335 WeakPolarHBondContact O-CG 3.39Å; D331-E335 PolarHBondContact O-N 3.18Å |
| 332 | A | 95.2 | Very high | 93.9 | Very high | 56 Ų | 56 | 99.5 Ų | 99.5 | 46% | 0.463 | 48% | 0.48 | S | S | . | . | H | α-helix | trans | -66.5 | -36.2 | 177.7 | 0 | 0 | 0 | 0 | 0 | 113.2 | E328 R329 E330 A336 | E328-A332 WeakPolarHBondContact O-CB 3.1Å; E328-A332 PolarHBondContact O-N 3.41Å; E328-A332 VanDerWaalsContact O-N 3.12Å; R329-A332 PolarHBondContact O-N 3.07Å; E330-A332 PolarHBondContact O-N 2.88Å; A332-A336 WeakPolarHBondContact O-CB 3.35Å; A332-A336 PolarHBondContact O-N 2.96Å |
| 333 | E | 95.3 | Very high | 94.3 | Very high | 85 Ų | 85 | 98.7 Ų | 98.7 | 40% | 0.397 | 48% | 0.476 | S | S | . | . | H | α-helix | trans | -69.8 | -40.6 | 174.4 | -75.4 | 178.4 | -159.5 | 0 | 0 | 111.7 | R329 E330 D331 A336 R337 | R329-E333 IonicContact NE-OE1 3.66Å; R329-E333 WeakPolarHBondContact O-CB 3.29Å; R329-E333 WeakPolarHBondContact O-CG 3.5Å; R329-E333 PolarHBondContact O-N 3.23Å; E330-E333 PolarHBondContact O-N 3.41Å; D331-E333 PolarHBondContact O-N 3.33Å; E333-A336 PolarHBondContact O-N 2.83Å; E333-R337 WeakPolarHBondContact O-CB 3.37Å; E333-R337 WeakPolarHBondContact O-CG 3.31Å; E333-R337 PolarHBondContact O-N 3.41Å; E333-R337 IonicContact OE2-NH1 3.89Å |
| 334 | D | 95.4 | Very high | 94.7 | Very high | 82 Ų | 82 | 97.9 Ų | 97.9 | 44% | 0.439 | 47% | 0.47 | S | S | . | . | H | α-helix | trans | -63.5 | -44.6 | 174.2 | -85.6 | -30.4 | 0 | 0 | 0 | 111.4 | E330 D331 A336 R337 E338 | E330-D334 WeakPolarHBondContact O-CB 3.2Å; E330-D334 PolarHBondContact O-N 2.8Å; D331-D334 PolarHBondContact O-N 3.29Å; D334-A336 VanDerWaalsContact C-N 3.32Å; D334-A336 PolarHBondContact O-N 2.85Å; D334-R337 PolarHBondContact O-N 3.42Å; D334-R337 IonicContact OD1-CZ 3.55Å; D334-R337 VanDerWaalsContact OD1-CZ 3.32Å; D334-R337 IonicContact OD1-NE 3.21Å; D334-R337 PolarHBondContact OD1-NE 3.48Å; D334-R337 IonicContact OD1-NH2 2.69Å; D334-R337 PolarHBondContact OD1-NH2 2.83Å; D334-R337 IonicContact OD2-NH2 2.89Å; D334-E338 WeakPolarHBondContact O-CB 3.26Å; D334-E338 PolarHBondContact O-N 2.86Å |
| 335 | E | 95.2 | Very high | 94.9 | Very high | 99 Ų | 99 | 100.6 Ų | 100.6 | 46% | 0.463 | 47% | 0.474 | S | S | . | . | H | α-helix | trans | -61.4 | -39.4 | 173.5 | -76.4 | -174.7 | -166.7 | 0 | 0 | 112.1 | D331 R339 | D331-E335 WeakPolarHBondContact O-CB 3.3Å; D331-E335 WeakPolarHBondContact O-CG 3.39Å; D331-E335 PolarHBondContact O-N 3.18Å; E335-R339 WeakPolarHBondContact O-CB 3.39Å; E335-R339 WeakPolarHBondContact O-CG 3.01Å; E335-R339 PolarHBondContact O-N 2.9Å; E335-R339 IonicContact OE2-CZ 3.7Å; E335-R339 IonicContact OE2-NH2 3.32Å; E335-R339 PolarHBondContact OE2-NH2 3.44Å |
| 336 | A | 95.7 | Very high | 95.1 | Very high | 49 Ų | 49 | 98.9 Ų | 98.9 | 41% | 0.405 | 47% | 0.471 | S | S | . | . | H | α-helix | trans | -67.2 | -43 | 177.1 | 0 | 0 | 0 | 0 | 0 | 111.7 | A332 E333 D334 R339 E340 | A332-A336 WeakPolarHBondContact O-CB 3.35Å; A332-A336 PolarHBondContact O-N 2.96Å; E333-A336 PolarHBondContact O-N 2.83Å; D334-A336 VanDerWaalsContact C-N 3.32Å; D334-A336 PolarHBondContact O-N 2.85Å; A336-R339 PolarHBondContact O-N 2.94Å; A336-E340 PolarHBondContact O-N 2.89Å |
| 337 | R | 94.7 | Very high | 95.3 | Very high | 115 Ų | 115 | 102.2 Ų | 102.2 | 43% | 0.434 | 49% | 0.485 | S | S | . | . | H | α-helix | trans | -61.1 | -45.3 | 174.1 | -76.2 | -172 | -73.3 | -99.6 | 9.9 | 111.2 | E333 D334 R339 E340 E341 | E333-R337 WeakPolarHBondContact O-CB 3.37Å; E333-R337 WeakPolarHBondContact O-CG 3.31Å; E333-R337 PolarHBondContact O-N 3.41Å; E333-R337 IonicContact OE2-NH1 3.89Å; D334-R337 PolarHBondContact O-N 3.42Å; D334-R337 IonicContact OD1-CZ 3.55Å; D334-R337 VanDerWaalsContact OD1-CZ 3.32Å; D334-R337 IonicContact OD1-NE 3.21Å; D334-R337 PolarHBondContact OD1-NE 3.48Å; D334-R337 IonicContact OD1-NH2 2.69Å; D334-R337 PolarHBondContact OD1-NH2 2.83Å; D334-R337 IonicContact OD2-NH2 2.89Å; R337-R339 VanDerWaalsContact C-N 3.33Å; R337-R339 PolarHBondContact O-N 2.87Å; R337-E340 PolarHBondContact O-N 3.31Å; R337-E341 WeakPolarHBondContact O-CB 3.45Å; R337-E341 WeakPolarHBondContact O-CG 3.42Å; R337-E341 PolarHBondContact O-N 3.48Å |
