| 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 | 38.9 | Very low | 41.4 | Very low | 252 Ų | 252 | 121.1 Ų | 121.1 | 100% | 1.241 | 84% | 0.84 | S | S | * | * | 0 | 146.2 | 0 | -66.8 | 179.3 | 174.5 | 0 | 0 | 107.9 | |||||
| 2 | A | 39.9 | Very low | 41 | Very low | 89 Ų | 89 | 125.7 Ų | 125.7 | 74% | 0.736 | 84% | 0.843 | S | S | * | * | trans | -146.9 | 149.9 | -171.1 | 0 | 0 | 0 | 0 | 0 | 113 | ||||
| 3 | T | 42.1 | Very low | 40.8 | Very low | 136 Ų | 136 | 120.8 Ų | 120.8 | 83% | 0.834 | 83% | 0.828 | S | S | * | * | trans | 49.1 | 108.7 | 154 | 54.6 | 0 | 0 | 0 | 0 | 120.3 | ||||
| 4 | A | 39.6 | Very low | 40.7 | Very low | 99 Ų | 99 | 121 Ų | 121 | 82% | 0.818 | 83% | 0.83 | S | S | * | * | -170.3 | 123.1 | 127.1 | 0 | 0 | 0 | 0 | 0 | 112.3 | |||||
| 5 | P | 44.9 | Very low | 40.6 | Very low | 128 Ų | 128 | 122.8 Ų | 122.8 | 83% | 0.831 | 84% | 0.835 | S | S | * | * | P | Polyproline II helix | trans | -94 | 150.2 | 155.1 | 34.7 | -29.5 | 0 | 0 | 0 | 111.4 | ||
| 6 | G | 41.6 | Very low | 40.7 | Very low | 70 Ų | 70 | 119.5 Ų | 119.5 | 72% | 0.722 | 83% | 0.828 | S | S | * | * | P | Polyproline II helix | trans | -78.9 | 165.5 | -178.5 | 0 | 0 | 0 | 0 | 0 | 115.1 | ||
| 7 | P | 48.6 | Very low | 40.5 | Very low | 135 Ų | 135 | 118.5 Ų | 118.5 | 88% | 0.877 | 82% | 0.821 | S | S | * | * | P | Polyproline II helix | trans | -82.6 | 159.7 | -167.9 | 33.5 | -36.9 | 0 | 0 | 0 | 115 | ||
| 8 | A | 39.7 | Very low | 40.3 | Very low | 94 Ų | 94 | 121 Ų | 121 | 78% | 0.777 | 82% | 0.823 | S | S | * | * | P | Polyproline II helix | trans | -79 | 144 | -178.9 | 0 | 0 | 0 | 0 | 0 | 113.8 | ||
| 9 | G | 37.8 | Very low | 40.2 | Very low | 80 Ų | 80 | 123.2 Ų | 123.2 | 83% | 0.825 | 82% | 0.824 | S | S | * | * | P | Polyproline II helix | trans | -80.9 | 123.8 | 163.5 | 0 | 0 | 0 | 0 | 0 | 110.8 | A11 | G9-A11 PolarHBondContact O-N 3.38Š|
| 10 | I | 39.3 | Very low | 39.9 | Very low | 151 Ų | 151 | 126.2 Ų | 126.2 | 77% | 0.774 | 83% | 0.826 | S | S | * | * | P | Polyproline II helix | trans | -79.8 | 119.1 | 180 | -62.7 | 174.1 | 0 | 0 | 0 | 109.6 | M12 | I10-M12 PolarHBondContact O-N 3.26Š|
| 11 | A | 42.8 | Very low | 39.6 | Very low | 98 Ų | 98 | 130.8 Ų | 130.8 | 81% | 0.81 | 83% | 0.827 | S | S | * | * | trans | -77.1 | 114.6 | 173.2 | 0 | 0 | 0 | 0 | 0 | 110.6 | G9 | G9-A11 PolarHBondContact O-N 3.38Š| ||
| 12 | M | 36.3 | Very low | 39.6 | Very low | 176 Ų | 176 | 127.2 Ų | 127.2 | 87% | 0.867 | 81% | 0.807 | S | S | * | * | P | Polyproline II helix | trans | -89.4 | 124.5 | 170.6 | -75.4 | -67 | -70.2 | 0 | 0 | 110 | I10 | I10-M12 PolarHBondContact O-N 3.26Š|
| 13 | G | 38.5 | Very low | 39.5 | Very low | 63 Ų | 63 | 129.9 Ų | 129.9 | 65% | 0.649 | 81% | 0.808 | S | S | * | * | P | Polyproline II helix | trans | -79.3 | 165.3 | -168.9 | 0 | 0 | 0 | 0 | 0 | 115.7 | V15 | G13-V15 PolarHBondContact O-N 3.11Š|
| 14 | S | 40.3 | Very low | 39.1 | Very low | 123 Ų | 123 | 129.9 Ų | 129.9 | 86% | 0.86 | 80% | 0.802 | S | S | * | * | P | Polyproline II helix | trans | -68.2 | 117.7 | 171.4 | -177.5 | 0 | 0 | 0 | 0 | 110.9 | G16 | S14-G16 PolarHBondContact O-N 2.98Š|
| 15 | V | 37.9 | Very low | 39.4 | Very low | 148 Ų | 148 | 128.6 Ų | 128.6 | 90% | 0.897 | 79% | 0.787 | S | S | * | * | trans | -87.1 | 59.6 | 179.7 | -163.4 | 0 | 0 | 0 | 0 | 110.3 | G13 | G13-V15 PolarHBondContact O-N 3.11Š| ||
| 16 | G | 42.6 | Very low | 39.2 | Very low | 70 Ų | 70 | 127.7 Ų | 127.7 | 72% | 0.722 | 78% | 0.782 | S | S | * | * | trans | -98.5 | 29.7 | -173.3 | 0 | 0 | 0 | 0 | 0 | 115.5 | S14 | S14-G16 PolarHBondContact O-N 2.98Š| ||
| 17 | S | 37.7 | Very low | 39.3 | Very low | 102 Ų | 102 | 131.3 Ų | 131.3 | 71% | 0.713 | 78% | 0.78 | S | S | * | * | trans | -161.4 | 114.5 | 173 | -172.6 | 0 | 0 | 0 | 0 | 112.7 | ||||
| 18 | L | 36.2 | Very low | 39.1 | Very low | 164 Ų | 164 | 131.1 Ų | 131.1 | 86% | 0.859 | 77% | 0.767 | S | S | * | * | trans | -161.1 | 68.3 | 148.9 | -149.4 | 85.3 | 0 | 0 | 0 | 111.3 | ||||
| 19 | L | 38.7 | Very low | 39.2 | Very low | 163 Ų | 163 | 133.5 Ų | 133.5 | 85% | 0.853 | 77% | 0.766 | S | S | * | * | trans | -112.8 | 115.9 | 153.7 | -99.6 | 79.5 | 0 | 0 | 0 | 107.3 | R21 | L19-R21 PolarHBondContact O-N 3.03Š| ||
| 20 | E | 35.1 | Very low | 39.4 | Very low | 182 Ų | 182 | 139 Ų | 139 | 85% | 0.85 | 76% | 0.762 | S | S | * | * | trans | -63.2 | 128.4 | 168 | -72 | 173.8 | 113.3 | 0 | 0 | 109.1 | ||||
| 21 | R | 34.1 | Very low | 39.6 | Very low | 224 Ų | 224 | 136 Ų | 136 | 85% | 0.845 | 76% | 0.76 | S | S | * | * | trans | -88.8 | 114.1 | 166.5 | -69.5 | -177.7 | 176.5 | -174.6 | -1.8 | 107.6 | L19 | L19-R21 PolarHBondContact O-N 3.03Š| ||
| 22 | H | 37.8 | Very low | 39.5 | Very low | 177 Ų | 177 | 135.5 Ų | 135.5 | 82% | 0.819 | 76% | 0.756 | S | S | * | * | trans | -83.8 | 111.4 | 158.3 | -112.3 | -86.2 | 0 | 0 | 0 | 107.5 | ||||
| 23 | D | 37.5 | Very low | 39.7 | Very low | 144 Ų | 144 | 134.8 Ų | 134.8 | 77% | 0.77 | 75% | 0.754 | S | S | * | * | trans | -74.3 | 128.7 | 173.9 | -64.4 | -47.5 | 0 | 0 | 0 | 109.6 | ||||
| 24 | L | 34.8 | Very low | 39.8 | Very low | 136 Ų | 136 | 136.5 Ų | 136.5 | 71% | 0.712 | 76% | 0.762 | S | S | * | * | trans | -119.9 | 139 | 172.5 | -68.6 | 175.2 | 0 | 0 | 0 | 109.1 | ||||