| 338 | E | 95.1 | Very high | 95.4 | Very high | 141 Ų | 141 | 103.7 Ų | 103.7 | 66% | 0.659 | 49% | 0.489 | S | S | * | . | H | α-helix | trans | -63.2 | -39.3 | 178.8 | -171.6 | 174 | -168.5 | 0 | 0 | 111.6 | D334 A342 | D334-E338 WeakPolarHBondContact O-CB 3.26Å; D334-E338 PolarHBondContact O-N 2.86Å; E338-A342 VanDerWaalsContact O-CB 3.27Å; E338-A342 WeakPolarHBondContact O-CB 3.09Å; E338-A342 PolarHBondContact O-N 3.03Å |
| 339 | R | 95.1 | Very high | 95.5 | Very high | 148 Ų | 148 | 103.5 Ų | 103.5 | 56% | 0.558 | 49% | 0.488 | S | S | * | . | H | α-helix | trans | -64.9 | -46.2 | 173.6 | -70.9 | 173 | -150.6 | 165.3 | 7.2 | 112.2 | E335 A336 R337 E341 A342 E343 | E335-R339 WeakPolarHBondContact O-CB 3.39Å; E335-R339 WeakPolarHBondContact O-CG 3.01Å; E335-R339 PolarHBondContact O-N 2.9Å; E335-R339 IonicContact OE2-CZ 3.7Å; E335-R339 IonicContact OE2-NH2 3.32Å; E335-R339 PolarHBondContact OE2-NH2 3.44Å; A336-R339 PolarHBondContact O-N 2.94Å; R337-R339 VanDerWaalsContact C-N 3.33Å; R337-R339 PolarHBondContact O-N 2.87Å; R339-E341 VanDerWaalsContact C-N 3.34Å; R339-E341 PolarHBondContact O-N 2.82Å; R339-A342 PolarHBondContact O-N 3.23Å; R339-E343 WeakPolarHBondContact O-CB 3.4Å; R339-E343 WeakPolarHBondContact O-CG 3.31Å; R339-E343 PolarHBondContact O-N 3.26Å |
| 340 | E | 95.8 | Very high | 95.6 | Very high | 123 Ų | 123 | 104.4 Ų | 104.4 | 58% | 0.575 | 50% | 0.497 | S | S | * | . | H | α-helix | trans | -63.1 | -41.2 | 177.6 | -172.6 | -174.5 | 168.2 | 0 | 0 | 111.4 | A336 R337 E343 R344 | A336-E340 PolarHBondContact O-N 2.89Å; R337-E340 PolarHBondContact O-N 3.31Å; E340-E343 PolarHBondContact O-N 2.73Å; E340-R344 VanDerWaalsContact O-CB 3.27Å; E340-R344 WeakPolarHBondContact O-CB 3.41Å; E340-R344 PolarHBondContact O-N 2.88Å |
| 341 | E | 96.4 | Very high | 95.6 | Very high | 80 Ų | 80 | 101.9 Ų | 101.9 | 37% | 0.374 | 49% | 0.493 | S | S | . | . | H | α-helix | trans | -65.2 | -39.2 | 174.3 | -72.7 | -160.6 | 179.7 | 0 | 0 | 112.4 | R337 R339 R345 | R337-E341 WeakPolarHBondContact O-CB 3.45Å; R337-E341 WeakPolarHBondContact O-CG 3.42Å; R337-E341 PolarHBondContact O-N 3.48Å; R339-E341 VanDerWaalsContact C-N 3.34Å; R339-E341 PolarHBondContact O-N 2.82Å; E341-R345 WeakPolarHBondContact O-CB 3.26Å; E341-R345 WeakPolarHBondContact O-CG 3.42Å; E341-R345 PolarHBondContact O-N 3.48Å; E341-R345 IonicContact OE2-NH2 3.51Å; E341-R345 PolarHBondContact OE2-NH2 2.94Å |
| 342 | A | 96 | Very high | 95.7 | Very high | 43 Ų | 43 | 101.7 Ų | 101.7 | 36% | 0.355 | 49% | 0.489 | S | S | . | . | H | α-helix | trans | -66.6 | -43.8 | 176.1 | 0 | 0 | 0 | 0 | 0 | 111.6 | E338 R339 R345 Q346 | E338-A342 VanDerWaalsContact O-CB 3.27Å; E338-A342 WeakPolarHBondContact O-CB 3.09Å; E338-A342 PolarHBondContact O-N 3.03Å; R339-A342 PolarHBondContact O-N 3.23Å; A342-R345 PolarHBondContact O-N 2.99Å; A342-Q346 WeakPolarHBondContact O-CB 3.37Å; A342-Q346 VanDerWaalsContact O-CG 3.31Å; A342-Q346 WeakPolarHBondContact O-CG 3.41Å; A342-Q346 PolarHBondContact O-N 3.44Å |