| 25 | S | 45 | Very low | 39.4 | Very low | 72 Ų | 72 | 134 Ų | 134 | 50% | 0.503 | 76% | 0.757 | S | S | . | * | trans | -81.6 | 154.7 | -170.9 | 66.4 | 0 | 0 | 0 | 0 | 112.7 | E27 | S25-E27 PolarHBondContact O-N 3.15Š| ||
| 26 | P | 40.5 | Very low | 39.2 | Very low | 110 Ų | 110 | 132.9 Ų | 132.9 | 71% | 0.714 | 76% | 0.755 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -78.9 | 34.7 | -171.1 | 33.6 | -38 | 0 | 0 | 0 | 114.9 | ||
| 27 | E | 44.2 | Very low | 39.2 | Very low | 145 Ų | 145 | 138.8 Ų | 138.8 | 68% | 0.678 | 76% | 0.764 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -110.4 | -37.7 | 176.9 | -62.3 | -163.1 | 124.5 | 0 | 0 | 113 | S25 L29 R30 | S25-E27 PolarHBondContact O-N 3.15Å; E27-L29 VanDerWaalsContact C-N 3.29Å; E27-L29 PolarHBondContact O-N 3.38Å; E27-R30 PolarHBondContact O-N 3.02Å |
| 28 | E | 44.1 | Very low | 38.9 | Very low | 132 Ų | 132 | 137.8 Ų | 137.8 | 62% | 0.617 | 77% | 0.769 | S | S | * | * | G | 310 helix | trans | -64.9 | -29.5 | -175.2 | -60.4 | -171.7 | 136.1 | 0 | 0 | 113.4 | R30 A31 | E28-R30 PolarHBondContact O-N 2.84Å; E28-R30 VanDerWaalsContact O-N 3.13Å; E28-A31 PolarHBondContact O-N 2.66Å |
| 29 | L | 42.1 | Very low | 39.2 | Very low | 143 Ų | 143 | 135.8 Ų | 135.8 | 75% | 0.749 | 77% | 0.769 | S | S | * | * | G | 310 helix | trans | -66 | -12.6 | 179.9 | -77 | 171.3 | 0 | 0 | 0 | 114.5 | E27 | E27-L29 VanDerWaalsContact C-N 3.29Å; E27-L29 PolarHBondContact O-N 3.38Å |
| 30 | R | 42.4 | Very low | 39 | Very low | 197 Ų | 197 | 140 Ų | 140 | 74% | 0.743 | 77% | 0.774 | S | S | * | * | G | 310 helix | trans | -82.4 | -18.8 | 178.2 | -71.1 | -177.1 | 173.9 | 133.1 | -1 | 114 | E27 E28 | E27-R30 PolarHBondContact O-N 3.02Å; E28-R30 PolarHBondContact O-N 2.84Å; E28-R30 VanDerWaalsContact O-N 3.13Å |
| 31 | A | 43 | Very low | 39.2 | Very low | 88 Ų | 88 | 139.6 Ų | 139.6 | 73% | 0.727 | 77% | 0.772 | S | S | * | * | G | 310 helix | trans | -77.1 | -22.5 | -178.2 | 0 | 0 | 0 | 0 | 0 | 113.9 | E28 | E28-A31 PolarHBondContact O-N 2.66Š|
| 32 | A | 40.8 | Very low | 39.9 | Very low | 87 Ų | 87 | 135.3 Ų | 135.3 | 72% | 0.719 | 77% | 0.773 | S | S | * | * | G | 310 helix | trans | -89.5 | -2.3 | -167.8 | 0 | 0 | 0 | 0 | 0 | 115.8 | ||
| 33 | L | 40.5 | Very low | 40.2 | Very low | 161 Ų | 161 | 134.1 Ų | 134.1 | 84% | 0.843 | 77% | 0.772 | S | S | * | * | G | 310 helix | trans | -119.4 | 5.6 | -172 | -68.7 | 174.4 | 0 | 0 | 0 | 114.9 | ||
| 34 | A | 39.8 | Very low | 40.6 | Very low | 98 Ų | 98 | 130.1 Ų | 130.1 | 81% | 0.81 | 77% | 0.766 | S | S | * | * | trans | -101.2 | 79.1 | 177.8 | 0 | 0 | 0 | 0 | 0 | 111.7 | ||||
| 35 | G | 32.1 | Very low | 41.1 | Very low | 72 Ų | 72 | 131.7 Ų | 131.7 | 74% | 0.742 | 77% | 0.774 | S | S | * | * | trans | -161.6 | 104.9 | 177.5 | 0 | 0 | 0 | 0 | 0 | 112.1 | ||||
| 36 | S | 34.9 | Very low | 41 | Very low | 124 Ų | 124 | 137 Ų | 137 | 87% | 0.867 | 80% | 0.795 | S | S | * | * | trans | -71.2 | 159.3 | -169.4 | -163.9 | 0 | 0 | 0 | 0 | 114.4 | ||||
| 37 | Q | 41.3 | Very low | 41.4 | Very low | 194 Ų | 194 | 143.3 Ų | 143.3 | 91% | 0.907 | 81% | 0.805 | S | S | * | * | trans | -64.3 | 153 | 171.5 | -61.2 | -179.1 | 0.7 | 0 | 0 | 112.1 | ||||
| 38 | G | 32 | Very low | 41.4 | Very low | 80 Ų | 80 | 146.4 Ų | 146.4 | 83% | 0.825 | 82% | 0.816 | S | S | * | * | trans | -153.4 | 115.7 | 164 | 0 | 0 | 0 | 0 | 0 | 110.3 | ||||
| 39 | S | 43.2 | Very low | 41.1 | Very low | 122 Ų | 122 | 143.7 Ų | 143.7 | 85% | 0.853 | 82% | 0.824 | S | S | * | * | trans | -84.7 | 138.1 | 179.3 | 55.1 | 0 | 0 | 0 | 0 | 111.4 | ||||
| 40 | R | 34.2 | Very low | 41 | Very low | 252 Ų | 252 | 144.8 Ų | 144.8 | 95% | 0.951 | 83% | 0.83 | S | S | * | * | trans | -154.5 | 139.1 | 163.9 | -121.6 | 179.3 | -175.7 | -158.7 | -0.4 | 111.7 | ||||
| 41 | Q | 39.9 | Very low | 41.1 | Very low | 173 Ų | 173 | 137.7 Ų | 137.7 | 81% | 0.808 | 82% | 0.818 | S | S | * | * | trans | -79.7 | 150.1 | 175.9 | -66.8 | -166.9 | -7.2 | 0 | 0 | 111.7 | D43 | Q41-D43 PolarHBondContact O-N 2.93Š| ||
| 42 | P | 46.8 | Very low | 41.3 | Very low | 134 Ų | 134 | 140.9 Ų | 140.9 | 87% | 0.87 | 82% | 0.817 | S | S | * | * | trans | -94.7 | 83.4 | 174.3 | 36.3 | -31.3 | 0 | 0 | 0 | 111 | ||||
| 43 | D | 44.5 | Very low | 41.5 | Very low | 152 Ų | 152 | 147.6 Ų | 147.6 | 81% | 0.813 | 82% | 0.824 | S | S | * | * | trans | -105.8 | 138.6 | 173.1 | -147.6 | -13.8 | 0 | 0 | 0 | 112.9 | Q41 | Q41-D43 PolarHBondContact O-N 2.93Š| ||
| 44 | G | 45.6 | Very low | 41.8 | Very low | 61 Ų | 61 | 146.6 Ų | 146.6 | 63% | 0.629 | 82% | 0.815 | S | S | * | * | trans | 38.2 | 93.8 | 170 | 0 | 0 | 0 | 0 | 0 | 121.3 | ||||
| 45 | L | 46.7 | Very low | 42 | Very low | 168 Ų | 168 | 148.3 Ų | 148.3 | 88% | 0.88 | 81% | 0.81 | S | S | * | * | trans | -160.6 | 54.8 | 143.1 | -115.1 | 168.5 | 0 | 0 | 0 | 116.4 | ||||
| 46 | L | 41.7 | Very low | 42.6 | Very low | 183 Ų | 183 | 151.8 Ų | 151.8 | 96% | 0.958 | 81% | 0.805 | S | S | * | * | trans | -121.7 | 87 | 167 | -73.6 | 178.6 | 0 | 0 | 0 | 112 | ||||
| 47 | R | 50 | Low | 42.9 | Very low | 244 Ų | 244 | 149.6 Ų | 149.6 | 92% | 0.921 | 79% | 0.789 | S | S | * | * | trans | -127 | 55.3 | 175.9 | -157.7 | -167.1 | -178.6 | -158 | 1.6 | 113.9 | ||||