| 343 | E | 96.5 | Very high | 95.7 | Very high | 112 Ų | 112 | 101.5 Ų | 101.5 | 52% | 0.523 | 49% | 0.487 | S | S | . | . | H | α-helix | trans | -63.7 | -42.5 | 175.1 | -74.6 | 177.8 | -171.8 | 0 | 0 | 111.4 | R339 E340 Q346 Q347 | R339-E343 WeakPolarHBondContact O-CB 3.4Å; R339-E343 WeakPolarHBondContact O-CG 3.31Å; R339-E343 PolarHBondContact O-N 3.26Å; E340-E343 PolarHBondContact O-N 2.73Å; E343-Q346 PolarHBondContact O-N 3.06Å; E343-Q347 WeakPolarHBondContact O-CB 3.17Å; E343-Q347 WeakPolarHBondContact O-CG 3.31Å; E343-Q347 PolarHBondContact O-N 3.24Å |
| 344 | R | 95.8 | Very high | 95.8 | Very high | 107 Ų | 107 | 102.4 Ų | 102.4 | 40% | 0.404 | 49% | 0.494 | S | S | . | . | H | α-helix | trans | -62.4 | -44.5 | 175.6 | -175.1 | 175.6 | 67.2 | -126.4 | -0.8 | 111.4 | E340 Q346 Q347 E348 | E340-R344 VanDerWaalsContact O-CB 3.27Å; E340-R344 WeakPolarHBondContact O-CB 3.41Å; E340-R344 PolarHBondContact O-N 2.88Å; R344-Q346 VanDerWaalsContact C-N 3.33Å; R344-Q346 PolarHBondContact O-N 3.29Å; R344-Q347 PolarHBondContact O-N 2.89Å; R344-E348 HydrophobicContact CG-CG 4.48Å; R344-E348 WeakPolarHBondContact CG-OE1 3.43Å; R344-E348 WeakPolarHBondContact O-CB 3.25Å; R344-E348 VanDerWaalsContact O-CG 3.29Å; R344-E348 WeakPolarHBondContact O-CG 3.12Å; R344-E348 PolarHBondContact O-N 2.89Å |
| 345 | R | 96.3 | Very high | 95.8 | Very high | 142 Ų | 142 | 107 Ų | 107 | 54% | 0.536 | 51% | 0.505 | S | S | . | . | H | α-helix | trans | -61.1 | -42.5 | 174.9 | -73.1 | 173.4 | -162 | -174.5 | 11.3 | 111.2 | E341 A342 E348 E349 | E341-R345 WeakPolarHBondContact O-CB 3.26Å; E341-R345 WeakPolarHBondContact O-CG 3.42Å; E341-R345 PolarHBondContact O-N 3.48Å; E341-R345 IonicContact OE2-NH2 3.51Å; E341-R345 PolarHBondContact OE2-NH2 2.94Å; A342-R345 PolarHBondContact O-N 2.99Å; R345-E348 PolarHBondContact O-N 3.26Å; R345-E349 WeakPolarHBondContact O-CB 3.44Å; R345-E349 VanDerWaalsContact O-CG 3.25Å; R345-E349 WeakPolarHBondContact O-CG 3.45Å; R345-E349 PolarHBondContact O-N 3.4Å |
| 346 | Q | 95.5 | Very high | 95.8 | Very high | 112 Ų | 112 | 108 Ų | 108 | 52% | 0.523 | 51% | 0.505 | S | S | . | . | H | α-helix | trans | -62.8 | -45.5 | 175.7 | -75.7 | 175.7 | -0.8 | 0 | 0 | 112.1 | A342 E343 R344 E348 E349 E350 | A342-Q346 WeakPolarHBondContact O-CB 3.37Å; A342-Q346 VanDerWaalsContact O-CG 3.31Å; A342-Q346 WeakPolarHBondContact O-CG 3.41Å; A342-Q346 PolarHBondContact O-N 3.44Å; E343-Q346 PolarHBondContact O-N 3.06Å; R344-Q346 VanDerWaalsContact C-N 3.33Å; R344-Q346 PolarHBondContact O-N 3.29Å; Q346-E348 PolarHBondContact O-N 3.45Å; Q346-E349 PolarHBondContact O-N 2.8Å; Q346-E350 WeakPolarHBondContact O-CB 3.5Å; Q346-E350 WeakPolarHBondContact O-CG 3.37Å; Q346-E350 PolarHBondContact O-N 3.46Å |
| 347 | Q | 95.6 | Very high | 95.8 | Very high | 127 Ų | 127 | 111.1 Ų | 111.1 | 59% | 0.593 | 51% | 0.511 | S | S | * | . | H | α-helix | trans | -64.5 | -39.7 | 177.6 | -72.6 | 176.2 | 13.8 | 0 | 0 | 112.2 | E343 R344 A351 | E343-Q347 WeakPolarHBondContact O-CB 3.17Å; E343-Q347 WeakPolarHBondContact O-CG 3.31Å; E343-Q347 PolarHBondContact O-N 3.24Å; R344-Q347 PolarHBondContact O-N 2.89Å; Q347-A351 WeakPolarHBondContact O-CB 3.4Å; Q347-A351 PolarHBondContact O-N 3.46Å |
| 348 | E | 96 | Very high | 95.9 | Very high | 114 Ų | 114 | 110.7 Ų | 110.7 | 53% | 0.533 | 51% | 0.514 | S | S | . | . | H | α-helix | trans | -63.7 | -43.7 | 174.3 | -75 | 173.7 | -170.1 | 0 | 0 | 111.1 | R344 R345 Q346 A351 E352 | R344-E348 HydrophobicContact CG-CG 4.48Å; R344-E348 WeakPolarHBondContact CG-OE1 3.43Å; R344-E348 WeakPolarHBondContact O-CB 3.25Å; R344-E348 VanDerWaalsContact O-CG 3.29Å; R344-E348 WeakPolarHBondContact O-CG 3.12Å; R344-E348 PolarHBondContact O-N 2.89Å; R345-E348 PolarHBondContact O-N 3.26Å; Q346-E348 PolarHBondContact O-N 3.45Å; E348-A351 PolarHBondContact O-N 2.83Å; E348-E352 VanDerWaalsContact O-CB 3.32Å; E348-E352 WeakPolarHBondContact O-CB 3.28Å; E348-E352 PolarHBondContact O-N 3.37Å |