| 48 | K | 43.3 | Very low | 42.7 | Very low | 210 Ų | 210 | 150.1 Ų | 150.1 | 91% | 0.913 | 78% | 0.784 | S | S | * | * | trans | -152.9 | 117.2 | 156.5 | -122.8 | 170.5 | -177.6 | 175.2 | 0 | 110.3 | ||||
| 49 | G | 38.9 | Very low | 43.1 | Very low | 75 Ų | 75 | 152.6 Ų | 152.6 | 77% | 0.773 | 78% | 0.778 | S | S | * | * | P | Polyproline II helix | trans | -87 | 141.8 | 171.2 | 0 | 0 | 0 | 0 | 0 | 110.6 | ||
| 50 | L | 40 | Very low | 42.8 | Very low | 166 Ų | 166 | 155 Ų | 155 | 87% | 0.869 | 78% | 0.776 | S | S | * | * | P | Polyproline II helix | trans | -66.2 | 142.5 | 171.6 | -69.1 | 166.8 | 0 | 0 | 0 | 110.5 | ||
| 51 | G | 43.2 | Very low | 42.9 | Very low | 48 Ų | 48 | 151.9 Ų | 151.9 | 50% | 0.495 | 77% | 0.769 | S | S | . | * | P | Polyproline II helix | trans | -83.2 | 137.9 | -173.3 | 0 | 0 | 0 | 0 | 0 | 113 | R53 | G51-R53 PolarHBondContact O-N 3.1Š|
| 52 | H | 47.5 | Very low | 42.8 | Very low | 154 Ų | 154 | 149.5 Ų | 149.5 | 71% | 0.713 | 77% | 0.769 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -64 | 9.4 | 179.5 | -105 | -101.7 | 0 | 0 | 0 | 115.9 | ||
| 53 | R | 45.7 | Very low | 42.1 | Very low | 229 Ų | 229 | 152.6 Ų | 152.6 | 86% | 0.864 | 77% | 0.769 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -92.4 | -20.6 | -171.6 | -172.1 | 171.6 | 171.6 | -176.4 | -4.8 | 113.9 | G51 | G51-R53 PolarHBondContact O-N 3.1Š|
| 54 | E | 45.9 | Very low | 41.8 | Very low | 139 Ų | 139 | 154.8 Ų | 154.8 | 65% | 0.65 | 77% | 0.771 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -86.4 | -9.6 | -173 | -72.3 | 158.8 | -164.4 | 0 | 0 | 114 | S57 | E54-S57 PolarHBondContact O-OG 2.91Š|
| 55 | L | 45.2 | Very low | 41.1 | Very low | 135 Ų | 135 | 159 Ų | 159 | 71% | 0.707 | 78% | 0.779 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -88.4 | -9.4 | -178.4 | -75.8 | 167.4 | 0 | 0 | 0 | 115 | ||
| 56 | F | 43.6 | Very low | 40.5 | Very low | 145 Ų | 145 | 154.8 Ų | 154.8 | 64% | 0.636 | 78% | 0.776 | S | S | * | * | S | Bend | trans | -105.1 | -4.8 | -173.3 | -72.6 | -73.6 | 0 | 0 | 0 | 115 | Y58 | F56-Y58 VanDerWaalsContact C-N 3.3Å; F56-Y58 PolarHBondContact O-N 2.94Å |
| 57 | S | 41.5 | Very low | 40.3 | Very low | 78 Ų | 78 | 156.4 Ų | 156.4 | 55% | 0.545 | 78% | 0.776 | S | S | . | * | T | Hydrogen-bonded Turn | trans | -69.7 | -20.6 | -179.3 | 42.2 | 0 | 0 | 0 | 0 | 114.6 | E54 | E54-S57 PolarHBondContact O-OG 2.91Š|
| 58 | Y | 38.2 | Very low | 39.5 | Very low | 204 Ų | 204 | 150.2 Ų | 150.2 | 80% | 0.8 | 77% | 0.77 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -95.3 | 10.2 | -169.3 | -70.1 | -78.6 | 0 | 0 | 0 | 115.7 | F56 | F56-Y58 VanDerWaalsContact C-N 3.3Å; F56-Y58 PolarHBondContact O-N 2.94Å |
| 59 | L | 40.2 | Very low | 38.8 | Very low | 132 Ų | 132 | 146.8 Ų | 146.8 | 69% | 0.691 | 77% | 0.767 | S | S | * | * | trans | -121.5 | 26.6 | -172.7 | -68.7 | 175.8 | 0 | 0 | 0 | 115.3 | F61 | L59-F61 PolarHBondContact O-N 3.3Š| ||
| 60 | H | 37 | Very low | 38.7 | Very low | 174 Ų | 174 | 152.8 Ų | 152.8 | 81% | 0.806 | 77% | 0.771 | S | S | * | * | trans | -89.6 | 95.5 | 174 | -86.6 | -81.2 | 0 | 0 | 0 | 113.1 | ||||
| 61 | F | 35.7 | Very low | 38.2 | Very low | 185 Ų | 185 | 156.6 Ų | 156.6 | 81% | 0.811 | 77% | 0.774 | S | S | * | * | trans | -75.6 | 138.6 | 160.6 | -81.3 | -88.8 | 0 | 0 | 0 | 110.8 | L59 K63 | L59-F61 PolarHBondContact O-N 3.3Å; F61-K63 PolarHBondContact O-N 3.42Å | ||
| 62 | P | 37.8 | Very low | 37.6 | Very low | 124 Ų | 124 | 158.7 Ų | 158.7 | 81% | 0.805 | 79% | 0.787 | S | S | * | * | trans | -71 | 117.4 | 173.3 | 28.7 | -33.2 | 0 | 0 | 0 | 110.6 | K64 | P62-K64 PolarHBondContact O-N 3.43Š| ||
| 63 | K | 31.3 | Very low | 37.2 | Very low | 198 Ų | 198 | 157.3 Ų | 157.3 | 86% | 0.861 | 79% | 0.791 | S | S | * | * | trans | -78 | 113.9 | 178 | -155.7 | 177.3 | -172.7 | -177.7 | 0 | 109 | F61 | F61-K63 PolarHBondContact O-N 3.42Š| ||
| 64 | K | 38 | Very low | 36.5 | Very low | 198 Ų | 198 | 156.9 Ų | 156.9 | 86% | 0.861 | 79% | 0.79 | S | S | * | * | trans | -89.5 | 114.5 | 179.3 | -173.9 | 177.8 | -177.1 | 177.6 | 0 | 110.1 | P62 | P62-K64 PolarHBondContact O-N 3.43Š| ||
| 65 | D | 32.1 | Very low | 35.7 | Very low | 149 Ų | 149 | 155.6 Ų | 155.6 | 80% | 0.797 | 79% | 0.788 | S | S | * | * | trans | -67.6 | 133.8 | 178.3 | -72.8 | -46 | 0 | 0 | 0 | 112.3 | ||||
| 66 | G | 34.1 | Very low | 35.2 | Very low | 80 Ų | 80 | 156.9 Ų | 156.9 | 83% | 0.825 | 79% | 0.79 | S | S | * | * | trans | -98.5 | 120.2 | 167.6 | 0 | 0 | 0 | 0 | 0 | 110.1 | ||||
| 67 | K | 37.8 | Very low | 35.4 | Very low | 217 Ų | 217 | 155.4 Ų | 155.4 | 94% | 0.943 | 80% | 0.795 | S | S | * | * | trans | -114.9 | 146.7 | 169.6 | -118.5 | 169.2 | -177.4 | 170.3 | 0 | 110.4 | ||||
| 68 | S | 31.7 | Very low | 35.1 | Very low | 114 Ų | 114 | 156.3 Ų | 156.3 | 80% | 0.797 | 81% | 0.807 | S | S | * | * | trans | -87.9 | 156.4 | -156.9 | 47.5 | 0 | 0 | 0 | 0 | 115.1 | ||||
| 69 | T | 30.4 | Very low | 34.8 | Very low | 139 Ų | 139 | 154 Ų | 154 | 85% | 0.853 | 81% | 0.809 | S | S | * | * | trans | -59 | 131.1 | 177.3 | -29.2 | 0 | 0 | 0 | 0 | 112.9 | ||||
| 70 | K | 36.3 | Very low | 34.4 | Very low | 200 Ų | 200 | 158.9 Ų | 158.9 | 87% | 0.87 | 82% | 0.819 | S | S | * | * | trans | -134.9 | 164.9 | 151.2 | -76.5 | -163 | 176.1 | -177.9 | 0 | 110.2 | ||||
| 71 | R | 30.1 | Very low | 34.2 | Very low | 247 Ų | 247 | 153.9 Ų | 153.9 | 93% | 0.932 | 81% | 0.809 | S | S | * | * | trans | -76.3 | 155.3 | -160.6 | -63.7 | 173 | 175.8 | 160 | -3.7 | 113.5 | ||||
| 72 | A | 30.4 | Very low | 34 | Very low | 91 Ų | 91 | 150.9 Ų | 150.9 | 75% | 0.752 | 81% | 0.805 | S | S | * | * | trans | -69.2 | 167.7 | 166.2 | 0 | 0 | 0 | 0 | 0 | 112 | ||||
| 73 | P | 38.5 | Very low | 33.7 | Very low | 125 Ų | 125 | 151.3 Ų | 151.3 | 81% | 0.812 | 80% | 0.8 | S | S | * | * | -143.3 | 138 | 99.3 | 37.5 | -23.4 | 0 | 0 | 0 | 117 | |||||
| 74 | R | 30.9 | Very low | 33.8 | Very low | 220 Ų | 220 | 151.7 Ų | 151.7 | 83% | 0.83 | 80% | 0.798 | S | S | * | * | 51.9 | 120 | 128.5 | -160 | 176.3 | -177.2 | -173 | 1.4 | 122.6 | |||||
| 75 | N | 29.9 | Very low | 33.4 | Very low | 113 Ų | 113 | 151.4 Ų | 151.4 | 60% | 0.604 | 79% | 0.793 | S | S | * | * | trans | 87.7 | 132.6 | 143.9 | -87.5 | 52.3 | 0 | 0 | 0 | 123.6 | ||||
| 76 | E | 33.8 | Very low | 33.3 | Very low | 162 Ų | 162 | 156.2 Ų | 156.2 | 76% | 0.757 | 80% | 0.8 | S | S | * | * | trans | 68.6 | 146.4 | 150.9 | -60.1 | -37.8 | 95 | 0 | 0 | 123.4 | ||||
| 77 | P | 48.2 | Very low | 33.1 | Very low | 113 Ų | 113 | 159.3 Ų | 159.3 | 73% | 0.734 | 79% | 0.793 | S | S | * | * | trans | -99.3 | 169.4 | -169.2 | 40.6 | -36.8 | 0 | 0 | 0 | 113.9 | ||||
| 78 | A | 33.9 | Very low | 32.9 | Very low | 98 Ų | 98 | 157.4 Ų | 157.4 | 81% | 0.81 | 79% | 0.787 | S | S | * | * | trans | -142.9 | 131.8 | 158 | 0 | 0 | 0 | 0 | 0 | 109.3 | ||||
| 79 | D | 32.9 | Very low | 33.6 | Very low | 156 Ų | 156 | 157.4 Ų | 157.4 | 83% | 0.834 | 78% | 0.784 | S | S | * | * | trans | -65.8 | 148.7 | 167.3 | -57 | -80.9 | 0 | 0 | 0 | 110.5 | ||||
| 80 | Y | 32.8 | Very low | 33.9 | Very low | 233 Ų | 233 | 162.3 Ų | 162.3 | 91% | 0.914 | 79% | 0.787 | S | S | * | * | trans | -148 | 139.4 | 134.3 | -135.2 | -90.3 | 0 | 0 | 0 | 113.2 | ||||
| 81 | A | 31.1 | Very low | 33.6 | Very low | 70 Ų | 70 | 157 Ų | 157 | 58% | 0.579 | 78% | 0.781 | S | S | * | * | trans | -70.5 | 146.2 | -171.6 | 0 | 0 | 0 | 0 | 0 | 113.8 | ||||
| 82 | T | 31.2 | Very low | 33.8 | Very low | 121 Ų | 121 | 148.8 Ų | 148.8 | 74% | 0.742 | 77% | 0.773 | S | S | * | * | trans | 61.6 | 127.5 | 131.1 | -57.5 | 0 | 0 | 0 | 0 | 119.7 | ||||
| 83 | L | 32.4 | Very low | 34 | Very low | 134 Ų | 134 | 151.3 Ų | 151.3 | 70% | 0.702 | 77% | 0.773 | S | S | * | * | -169.8 | 148.2 | 115.3 | -98.6 | 177.9 | 0 | 0 | 0 | 113.8 | |||||
| 84 | Y | 33.4 | Very low | 33.8 | Very low | 205 Ų | 205 | 155.8 Ų | 155.8 | 80% | 0.804 | 78% | 0.781 | S | S | * | * | trans | 59.6 | 87.1 | 168.8 | -66.6 | -63.8 | 0 | 0 | 0 | 121.9 | ||||
| 85 | Y | 29 | Very low | 33.9 | Very low | 193 Ų | 193 | 149.8 Ų | 149.8 | 76% | 0.757 | 77% | 0.772 | S | S | * | * | trans | -33 | 143.7 | 136.4 | -116.2 | -125 | 0 | 0 | 0 | 115.3 | E87 | Y85-E87 HydrophobicContact CD1-CG 3.62Å; Y85-E87 HydrophobicContact CE1-CG 3.58Å | ||
| 86 | R | 31.3 | Very low | 34.6 | Very low | 249 Ų | 249 | 153.4 Ų | 153.4 | 94% | 0.94 | 78% | 0.783 | S | S | * | * | trans | -149.6 | 135.4 | 136.9 | -165 | 171.7 | -170.8 | 164.7 | 4.9 | 109.4 | ||||
| 87 | E | 29 | Very low | 34.6 | Very low | 146 Ų | 146 | 152.6 Ų | 152.6 | 68% | 0.682 | 79% | 0.789 | S | S | * | * | trans | -87.1 | 147.1 | -163.8 | -67.7 | 171.2 | 114.9 | 0 | 0 | 115.3 | Y85 | Y85-E87 HydrophobicContact CD1-CG 3.62Å; Y85-E87 HydrophobicContact CE1-CG 3.58Å | ||
| 88 | H | 33.2 | Very low | 34.1 | Very low | 177 Ų | 177 | 152.3 Ų | 152.3 | 82% | 0.819 | 79% | 0.79 | S | S | * | * | -5.5 | 160.3 | 127.4 | -64.3 | -50.6 | 0 | 0 | 0 | 118.3 | |||||
| 89 | P | 46.9 | Very low | 34.5 | Very low | 114 Ų | 114 | 155.7 Ų | 155.7 | 74% | 0.74 | 79% | 0.793 | S | S | * | * | cis | -145.5 | 158.4 | 30.7 | 41.5 | -22.3 | 0 | 0 | 0 | 119.1 | ||||
| 90 | R | 35.9 | Very low | 35.1 | Very low | 241 Ų | 241 | 154.1 Ų | 154.1 | 91% | 0.909 | 79% | 0.791 | S | S | * | * | -168.5 | 106.8 | 107.3 | -100.1 | -178.4 | -169.6 | -136.7 | 1.8 | 110.5 | |||||
| 91 | A | 31.3 | Very low | 35.4 | Very low | 90 Ų | 90 | 151.7 Ų | 151.7 | 74% | 0.744 | 79% | 0.788 | S | S | * | * | trans | -78.4 | 162.9 | 159 | 0 | 0 | 0 | 0 | 0 | 109.8 | ||||
| 92 | G | 33.2 | Very low | 35.7 | Very low | 74 Ų | 74 | 158.7 Ų | 158.7 | 76% | 0.763 | 80% | 0.8 | S | S | * | * | trans | -156.6 | 59.6 | -177.9 | 0 | 0 | 0 | 0 | 0 | 110.6 | ||||
| 93 | D | 36.2 | Very low | 35.9 | Very low | 143 Ų | 143 | 156.8 Ų | 156.8 | 77% | 0.765 | 80% | 0.804 | S | S | * | * | trans | -66.7 | 134.5 | 179.7 | -64.6 | -67 | 0 | 0 | 0 | 111.8 | ||||
| 94 | F | 32.8 | Very low | 36.6 | Very low | 220 Ų | 220 | 160.7 Ų | 160.7 | 97% | 0.965 | 81% | 0.81 | S | S | * | * | trans | -130.2 | 132.6 | 151.4 | -91.3 | -78.7 | 0 | 0 | 0 | 109.6 | ||||
| 95 | S | 32.9 | Very low | 36.8 | Very low | 94 Ų | 94 | 160.8 Ų | 160.8 | 66% | 0.657 | 81% | 0.814 | S | S | * | * | trans | -118.6 | 141.2 | -166.5 | -154.7 | 0 | 0 | 0 | 0 | 111.3 | ||||