| 349 | E | 96 | Very high | 95.9 | Very high | 130 Ų | 130 | 109.7 Ų | 109.7 | 61% | 0.607 | 51% | 0.509 | S | S | * | . | H | α-helix | trans | -63.7 | -43.6 | 175.7 | -75.6 | 175.8 | -172.1 | 0 | 0 | 112.4 | R345 Q346 E352 A353 | R345-E349 WeakPolarHBondContact O-CB 3.44Å; R345-E349 VanDerWaalsContact O-CG 3.25Å; R345-E349 WeakPolarHBondContact O-CG 3.45Å; R345-E349 PolarHBondContact O-N 3.4Å; Q346-E349 PolarHBondContact O-N 2.8Å; E349-E352 PolarHBondContact O-N 3.47Å; E349-A353 WeakPolarHBondContact O-CB 3.31Å; E349-A353 PolarHBondContact O-N 3.19Å |
| 350 | E | 95.6 | Very high | 96 | Very high | 129 Ų | 129 | 110.8 Ų | 110.8 | 60% | 0.603 | 51% | 0.514 | S | S | * | . | H | α-helix | trans | -65.2 | -43.7 | 176 | -75.3 | -179.8 | -179.9 | 0 | 0 | 112 | Q346 E352 A353 L354 | Q346-E350 WeakPolarHBondContact O-CB 3.5Å; Q346-E350 WeakPolarHBondContact O-CG 3.37Å; Q346-E350 PolarHBondContact O-N 3.46Å; E350-E352 VanDerWaalsContact C-N 3.34Å; E350-E352 PolarHBondContact O-N 2.91Å; E350-A353 PolarHBondContact O-N 2.72Å; E350-L354 WeakPolarHBondContact O-CG 3.42Å; E350-L354 PolarHBondContact O-N 3.46Å |
| 351 | A | 95.5 | Very high | 96 | Very high | 44 Ų | 44 | 109.6 Ų | 109.6 | 36% | 0.364 | 51% | 0.511 | S | S | . | . | H | α-helix | trans | -65.2 | -37.9 | 176.9 | 0 | 0 | 0 | 0 | 0 | 111.8 | Q347 E348 R355 | Q347-A351 WeakPolarHBondContact O-CB 3.4Å; Q347-A351 PolarHBondContact O-N 3.46Å; E348-A351 PolarHBondContact O-N 2.83Å; A351-R355 WeakPolarHBondContact O-CG 3.4Å; A351-R355 PolarHBondContact O-N 3.31Å; A351-R355 VanDerWaalsContact O-N 3.08Å |
| 352 | E | 96.1 | Very high | 95.9 | Very high | 97 Ų | 97 | 113.5 Ų | 113.5 | 45% | 0.453 | 52% | 0.522 | S | S | . | . | H | α-helix | trans | -69 | -38 | 174.7 | -159.1 | -170.4 | -164.9 | 0 | 0 | 111.6 | E348 E349 E350 R355 R356 | E348-E352 VanDerWaalsContact O-CB 3.32Å; E348-E352 WeakPolarHBondContact O-CB 3.28Å; E348-E352 PolarHBondContact O-N 3.37Å; E349-E352 PolarHBondContact O-N 3.47Å; E350-E352 VanDerWaalsContact C-N 3.34Å; E350-E352 PolarHBondContact O-N 2.91Å; E352-R355 PolarHBondContact O-N 3.5Å; E352-R356 VanDerWaalsContact CD-NH1 3.3Å; E352-R356 VanDerWaalsContact O-CG 3.32Å; E352-R356 WeakPolarHBondContact O-CG 3.41Å; E352-R356 PolarHBondContact O-N 2.87Å; E352-R356 IonicContact OE1-CZ 2.93Å; E352-R356 IonicContact OE1-NH1 2.67Å; E352-R356 IonicContact OE1-NH2 3.41Å; E352-R356 PolarHBondContact OE1-NH2 3.29Å; E352-R356 IonicContact OE2-CZ 2.7Å; E352-R356 IonicContact OE2-NH1 2.78Å; E352-R356 PolarHBondContact OE2-NH1 3.45Å; E352-R356 IonicContact OE2-NH2 3.91Å; E352-R356 PolarHBondContact OE2-NH2 2.89Å |
| 353 | A | 96.4 | Very high | 95.9 | Very high | 53 Ų | 53 | 117.5 Ų | 117.5 | 44% | 0.438 | 53% | 0.533 | S | S | . | . | H | α-helix | trans | -62.5 | -45 | 174.2 | 0 | 0 | 0 | 0 | 0 | 112.2 | E349 E350 R356 E357 | E349-A353 WeakPolarHBondContact O-CB 3.31Å; E349-A353 PolarHBondContact O-N 3.19Å; E350-A353 PolarHBondContact O-N 2.72Å; A353-R356 PolarHBondContact O-N 3.44Å; A353-E357 PolarHBondContact O-N 3.36Å |
| 354 | L | 96.4 | Very high | 95.8 | Very high | 104 Ų | 104 | 117 Ų | 117 | 55% | 0.545 | 53% | 0.531 | S | S | . | . | H | α-helix | trans | -62.1 | -43 | 175.7 | -76.8 | 168.3 | 0 | 0 | 0 | 112.2 | E350 R356 E357 E358 | E350-L354 WeakPolarHBondContact O-CG 3.42Å; E350-L354 PolarHBondContact O-N 3.46Å; L354-R356 VanDerWaalsContact C-N 3.34Å; L354-R356 PolarHBondContact O-N 3.02Å; L354-E357 PolarHBondContact O-N 3.36Å; L354-E358 PolarHBondContact O-N 2.88Å |
| 355 | R | 95.6 | Very high | 95.8 | Very high | 177 Ų | 177 | 119.4 Ų | 119.4 | 67% | 0.668 | 54% | 0.541 | S | S | * | . | H | α-helix | trans | -61 | -42.9 | 176 | -74.9 | 177.1 | -176.3 | -168 | 3.7 | 112 | A351 E352 E357 E358 E359 | A351-R355 WeakPolarHBondContact O-CG 3.4Å; A351-R355 PolarHBondContact O-N 3.31Å; A351-R355 VanDerWaalsContact O-N 3.08Å; E352-R355 PolarHBondContact O-N 3.5Å; R355-E357 VanDerWaalsContact C-N 3.3Å; R355-E357 PolarHBondContact O-N 3.45Å; R355-E358 PolarHBondContact O-N 3.34Å; R355-E359 WeakPolarHBondContact O-CB 3.47Å; R355-E359 WeakPolarHBondContact O-CG 3.38Å; R355-E359 PolarHBondContact O-N 2.94Å |
| 356 | R | 96.1 | Very high | 95.7 | Very high | 121 Ų | 121 | 117.6 Ų | 117.6 | 46% | 0.457 | 54% | 0.539 | S | S | . | . | H | α-helix | trans | -63.2 | -36.5 | 175.3 | -72 | 175.6 | -177.5 | 124.3 | -3.1 | 112 | E352 A353 L354 R360 | E352-R356 VanDerWaalsContact CD-NH1 3.3Å; E352-R356 VanDerWaalsContact O-CG 3.32Å; E352-R356 WeakPolarHBondContact O-CG 3.41Å; E352-R356 PolarHBondContact O-N 2.87Å; E352-R356 IonicContact OE1-CZ 2.93Å; E352-R356 IonicContact OE1-NH1 2.67Å; E352-R356 IonicContact OE1-NH2 3.41Å; E352-R356 PolarHBondContact OE1-NH2 3.29Å; E352-R356 IonicContact OE2-CZ 2.7Å; E352-R356 IonicContact OE2-NH1 2.78Å; E352-R356 PolarHBondContact OE2-NH1 3.45Å; E352-R356 IonicContact OE2-NH2 3.91Å; E352-R356 PolarHBondContact OE2-NH2 2.89Å; A353-R356 PolarHBondContact O-N 3.44Å; L354-R356 VanDerWaalsContact C-N 3.34Å; L354-R356 PolarHBondContact O-N 3.02Å; R356-R360 VanDerWaalsContact O-CG 3.28Å; R356-R360 WeakPolarHBondContact O-CG 3.41Å; R356-R360 PolarHBondContact O-N 3.41Å; R356-R360 VanDerWaalsContact O-N 3.13Å |
| 357 | E | 96.2 | Very high | 95.7 | Very high | 114 Ų | 114 | 117.8 Ų | 117.8 | 53% | 0.533 | 54% | 0.54 | S | S | . | . | H | α-helix | trans | -70 | -43.8 | 176.1 | -171.3 | 175.1 | -171.5 | 0 | 0 | 111.8 | A353 L354 R355 E359 R360 L361 | A353-E357 PolarHBondContact O-N 3.36Å; L354-E357 PolarHBondContact O-N 3.36Å; R355-E357 VanDerWaalsContact C-N 3.3Å; R355-E357 PolarHBondContact O-N 3.45Å; E357-E359 PolarHBondContact O-N 3.38Å; E357-R360 PolarHBondContact O-N 2.86Å; E357-L361 HydrophobicContact CG-CD1 4.33Å; E357-L361 WeakPolarHBondContact O-CG 3.36Å; E357-L361 PolarHBondContact O-N 3.15Å |
| 358 | E | 95.5 | Very high | 95.6 | Very high | 106 Ų | 106 | 119.4 Ų | 119.4 | 50% | 0.495 | 54% | 0.54 | S | S | . | . | H | α-helix | trans | -60.8 | -42.5 | 174.4 | -75.7 | -170.3 | -173.9 | 0 | 0 | 112.4 | L354 R355 L361 R362 | L354-E358 PolarHBondContact O-N 2.88Å; R355-E358 PolarHBondContact O-N 3.34Å; E358-L361 PolarHBondContact O-N 2.85Å; E358-R362 WeakPolarHBondContact O-CB 3.28Å; E358-R362 VanDerWaalsContact O-CG 3.28Å; E358-R362 WeakPolarHBondContact O-CG 3.22Å; E358-R362 PolarHBondContact O-N 3.42Å; E358-R362 IonicContact OE2-NH2 3.65Å |
| 359 | E | 95.7 | Very high | 95.5 | Very high | 120 Ų | 120 | 120.3 Ų | 120.3 | 56% | 0.561 | 54% | 0.543 | S | S | * | . | H | α-helix | trans | -60.7 | -46.2 | 175.6 | -76.9 | 175.5 | 178.8 | 0 | 0 | 111.1 | R355 E357 L361 R362 E363 | R355-E359 WeakPolarHBondContact O-CB 3.47Å; R355-E359 WeakPolarHBondContact O-CG 3.38Å; R355-E359 PolarHBondContact O-N 2.94Å; E357-E359 PolarHBondContact O-N 3.38Å; E359-L361 PolarHBondContact O-N 2.91Å; E359-R362 PolarHBondContact O-N 3.16Å; E359-E363 WeakPolarHBondContact O-CG 3.37Å; E359-E363 PolarHBondContact O-N 2.86Å |
| 360 | R | 96.2 | Very high | 95.3 | Very high | 172 Ų | 172 | 121.6 Ų | 121.6 | 65% | 0.649 | 54% | 0.542 | S | S | * | . | H | α-helix | trans | -59.5 | -45.3 | 174.9 | -74.7 | 175.2 | -178.5 | -167.1 | 1.7 | 112.5 | R356 E357 R362 E363 E364 | R356-R360 VanDerWaalsContact O-CG 3.28Å; R356-R360 WeakPolarHBondContact O-CG 3.41Å; R356-R360 PolarHBondContact O-N 3.41Å; R356-R360 VanDerWaalsContact O-N 3.13Å; E357-R360 PolarHBondContact O-N 2.86Å; R360-R362 VanDerWaalsContact C-N 3.31Å; R360-R362 PolarHBondContact O-N 3.39Å; R360-E363 PolarHBondContact O-N 3.27Å; R360-E364 WeakPolarHBondContact O-CG 3.35Å; R360-E364 PolarHBondContact O-N 3.25Å |