| 96 | K | 44.5 | Very low | 37.2 | Very low | 188 Ų | 188 | 158 Ų | 158 | 82% | 0.817 | 81% | 0.812 | S | S | * | * | trans | 54.9 | 114.4 | 159 | -62.7 | 164.3 | -175.5 | 174.3 | 0 | 118.2 | ||||
| 97 | T | 35.3 | Very low | 37.7 | Very low | 146 Ų | 146 | 155.7 Ų | 155.7 | 90% | 0.896 | 81% | 0.809 | S | S | * | * | 175.9 | 152.2 | 119.7 | 27.9 | 0 | 0 | 0 | 0 | 108.4 | |||||
| 98 | S | 36.7 | Very low | 38.3 | Very low | 106 Ų | 106 | 153.9 Ų | 153.9 | 74% | 0.741 | 81% | 0.812 | S | S | * | * | cis | -145.7 | 160 | -9.8 | 50.9 | 0 | 0 | 0 | 0 | 109.3 | ||||
| 99 | L | 42.2 | Very low | 39.2 | Very low | 169 Ų | 169 | 157.2 Ų | 157.2 | 89% | 0.885 | 82% | 0.817 | S | S | * | * | trans | -107.3 | 129.4 | 171.3 | -76.9 | 171 | 0 | 0 | 0 | 109.7 | ||||
| 100 | P | 46.2 | Very low | 38.9 | Very low | 123 Ų | 123 | 158.6 Ų | 158.6 | 80% | 0.799 | 82% | 0.817 | S | S | * | * | trans | -73.8 | 139.1 | 162.8 | -15.5 | 31 | 0 | 0 | 0 | 111 | ||||
| 101 | E | 38.1 | Very low | 39.5 | Very low | 182 Ų | 182 | 158.2 Ų | 158.2 | 85% | 0.85 | 82% | 0.815 | S | S | * | * | trans | -79.5 | 133 | 178.1 | -70.7 | -172 | 89.4 | 0 | 0 | 113.4 | G103 | E101-G103 PolarHBondContact O-N 3.44Å; E101-G103 VanDerWaalsContact O-N 3.1Å | ||
| 102 | R | 38.6 | Very low | 39.9 | Very low | 218 Ų | 218 | 160 Ų | 160 | 82% | 0.823 | 82% | 0.82 | S | S | * | * | 51.6 | 46 | 129.3 | -150.8 | -175.6 | -168.5 | -178.1 | 4.6 | 118.8 | |||||
| 103 | G | 35 | Very low | 40.2 | Very low | 80 Ų | 80 | 161.4 Ų | 161.4 | 83% | 0.825 | 82% | 0.817 | S | S | * | * | trans | -68 | 128.1 | 160.5 | 0 | 0 | 0 | 0 | 0 | 112.1 | E101 | E101-G103 PolarHBondContact O-N 3.44Å; E101-G103 VanDerWaalsContact O-N 3.1Å | ||
| 104 | R | 46.6 | Very low | 40.6 | Very low | 217 Ų | 217 | 160.6 Ų | 160.6 | 82% | 0.819 | 82% | 0.817 | S | S | * | * | trans | -91.7 | 130.9 | 164.6 | -62 | -179.4 | -172.5 | -99.5 | 9.4 | 108.8 | ||||
| 105 | F | 38.7 | Very low | 40.8 | Very low | 207 Ų | 207 | 159.7 Ų | 159.7 | 91% | 0.908 | 81% | 0.813 | S | S | * | * | trans | -155.4 | 167.7 | 154.6 | -99.4 | -64 | 0 | 0 | 0 | 111 | ||||
| 106 | D | 37.2 | Very low | 41.1 | Very low | 133 Ų | 133 | 164.9 Ų | 164.9 | 71% | 0.711 | 82% | 0.824 | S | S | * | * | trans | -84.7 | 156.6 | -150.1 | -68.1 | -80.2 | 0 | 0 | 0 | 117.1 | C108 | D106-C108 VanDerWaalsContact C-N 3.29Å; D106-C108 PolarHBondContact O-N 2.94Å | ||
| 107 | K | 41.1 | Very low | 41 | Very low | 202 Ų | 202 | 162.2 Ų | 162.2 | 88% | 0.878 | 83% | 0.826 | S | S | * | * | trans | -79.1 | 75.7 | 173.3 | -63.7 | 178.3 | -176 | 174.1 | 0 | 110.1 | R109 | K107-R109 PolarHBondContact O-N 3.36Š| ||
| 108 | C | 41.2 | Very low | 41 | Very low | 108 Ų | 108 | 161.6 Ų | 161.6 | 73% | 0.73 | 82% | 0.822 | S | S | * | * | trans | -58 | 96.5 | 174.9 | -69.6 | 0 | 0 | 0 | 0 | 111.6 | D106 I110 | D106-C108 VanDerWaalsContact C-N 3.29Å; D106-C108 PolarHBondContact O-N 2.94Å; C108-I110 VanDerWaalsContact C-N 3.31Å; C108-I110 PolarHBondContact O-N 3.37Å | ||
| 109 | R | 52.1 | Low | 41.4 | Very low | 247 Ų | 247 | 161.8 Ų | 161.8 | 93% | 0.932 | 83% | 0.83 | S | S | * | * | trans | -73.4 | 80.5 | 173.1 | -80.5 | 179.9 | 158.6 | -173.9 | -4.6 | 110.1 | K107 | K107-R109 PolarHBondContact O-N 3.36Š| ||
| 110 | I | 41.5 | Very low | 41.1 | Very low | 143 Ų | 143 | 157.1 Ų | 157.1 | 73% | 0.733 | 82% | 0.822 | S | S | * | * | trans | -114.6 | 103.3 | 170.5 | -55.7 | -179 | 0 | 0 | 0 | 109 | C108 | C108-I110 VanDerWaalsContact C-N 3.31Å; C108-I110 PolarHBondContact O-N 3.37Å | ||
| 111 | R | 48.2 | Very low | 40.8 | Very low | 232 Ų | 232 | 159.7 Ų | 159.7 | 88% | 0.875 | 83% | 0.83 | S | S | * | * | trans | -102.2 | 113.7 | 163.2 | -90.6 | -174.5 | 165.3 | -168.6 | -4.1 | 108.1 | S113 | R111-S113 PolarHBondContact O-N 2.95Å; R111-S113 VanDerWaalsContact O-N 3.11Å | ||
| 112 | P | 40.6 | Very low | 40.7 | Very low | 129 Ų | 129 | 154.4 Ų | 154.4 | 84% | 0.838 | 82% | 0.824 | S | S | * | * | trans | -71.3 | 99.2 | 158.6 | -10.5 | 27.4 | 0 | 0 | 0 | 107.8 | ||||
| 113 | S | 38.4 | Very low | 41.1 | Very low | 102 Ų | 102 | 154 Ų | 154 | 71% | 0.713 | 83% | 0.828 | S | S | * | * | trans | -135.4 | 94.5 | 172.5 | -172.6 | 0 | 0 | 0 | 0 | 108.6 | R111 | R111-S113 PolarHBondContact O-N 2.95Å; R111-S113 VanDerWaalsContact O-N 3.11Å | ||
| 114 | V | 44.1 | Very low | 41.2 | Very low | 127 Ų | 127 | 153.6 Ų | 153.6 | 77% | 0.77 | 82% | 0.823 | S | S | * | * | trans | -118.6 | 103.4 | 172.6 | 176.4 | 0 | 0 | 0 | 0 | 106.6 | ||||
| 115 | F | 38.7 | Very low | 40.7 | Very low | 200 Ų | 200 | 152.7 Ų | 152.7 | 88% | 0.877 | 83% | 0.826 | S | S | * | * | trans | 177.1 | 94.7 | 142.6 | -86.1 | -53.4 | 0 | 0 | 0 | 108.1 | ||||
| 116 | K | 38.4 | Very low | 40.6 | Very low | 204 Ų | 204 | 151.5 Ų | 151.5 | 89% | 0.887 | 83% | 0.828 | S | S | * | * | trans | -113.8 | 121.1 | 159.6 | -88.9 | -168.4 | 171.8 | -172.2 | 0 | 107.5 | T118 | K116-T118 PolarHBondContact O-N 3.47Š| ||
| 117 | P | 41.3 | Very low | 40.8 | Very low | 131 Ų | 131 | 149.7 Ų | 149.7 | 85% | 0.851 | 83% | 0.825 | S | S | * | * | trans | -67 | 126.4 | 167 | -17.4 | 31.5 | 0 | 0 | 0 | 109.7 | ||||