| 361 | L | 95.9 | Very high | 95.1 | Very high | 98 Ų | 98 | 120.8 Ų | 120.8 | 51% | 0.513 | 54% | 0.538 | S | S | . | . | H | α-helix | trans | -64.8 | -35.6 | 178.4 | -73.3 | 172.3 | 0 | 0 | 0 | 112.1 | E357 E358 E359 Y365 | E357-L361 HydrophobicContact CG-CD1 4.33Å; E357-L361 WeakPolarHBondContact O-CG 3.36Å; E357-L361 PolarHBondContact O-N 3.15Å; E358-L361 PolarHBondContact O-N 2.85Å; E359-L361 PolarHBondContact O-N 2.91Å; L361-Y365 VanDerWaalsContact O-CB 3.3Å; L361-Y365 WeakPolarHBondContact O-CB 3.39Å; L361-Y365 PolarHBondContact O-N 3.25Å |
| 362 | R | 95.6 | Very high | 94.9 | Very high | 162 Ų | 162 | 124.8 Ų | 124.8 | 61% | 0.611 | 55% | 0.549 | S | S | * | . | H | α-helix | trans | -67.1 | -44.7 | 174.3 | -74.5 | 176.3 | -170.2 | -170.3 | 9 | 111.5 | E358 E359 R360 Y365 E366 | E358-R362 WeakPolarHBondContact O-CB 3.28Å; E358-R362 VanDerWaalsContact O-CG 3.28Å; E358-R362 WeakPolarHBondContact O-CG 3.22Å; E358-R362 PolarHBondContact O-N 3.42Å; E358-R362 IonicContact OE2-NH2 3.65Å; E359-R362 PolarHBondContact O-N 3.16Å; R360-R362 VanDerWaalsContact C-N 3.31Å; R360-R362 PolarHBondContact O-N 3.39Å; R362-Y365 PolarHBondContact O-N 3.49Å; R362-E366 WeakPolarHBondContact O-CG 3.25Å; R362-E366 PolarHBondContact O-N 2.88Å |
| 363 | E | 95.2 | Very high | 94.6 | Very high | 127 Ų | 127 | 122.7 Ų | 122.7 | 59% | 0.593 | 55% | 0.549 | S | S | * | . | H | α-helix | trans | -59.2 | -48.2 | 175 | -72.8 | 177.2 | 172.1 | 0 | 0 | 111 | E359 R360 Y365 E366 E367 | E359-E363 WeakPolarHBondContact O-CG 3.37Å; E359-E363 PolarHBondContact O-N 2.86Å; R360-E363 PolarHBondContact O-N 3.27Å; E363-Y365 VanDerWaalsContact C-N 3.33Å; E363-Y365 PolarHBondContact O-N 3.39Å; E363-E366 PolarHBondContact O-N 3.38Å; E363-E367 WeakPolarHBondContact O-CG 3.39Å; E363-E367 PolarHBondContact O-N 2.97Å |
| 364 | E | 95.5 | Very high | 94.2 | Very high | 101 Ų | 101 | 125.1 Ų | 125.1 | 47% | 0.472 | 55% | 0.551 | S | S | . | * | H | α-helix | trans | -60.8 | -40.1 | 176.2 | -74.7 | -176.9 | -175.1 | 0 | 0 | 112.6 | R360 E367 R368 | R360-E364 WeakPolarHBondContact O-CG 3.35Å; R360-E364 PolarHBondContact O-N 3.25Å; E364-E367 PolarHBondContact O-N 2.94Å; E364-R368 WeakPolarHBondContact O-CB 3.49Å; E364-R368 WeakPolarHBondContact O-CG 3.35Å; E364-R368 PolarHBondContact O-N 3.23Å |
| 365 | Y | 94.6 | Very high | 93.8 | Very high | 158 Ų | 158 | 124.7 Ų | 124.7 | 62% | 0.62 | 55% | 0.549 | S | S | * | . | H | α-helix | trans | -65.8 | -42.9 | 176.7 | -179 | -96.4 | 0 | 0 | 0 | 111.8 | L361 R362 E363 R368 K369 | L361-Y365 VanDerWaalsContact O-CB 3.3Å; L361-Y365 WeakPolarHBondContact O-CB 3.39Å; L361-Y365 PolarHBondContact O-N 3.25Å; R362-Y365 PolarHBondContact O-N 3.49Å; E363-Y365 VanDerWaalsContact C-N 3.33Å; E363-Y365 PolarHBondContact O-N 3.39Å; Y365-R368 PolarHBondContact O-N 2.86Å; Y365-K369 WeakPolarHBondContact O-CB 3.43Å; Y365-K369 PolarHBondContact O-N 3.26Å |
| 366 | E | 95.1 | Very high | 93.2 | Very high | 104 Ų | 104 | 121.7 Ų | 121.7 | 49% | 0.486 | 55% | 0.546 | S | S | . | . | H | α-helix | trans | -64 | -42.1 | 175 | -75.7 | -169.6 | -168.8 | 0 | 0 | 112.1 | R362 E363 K369 R370 | R362-E366 WeakPolarHBondContact O-CG 3.25Å; R362-E366 PolarHBondContact O-N 2.88Å; E363-E366 PolarHBondContact O-N 3.38Å; E366-K369 PolarHBondContact O-N 3.13Å; E366-R370 VanDerWaalsContact O-CG 3.29Å; E366-R370 WeakPolarHBondContact O-CG 3.3Å; E366-R370 PolarHBondContact O-N 3.35Å; E366-R370 IonicContact OE2-NH2 3.41Å; E366-R370 PolarHBondContact OE2-NH2 3.46Å |