| 118 | T | 36.4 | Very low | 40.6 | Very low | 134 Ų | 134 | 147 Ų | 147 | 82% | 0.822 | 82% | 0.818 | S | S | * | * | trans | -72.5 | 135.2 | 170.1 | -47.9 | 0 | 0 | 0 | 0 | 109.1 | K116 G120 | K116-T118 PolarHBondContact O-N 3.47Å; T118-G120 PolarHBondContact O-N 2.9Å | ||
| 119 | A | 45.5 | Very low | 40.6 | Very low | 110 Ų | 110 | 148.7 Ų | 148.7 | 91% | 0.909 | 82% | 0.815 | S | S | * | * | trans | -67.2 | 104 | 171.9 | 0 | 0 | 0 | 0 | 0 | 109.7 | ||||
| 120 | G | 35.1 | Very low | 39.8 | Very low | 70 Ų | 70 | 142.4 Ų | 142.4 | 72% | 0.722 | 81% | 0.809 | S | S | * | * | trans | -130 | 126.8 | -178.8 | 0 | 0 | 0 | 0 | 0 | 111 | T118 G122 | T118-G120 PolarHBondContact O-N 2.9Å; G120-G122 PolarHBondContact O-N 3.5Å | ||
| 121 | N | 41.2 | Very low | 39.5 | Very low | 178 Ų | 178 | 142.7 Ų | 142.7 | 95% | 0.952 | 81% | 0.811 | S | S | * | * | trans | -80.2 | 109.2 | -172.7 | -168.6 | 16.1 | 0 | 0 | 0 | 111.1 | ||||
| 122 | G | 34.8 | Very low | 39 | Very low | 70 Ų | 70 | 136.5 Ų | 136.5 | 72% | 0.722 | 81% | 0.81 | S | S | * | * | trans | -160.3 | 144.3 | -176.8 | 0 | 0 | 0 | 0 | 0 | 113.2 | G120 | G120-G122 PolarHBondContact O-N 3.5Š| ||
| 123 | K | 47.4 | Very low | 38.7 | Very low | 211 Ų | 211 | 135.6 Ų | 135.6 | 92% | 0.917 | 81% | 0.813 | S | S | * | * | trans | -104.3 | 142.3 | -168.7 | -60.5 | 172.4 | -177.8 | 173.9 | 0 | 112.8 | ||||
| 124 | G | 36.9 | Very low | 39 | Very low | 70 Ų | 70 | 139.1 Ų | 139.1 | 72% | 0.722 | 82% | 0.818 | S | S | * | * | trans | 83 | 148.8 | 170.4 | 0 | 0 | 0 | 0 | 0 | 113.9 | ||||
| 125 | F | 36.3 | Very low | 38.5 | Very low | 198 Ų | 198 | 142.8 Ų | 142.8 | 87% | 0.868 | 82% | 0.824 | S | S | * | * | cis | -141.1 | 148 | 0.6 | -92 | -105.9 | 0 | 0 | 0 | 109.4 | ||||
| 126 | L | 37.3 | Very low | 38.2 | Very low | 182 Ų | 182 | 137 Ų | 137 | 95% | 0.953 | 82% | 0.82 | S | S | * | * | trans | -147.7 | 125.2 | 142.1 | -83.2 | -170.4 | 0 | 0 | 0 | 110.7 | ||||
| 127 | S | 39.4 | Very low | 37.9 | Very low | 95 Ų | 95 | 136.7 Ų | 136.7 | 66% | 0.664 | 82% | 0.821 | S | S | * | * | trans | -148.9 | 147.3 | 170.6 | -172 | 0 | 0 | 0 | 0 | 105.4 | ||||
| 128 | M | 37.5 | Very low | 37.8 | Very low | 145 Ų | 145 | 139.4 Ų | 139.4 | 71% | 0.714 | 82% | 0.82 | S | S | * | * | cis | -110.9 | 134.7 | 12 | -67.9 | -81.4 | -74.9 | 0 | 0 | 109.9 | ||||
| 129 | Q | 42.2 | Very low | 37.8 | Very low | 144 Ų | 144 | 139.7 Ų | 139.7 | 67% | 0.673 | 82% | 0.816 | S | S | * | * | 55.3 | 94.6 | 86.5 | -169.7 | 170 | 74.6 | 0 | 0 | 114.7 | L131 | Q129-L131 HydrophobicContact CG-CD2 4.2Š| |||
| 130 | S | 34.1 | Very low | 37.1 | Very low | 115 Ų | 115 | 145.4 Ų | 145.4 | 80% | 0.804 | 81% | 0.814 | S | S | * | * | trans | -79.2 | 146.3 | 154.8 | 177.1 | 0 | 0 | 0 | 0 | 109.7 | ||||
| 131 | L | 36.6 | Very low | 37.4 | Very low | 149 Ų | 149 | 153.4 Ų | 153.4 | 78% | 0.78 | 82% | 0.822 | S | S | * | * | trans | -111.6 | 108.2 | 173.3 | -71 | 177.8 | 0 | 0 | 0 | 110.5 | Q129 | Q129-L131 HydrophobicContact CG-CD2 4.2Š| ||
| 132 | A | 37.7 | Very low | 37 | Very low | 102 Ų | 102 | 150.5 Ų | 150.5 | 84% | 0.843 | 82% | 0.816 | S | S | * | * | trans | -93 | 135.6 | 163.4 | 0 | 0 | 0 | 0 | 0 | 109.8 | ||||
| 133 | A | 33.5 | Very low | 37.2 | Very low | 110 Ų | 110 | 155 Ų | 155 | 91% | 0.909 | 82% | 0.824 | S | S | * | * | trans | -102.8 | 147 | 173.5 | 0 | 0 | 0 | 0 | 0 | 111 | ||||
| 134 | H | 44.8 | Very low | 36.4 | Very low | 176 Ų | 176 | 148.5 Ų | 148.5 | 82% | 0.815 | 82% | 0.816 | S | S | * | * | trans | -119.3 | 141.5 | -155.7 | -161.1 | -65.2 | 0 | 0 | 0 | 113.1 | ||||
| 135 | K | 33.5 | Very low | 36.1 | Very low | 205 Ų | 205 | 150.4 Ų | 150.4 | 89% | 0.891 | 82% | 0.818 | S | S | * | * | trans | 157.9 | 119 | 153.7 | -88.3 | 152.8 | -171.2 | -179.2 | 0 | 107.2 | ||||
| 136 | G | 33.1 | Very low | 36.1 | Very low | 77 Ų | 77 | 147.7 Ų | 147.7 | 79% | 0.794 | 81% | 0.812 | S | S | * | * | 116.3 | 151.3 | 69 | 0 | 0 | 0 | 0 | 0 | 107.1 | |||||
| 137 | Q | 32.1 | Very low | 35.9 | Very low | 198 Ų | 198 | 146.6 Ų | 146.6 | 93% | 0.925 | 80% | 0.802 | S | S | * | * | cis | -149 | 164.6 | 1.8 | -173.1 | 167.1 | -11.9 | 0 | 0 | 108.7 | ||||
| 138 | K | 38.8 | Very low | 35.7 | Very low | 188 Ų | 188 | 147.6 Ų | 147.6 | 82% | 0.817 | 80% | 0.804 | S | S | * | * | trans | -75.7 | 152.8 | -175.3 | -50.9 | 171.7 | -175.4 | 175 | 0 | 112 | ||||
| 139 | L | 35.2 | Very low | 35.6 | Very low | 140 Ų | 140 | 149 Ų | 149 | 73% | 0.733 | 81% | 0.813 | S | S | * | * | -170 | 152 | 117.6 | -123.3 | 53.5 | 0 | 0 | 0 | 116 | |||||
| 140 | W | 31.7 | Very low | 35 | Very low | 231 Ų | 231 | 146.2 Ų | 146.2 | 88% | 0.875 | 82% | 0.815 | S | S | * | * | trans | 61.4 | 148.4 | 162.3 | -60.3 | 125 | 0 | 0 | 0 | 123.1 | ||||
| 141 | R | 40.7 | Very low | 34.9 | Very low | 238 Ų | 238 | 146.9 Ų | 146.9 | 90% | 0.898 | 82% | 0.818 | S | S | * | * | trans | -110.7 | 155.5 | 168.2 | -58.5 | -176.8 | -177.4 | -80.2 | 6.6 | 108.6 | ||||
| 142 | S | 33.6 | Very low | 34.6 | Very low | 116 Ų | 116 | 148.3 Ų | 148.3 | 81% | 0.811 | 82% | 0.821 | S | S | * | * | trans | -147.3 | 149.3 | 152.2 | -172.2 | 0 | 0 | 0 | 0 | 109.6 | ||||
| 143 | N | 38.1 | Very low | 34.8 | Very low | 166 Ų | 166 | 148.8 Ų | 148.8 | 89% | 0.888 | 82% | 0.815 | S | S | * | * | trans | -123.4 | 128.9 | 171.8 | -86.9 | -37.4 | 0 | 0 | 0 | 108.1 | ||||
| 144 | G | 30.9 | Very low | 35.3 | Very low | 73 Ų | 73 | 149.6 Ų | 149.6 | 75% | 0.753 | 81% | 0.811 | S | S | * | * | trans | 154.4 | 119.1 | -177.8 | 0 | 0 | 0 | 0 | 0 | 108.8 | ||||
| 145 | S | 31 | Very low | 34.7 | Very low | 110 Ų | 110 | 148.8 Ų | 148.8 | 77% | 0.769 | 81% | 0.812 | S | S | * | * | cis | 117.8 | 141.8 | 14.2 | -172 | 0 | 0 | 0 | 0 | 110.1 | ||||
| 146 | L | 37.3 | Very low | 34.6 | Very low | 141 Ų | 141 | 144.5 Ų | 144.5 | 74% | 0.738 | 81% | 0.807 | S | S | * | * | trans | 79.2 | 120.8 | 175.7 | -50 | -171.9 | 0 | 0 | 0 | 119.3 | ||||
| 147 | H | 32.9 | Very low | 35.1 | Very low | 159 Ų | 159 | 147 Ų | 147 | 74% | 0.736 | 81% | 0.81 | S | S | * | * | trans | 46.3 | 119.8 | 142.4 | -63.1 | -56.6 | 0 | 0 | 0 | 122 | ||||
| 148 | T | 34.6 | Very low | 35.1 | Very low | 117 Ų | 117 | 141 Ų | 141 | 72% | 0.718 | 80% | 0.801 | S | S | * | * | 75.8 | 92.8 | 64.5 | -52 | 0 | 0 | 0 | 0 | 113.5 | |||||
| 149 | L | 34.9 | Very low | 35.2 | Very low | 174 Ų | 174 | 138.4 Ų | 138.4 | 91% | 0.911 | 80% | 0.803 | S | S | * | * | trans | -134.6 | 147.8 | 142.1 | -78.4 | -178.8 | 0 | 0 | 0 | 108.8 | ||||
| 150 | A | 30.9 | Very low | 35.1 | Very low | 85 Ų | 85 | 143.2 Ų | 143.2 | 70% | 0.702 | 81% | 0.812 | S | S | * | * | trans | -121.6 | 136.2 | 176.9 | 0 | 0 | 0 | 0 | 0 | 109.4 | ||||
| 151 | C | 30.6 | Very low | 35.2 | Very low | 130 Ų | 130 | 136.5 Ų | 136.5 | 88% | 0.878 | 81% | 0.805 | S | S | * | * | trans | -110.8 | 113.1 | 177.8 | -62.3 | 0 | 0 | 0 | 0 | 109.9 | ||||
| 152 | H | 30.8 | Very low | 34.8 | Very low | 179 Ų | 179 | 130.1 Ų | 130.1 | 83% | 0.829 | 80% | 0.797 | S | S | * | * | P | Polyproline II helix | trans | -87.6 | 151.4 | 165.8 | -78.4 | -91 | 0 | 0 | 0 | 110.3 | ||
| 153 | P | 42.6 | Very low | 34.7 | Very low | 111 Ų | 111 | 133.8 Ų | 133.8 | 72% | 0.721 | 80% | 0.801 | S | S | * | * | P | Polyproline II helix | trans | -84.2 | 149.1 | 179.6 | 34 | -35 | 0 | 0 | 0 | 112.6 | ||
| 154 | P | 44.1 | Very low | 34.4 | Very low | 127 Ų | 127 | 130 Ų | 130 | 83% | 0.825 | 79% | 0.793 | S | S | * | * | P | Polyproline II helix | trans | -80.8 | 159.1 | 166.2 | 34.2 | -34 | 0 | 0 | 0 | 112 | ||
| 155 | L | 31.6 | Very low | 34.3 | Very low | 160 Ų | 160 | 138.4 Ų | 138.4 | 84% | 0.838 | 80% | 0.802 | S | S | * | * | trans | -133.5 | 146.3 | 176.2 | -81.5 | 169.5 | 0 | 0 | 0 | 110.8 | ||||
| 156 | S | 32.1 | Very low | 34.3 | Very low | 114 Ų | 114 | 136.4 Ų | 136.4 | 80% | 0.797 | 79% | 0.792 | S | S | * | * | trans | 67.9 | 166.1 | 162 | -55.5 | 0 | 0 | 0 | 0 | 117.4 | ||||
| 157 | P | 43.9 | Very low | 33.9 | Very low | 131 Ų | 131 | 138.7 Ų | 138.7 | 85% | 0.851 | 80% | 0.799 | S | S | * | * | cis | -114.4 | 179.5 | -13.2 | 36.6 | -22.4 | 0 | 0 | 0 | 112.9 | ||||
| 158 | G | 32 | Very low | 33.8 | Very low | 71 Ų | 71 | 138.2 Ų | 138.2 | 73% | 0.732 | 80% | 0.801 | S | S | * | * | trans | -124.5 | 163.2 | 173.1 | 0 | 0 | 0 | 0 | 0 | 113 | ||||
| 159 | P | 40.7 | Very low | 33.6 | Very low | 133 Ų | 133 | 140.3 Ų | 140.3 | 86% | 0.864 | 81% | 0.807 | S | S | * | * | trans | -108.4 | 169.3 | -179.2 | 39.7 | -33.2 | 0 | 0 | 0 | 114.3 | ||||
| 160 | R | 33.1 | Very low | 33.4 | Very low | 242 Ų | 242 | 140.1 Ų | 140.1 | 91% | 0.913 | 80% | 0.802 | S | S | * | * | trans | -146.1 | 147.2 | 167.8 | -126.4 | -174.5 | -176.8 | -164.5 | 0.5 | 111.2 | ||||
| 161 | A | 33.8 | Very low | 33.3 | Very low | 90 Ų | 90 | 140.2 Ų | 140.2 | 74% | 0.744 | 80% | 0.802 | S | S | * | * | trans | 82.6 | 128.8 | 158.6 | 0 | 0 | 0 | 0 | 0 | 121.9 | ||||
| 162 | S | 31.4 | Very low | 33.3 | Very low | 104 Ų | 104 | 141.8 Ų | 141.8 | 73% | 0.727 | 80% | 0.801 | S | S | * | * | trans | 65.4 | 90.9 | 138.7 | 54.5 | 0 | 0 | 0 | 0 | 123.6 | ||||
| 163 | Q | 31.9 | Very low | 33.1 | Very low | 192 Ų | 192 | 139 Ų | 139 | 90% | 0.897 | 80% | 0.801 | S | S | * | * | 65 | 124.1 | 99 | -167 | -179 | 1.2 | 0 | 0 | 122 | |||||
| 164 | A | 30.7 | Very low | 32.7 | Very low | 86 Ų | 86 | 141 Ų | 141 | 71% | 0.711 | 81% | 0.805 | S | S | * | * | trans | 123.5 | 121.5 | 138.3 | 0 | 0 | 0 | 0 | 0 | 119.3 | ||||
| 165 | R | 30.8 | Very low | 32 | Very low | 250 Ų | 250 | 142.2 Ų | 142.2 | 94% | 0.943 | 81% | 0.805 | S | S | * | * | trans | 60.2 | 159.5 | 152.2 | -73.4 | -175 | 152.9 | 140.1 | -6.2 | 119.6 | ||||
| 166 | A | 29.7 | Very low | 32 | Very low | 68 Ų | 68 | 143.2 Ų | 143.2 | 56% | 0.562 | 81% | 0.805 | S | S | * | * | cis | -172.7 | 160.4 | -31.1 | 0 | 0 | 0 | 0 | 0 | 109.9 | ||||
| 167 | Q | 29.5 | Very low | 31.9 | Very low | 190 Ų | 190 | 141.2 Ų | 141.2 | 89% | 0.888 | 80% | 0.803 | S | S | * | * | trans | 65.4 | 133.2 | 167.8 | -64.3 | 152 | -21 | 0 | 0 | 115.5 | ||||
| 168 | L | 30.3 | Very low | 31.4 | Very low | 149 Ų | 149 | 138.7 Ų | 138.7 | 78% | 0.78 | 80% | 0.8 | S | S | * | * | cis | 86.8 | 97.4 | 21.7 | -160.9 | 154.9 | 0 | 0 | 0 | 115.5 | ||||
| 169 | L | 31.4 | Very low | 32.2 | Very low | 161 Ų | 161 | 141 Ų | 141 | 84% | 0.843 | 80% | 0.803 | S | S | * | * | trans | -177.5 | 134.4 | 140.9 | -91.4 | 172.2 | 0 | 0 | 0 | 105.6 | ||||
| 170 | H | 29 | Very low | 32 | Very low | 170 Ų | 170 | 143 Ų | 143 | 79% | 0.787 | 80% | 0.8 | S | S | * | * | cis | 90.4 | 105.6 | 36.7 | -117.2 | -69.7 | 0 | 0 | 0 | 116.1 | ||||