| 367 | E | 94.2 | Very high | 92.4 | Very high | 115 Ų | 115 | 123.5 Ų | 123.5 | 54% | 0.537 | 56% | 0.559 | S | S | . | * | H | α-helix | trans | -62.2 | -45.6 | 175.5 | -76.6 | -171.9 | 171.1 | 0 | 0 | 111.9 | E363 E364 K369 R370 Q371 | E363-E367 WeakPolarHBondContact O-CG 3.39Å; E363-E367 PolarHBondContact O-N 2.97Å; E364-E367 PolarHBondContact O-N 2.94Å; E367-K369 VanDerWaalsContact C-N 3.32Å; E367-K369 PolarHBondContact O-N 3.27Å; E367-R370 PolarHBondContact O-N 3.27Å; E367-Q371 WeakPolarHBondContact O-CG 3.39Å; E367-Q371 PolarHBondContact O-N 3.41Å |
| 368 | R | 94.4 | Very high | 91.6 | Very high | 161 Ų | 161 | 125.1 Ų | 125.1 | 61% | 0.608 | 57% | 0.565 | S | S | * | * | H | α-helix | trans | -58.9 | -44.9 | 174.9 | -77.2 | -179.4 | -177.2 | -148.9 | 4.1 | 111.6 | E364 Y365 R370 Q371 E372 | E364-R368 WeakPolarHBondContact O-CB 3.49Å; E364-R368 WeakPolarHBondContact O-CG 3.35Å; E364-R368 PolarHBondContact O-N 3.23Å; Y365-R368 PolarHBondContact O-N 2.86Å; R368-R370 VanDerWaalsContact C-N 3.32Å; R368-R370 PolarHBondContact O-N 2.96Å; R368-Q371 PolarHBondContact O-N 3.46Å; R368-E372 WeakPolarHBondContact O-CB 3.28Å; R368-E372 WeakPolarHBondContact O-CG 3.23Å; R368-E372 PolarHBondContact O-N 2.94Å |
| 369 | K | 93.5 | Very high | 90.6 | Very high | 134 Ų | 134 | 125.7 Ų | 125.7 | 58% | 0.583 | 58% | 0.575 | S | S | * | * | H | α-helix | trans | -63.6 | -37.9 | 178.2 | -167.4 | -179.7 | -179.3 | -177.9 | 0 | 112 | Y365 E366 E367 A373 | Y365-K369 WeakPolarHBondContact O-CB 3.43Å; Y365-K369 PolarHBondContact O-N 3.26Å; E366-K369 PolarHBondContact O-N 3.13Å; E367-K369 VanDerWaalsContact C-N 3.32Å; E367-K369 PolarHBondContact O-N 3.27Å; K369-A373 WeakPolarHBondContact O-CB 3.29Å; K369-A373 PolarHBondContact O-N 3.3Å |
| 370 | R | 92.6 | Very high | 89 | Confident | 156 Ų | 156 | 128.2 Ų | 128.2 | 59% | 0.589 | 60% | 0.599 | S | S | * | * | H | α-helix | trans | -64.9 | -45.5 | 173.5 | -71.9 | 175.1 | -165.9 | -173.6 | 9.9 | 111.2 | E366 E367 R368 E372 A373 E374 | E366-R370 VanDerWaalsContact O-CG 3.29Å; E366-R370 WeakPolarHBondContact O-CG 3.3Å; E366-R370 PolarHBondContact O-N 3.35Å; E366-R370 IonicContact OE2-NH2 3.41Å; E366-R370 PolarHBondContact OE2-NH2 3.46Å; E367-R370 PolarHBondContact O-N 3.27Å; R368-R370 VanDerWaalsContact C-N 3.32Å; R368-R370 PolarHBondContact O-N 2.96Å; R370-E372 PolarHBondContact O-N 2.89Å; R370-A373 PolarHBondContact O-N 2.71Å; R370-E374 WeakPolarHBondContact O-CG 3.15Å; R370-E374 PolarHBondContact O-N 2.85Å |
| 371 | Q | 91.7 | Very high | 88.6 | Confident | 113 Ų | 113 | 126 Ų | 126 | 53% | 0.528 | 60% | 0.597 | S | S | . | * | H | α-helix | trans | -63.1 | -40.2 | 177 | -71.1 | 176.4 | 12.4 | 0 | 0 | 112.4 | E367 R368 E374 N375 | E367-Q371 WeakPolarHBondContact O-CG 3.39Å; E367-Q371 PolarHBondContact O-N 3.41Å; R368-Q371 PolarHBondContact O-N 3.46Å; Q371-E374 PolarHBondContact O-N 2.91Å; Q371-N375 WeakPolarHBondContact O-CB 3.11Å; Q371-N375 VanDerWaalsContact O-CG 3.29Å; Q371-N375 PolarHBondContact O-N 3.32Å; Q371-N375 PolarHBondContact O-ND2 2.98Å |
| 372 | E | 90.9 | Very high | 88.2 | Confident | 127 Ų | 127 | 127.5 Ų | 127.5 | 59% | 0.593 | 60% | 0.601 | S | S | * | * | H | α-helix | trans | -64.3 | -43.6 | 174.9 | -75.9 | 177.2 | -179 | 0 | 0 | 111.8 | R368 R370 N375 L376 | R368-E372 WeakPolarHBondContact O-CB 3.28Å; R368-E372 WeakPolarHBondContact O-CG 3.23Å; R368-E372 PolarHBondContact O-N 2.94Å; R370-E372 PolarHBondContact O-N 2.89Å; E372-N375 PolarHBondContact O-N 2.89Å; E372-L376 WeakPolarHBondContact O-CG 3.39Å; E372-L376 PolarHBondContact O-N 3.41Å |
| 373 | A | 89.7 | Confident | 87.8 | Confident | 54 Ų | 54 | 125.6 Ų | 125.6 | 45% | 0.446 | 60% | 0.601 | S | S | . | * | H | α-helix | trans | -62.6 | -44.5 | 175.4 | 0 | 0 | 0 | 0 | 0 | 112 | K369 R370 N375 L376 E377 | K369-A373 WeakPolarHBondContact O-CB 3.29Å; K369-A373 PolarHBondContact O-N 3.3Å; R370-A373 PolarHBondContact O-N 2.71Å; A373-N375 VanDerWaalsContact C-N 3.33Å; A373-N375 PolarHBondContact O-N 3.3Å; A373-L376 PolarHBondContact O-N 3.44Å; A373-E377 PolarHBondContact O-N 3.22Å |
| 374 | E | 88.5 | Confident | 87.4 | Confident | 103 Ų | 103 | 125.5 Ų | 125.5 | 48% | 0.481 | 60% | 0.601 | S | S | . | * | H | α-helix | trans | -64.3 | -35.3 | 175.5 | -74.4 | -177.4 | -168 | 0 | 0 | 112.7 | R370 Q371 K378 | R370-E374 WeakPolarHBondContact O-CG 3.15Å; R370-E374 PolarHBondContact O-N 2.85Å; Q371-E374 PolarHBondContact O-N 2.91Å; E374-K378 VanDerWaalsContact O-CG 3.29Å; E374-K378 WeakPolarHBondContact O-CG 3.04Å; E374-K378 PolarHBondContact O-N 3.41Å; E374-K378 VanDerWaalsContact O-N 3.15Å |
| 375 | N | 87.6 | Confident | 86.9 | Confident | 95 Ų | 95 | 127 Ų | 127 | 51% | 0.508 | 61% | 0.609 | S | S | . | * | H | α-helix | trans | -71.7 | -35.3 | 176.4 | -79.6 | -22.6 | 0 | 0 | 0 | 112.2 | Q371 E372 A373 K378 T379 | Q371-N375 WeakPolarHBondContact O-CB 3.11Å; Q371-N375 VanDerWaalsContact O-CG 3.29Å; Q371-N375 PolarHBondContact O-N 3.32Å; Q371-N375 PolarHBondContact O-ND2 2.98Å; E372-N375 PolarHBondContact O-N 2.89Å; A373-N375 VanDerWaalsContact C-N 3.33Å; A373-N375 PolarHBondContact O-N 3.3Å; N375-K378 PolarHBondContact O-N 3.21Å; N375-T379 PolarHBondContact O-N 2.95Å; N375-T379 PolarHBondContact O-OG1 3.46Å |
| 376 | L | 83.7 | Confident | 86.4 | Confident | 115 Ų | 115 | 124.9 Ų | 124.9 | 60% | 0.602 | 61% | 0.608 | S | S | * | * | H | α-helix | trans | -65.6 | -43.5 | 172.8 | -80.2 | 160.2 | 0 | 0 | 0 | 111.4 | E372 A373 K378 T379 T380 | E372-L376 WeakPolarHBondContact O-CG 3.39Å; E372-L376 PolarHBondContact O-N 3.41Å; A373-L376 PolarHBondContact O-N 3.44Å; L376-K378 VanDerWaalsContact C-N 3.27Å; L376-K378 PolarHBondContact O-N 2.83Å; L376-T379 WeakPolarHBondContact CA-OG1 3.31Å; L376-T379 PolarHBondContact O-N 3.28Å; L376-T379 PolarHBondContact O-OG1 3.09Å; L376-T380 PolarHBondContact O-N 2.81Å; L376-T380 PolarHBondContact O-OG1 3.48Å |
| 377 | E | 79.4 | Confident | 85.8 | Confident | 158 Ų | 158 | 126.4 Ų | 126.4 | 74% | 0.738 | 62% | 0.617 | S | S | * | * | H | α-helix | trans | -62.4 | -32.5 | 174.8 | -78.4 | -170 | 160.8 | 0 | 0 | 113.1 | A373 | A373-E377 PolarHBondContact O-N 3.22Å |
| 378 | K | 78.5 | Confident | 85.1 | Confident | 149 Ų | 149 | 127.3 Ų | 127.3 | 65% | 0.648 | 62% | 0.623 | S | S | * | * | H | α-helix | trans | -78.8 | -17.4 | 177.3 | -72.3 | 168.9 | -171.6 | 161.3 | 0 | 114.3 | E374 N375 L376 | E374-K378 VanDerWaalsContact O-CG 3.29Å; E374-K378 WeakPolarHBondContact O-CG 3.04Å; E374-K378 PolarHBondContact O-N 3.41Å; E374-K378 VanDerWaalsContact O-N 3.15Å; N375-K378 PolarHBondContact O-N 3.21Å; L376-K378 VanDerWaalsContact C-N 3.27Å; L376-K378 PolarHBondContact O-N 2.83Å |
| 379 | T | 74.4 | Confident | 84.3 | Confident | 117 Ų | 117 | 124.5 Ų | 124.5 | 72% | 0.718 | 63% | 0.625 | S | S | * | * | H | α-helix | trans | -99.8 | -5 | -178 | 43.7 | 0 | 0 | 0 | 0 | 113.8 | N375 L376 | N375-T379 PolarHBondContact O-N 2.95Å; N375-T379 PolarHBondContact O-OG1 3.46Å; L376-T379 WeakPolarHBondContact CA-OG1 3.31Å; L376-T379 PolarHBondContact O-N 3.28Å; L376-T379 PolarHBondContact O-OG1 3.09Å |
| 380 | T | 61.9 | Low | 83.5 | Confident | 173 Ų | 173 | 123.6 Ų | 123.6 | 100% | 1.061 | 63% | 0.628 | S | S | * | * | trans | -100 | 0 | 171.5 | -23.9 | 0 | 0 | 0 | 0 | 109.7 | L376 | L376-T380 PolarHBondContact O-N 2.81Å; L376-T380 PolarHBondContact O-OG1 3.48Å |
Retrieved 380 of 380 residues in 1208.7 ms
(Link to these results)