| 171 | A | 29.5 | Very low | 33.1 | Very low | 86 Ų | 86 | 135.9 Ų | 135.9 | 71% | 0.711 | 79% | 0.785 | S | S | * | * | trans | 64.3 | 157 | 164.2 | 0 | 0 | 0 | 0 | 0 | 117.4 | ||||
| 172 | L | 30.6 | Very low | 33 | Very low | 164 Ų | 164 | 138.2 Ų | 138.2 | 86% | 0.859 | 78% | 0.781 | S | S | * | * | cis | -140.6 | 157.2 | 11.5 | -71.9 | 159.5 | 0 | 0 | 0 | 111.6 | ||||
| 173 | S | 26.9 | Very low | 33.6 | Very low | 120 Ų | 120 | 138.8 Ų | 138.8 | 84% | 0.839 | 78% | 0.782 | S | S | * | * | trans | -163.9 | 153.9 | 134 | -160.5 | 0 | 0 | 0 | 0 | 110.3 | ||||
| 174 | L | 33 | Very low | 33.7 | Very low | 152 Ų | 152 | 133.4 Ų | 133.4 | 80% | 0.796 | 77% | 0.766 | S | S | * | * | trans | -118.3 | 148.1 | 177.7 | -81.5 | 122.1 | 0 | 0 | 0 | 112 | ||||
| 175 | D | 30.4 | Very low | 34.2 | Very low | 154 Ų | 154 | 136.9 Ų | 136.9 | 82% | 0.824 | 77% | 0.772 | S | S | * | * | trans | -171.2 | 125.7 | 140 | -106.7 | -0.3 | 0 | 0 | 0 | 104.7 | ||||
| 176 | E | 31.7 | Very low | 34.7 | Very low | 180 Ų | 180 | 129.2 Ų | 129.2 | 84% | 0.841 | 76% | 0.757 | S | S | * | * | 54 | 116.1 | 70 | -75.4 | -69 | 107 | 0 | 0 | 113.6 | |||||
| 177 | G | 28.9 | Very low | 34.9 | Very low | 73 Ų | 73 | 132.4 Ų | 132.4 | 75% | 0.753 | 76% | 0.764 | S | S | * | * | cis | 172.6 | 140.1 | -9.6 | 0 | 0 | 0 | 0 | 0 | 113.7 | ||||
| 178 | G | 33.6 | Very low | 35.4 | Very low | 77 Ų | 77 | 128 Ų | 128 | 79% | 0.794 | 75% | 0.754 | S | S | * | * | trans | 93.3 | -179.3 | 164.8 | 0 | 0 | 0 | 0 | 0 | 118.6 | ||||
| 179 | P | 50.1 | Low | 35.5 | Very low | 120 Ų | 120 | 126 Ų | 126 | 78% | 0.779 | 75% | 0.752 | S | S | * | * | -113.1 | 148.1 | -92 | -0.2 | 22 | 0 | 0 | 0 | 114 | |||||
| 180 | E | 35.8 | Very low | 35.7 | Very low | 174 Ų | 174 | 123.6 Ų | 123.6 | 81% | 0.813 | 75% | 0.75 | S | S | * | * | 62.7 | 149.4 | 79.3 | -68.6 | -78.5 | 92.6 | 0 | 0 | 116 | |||||
| 181 | P | 56.1 | Low | 35.9 | Very low | 93 Ų | 93 | 119.2 Ų | 119.2 | 60% | 0.604 | 75% | 0.75 | S | S | * | * | cis | -144.5 | -165.9 | -31.1 | 40.6 | -21.8 | 0 | 0 | 0 | 114.9 | ||||
| 182 | E | 32 | Very low | 36 | Very low | 140 Ų | 140 | 119.1 Ų | 119.1 | 65% | 0.654 | 76% | 0.758 | S | S | * | * | trans | 70.8 | 160.3 | 162.1 | -76.1 | -55.6 | 100.3 | 0 | 0 | 119.1 | S184 | E182-S184 WeakPolarHBondContact OE2-CB 3.38Å; E182-S184 PolarHBondContact OE2-N 2.88Å; E182-S184 PolarHBondContact OE2-OG 3.26Å | ||
| 183 | P | 44 | Very low | 36.4 | Very low | 116 Ų | 116 | 116.2 Ų | 116.2 | 75% | 0.753 | 75% | 0.751 | S | S | * | * | cis | -126.5 | 151.3 | 10.6 | 39.2 | -23 | 0 | 0 | 0 | 120.2 | ||||
| 184 | S | 33.4 | Very low | 36.7 | Very low | 79 Ų | 79 | 120.3 Ų | 120.3 | 55% | 0.552 | 75% | 0.754 | S | S | * | * | -11.2 | 157.2 | 129.6 | -64.2 | 0 | 0 | 0 | 0 | 118 | E182 | E182-S184 WeakPolarHBondContact OE2-CB 3.38Å; E182-S184 PolarHBondContact OE2-N 2.88Å; E182-S184 PolarHBondContact OE2-OG 3.26Å | |||
| 185 | L | 41.6 | Very low | 36.5 | Very low | 158 Ų | 158 | 116.6 Ų | 116.6 | 83% | 0.827 | 75% | 0.752 | S | S | * | * | cis | -169.7 | 175.5 | -2.7 | -105.3 | 170.1 | 0 | 0 | 0 | 106.2 | ||||
| 186 | S | 41.8 | Very low | 36.6 | Very low | 90 Ų | 90 | 121 Ų | 121 | 63% | 0.629 | 76% | 0.757 | S | S | * | * | cis | -140.6 | -149.7 | -0.7 | -154.8 | 0 | 0 | 0 | 0 | 106.9 | ||||
| 187 | D | 34.2 | Very low | 36.7 | Very low | 135 Ų | 135 | 117.6 Ų | 117.6 | 72% | 0.722 | 75% | 0.754 | S | S | * | * | cis | -156.5 | 173.8 | 0.4 | -142.1 | 47.1 | 0 | 0 | 0 | 106.1 | ||||
| 188 | S | 38.3 | Very low | 37.5 | Very low | 96 Ų | 96 | 120.5 Ų | 120.5 | 67% | 0.671 | 76% | 0.76 | S | S | * | * | cis | -158 | -178 | 7.5 | -148 | 0 | 0 | 0 | 0 | 106.8 | ||||
| 189 | S | 32.4 | Very low | 37.4 | Very low | 107 Ų | 107 | 119.8 Ų | 119.8 | 75% | 0.748 | 75% | 0.752 | S | S | * | * | cis | -154.9 | -172.7 | 5.2 | 65.5 | 0 | 0 | 0 | 0 | 110.7 | ||||
| 190 | S | 36.7 | Very low | 36.6 | Very low | 112 Ų | 112 | 121.3 Ų | 121.3 | 78% | 0.783 | 76% | 0.759 | S | S | * | * | trans | -83.5 | 160.7 | 175.4 | 54.1 | 0 | 0 | 0 | 0 | 114.5 | ||||
| 191 | G | 33.7 | Very low | 36.3 | Very low | 78 Ų | 78 | 116.2 Ų | 116.2 | 80% | 0.804 | 75% | 0.754 | S | S | * | * | cis | 124.6 | 134.3 | 1.9 | 0 | 0 | 0 | 0 | 0 | 113.4 | ||||
| 192 | G | 29.8 | Very low | 35.8 | Very low | 84 Ų | 84 | 118.1 Ų | 118.1 | 87% | 0.866 | 77% | 0.766 | S | S | * | * | trans | 160.1 | 162.3 | 176.5 | 0 | 0 | 0 | 0 | 0 | 115.4 | ||||
| 193 | S | 40.8 | Very low | 35.9 | Very low | 103 Ų | 103 | 114.5 Ų | 114.5 | 72% | 0.72 | 77% | 0.766 | S | S | * | * | trans | -155.8 | 167.7 | -173.8 | -171.6 | 0 | 0 | 0 | 0 | 114.2 | ||||
| 194 | F | 32.8 | Very low | 36.2 | Very low | 205 Ų | 205 | 115.2 Ų | 115.2 | 90% | 0.899 | 77% | 0.771 | S | S | * | * | trans | 122.1 | 131.3 | 150.3 | -67.8 | -64.7 | 0 | 0 | 0 | 120.2 | ||||
| 195 | G | 29 | Very low | 36.1 | Very low | 74 Ų | 74 | 121.3 Ų | 121.3 | 76% | 0.763 | 79% | 0.788 | S | S | * | * | trans | 88.9 | 162.9 | 149.9 | 0 | 0 | 0 | 0 | 0 | 118.6 | ||||
| 196 | R | 31.7 | Very low | 35.6 | Very low | 246 Ų | 246 | 119.6 Ų | 119.6 | 93% | 0.928 | 79% | 0.789 | S | S | * | * | cis | -175.7 | 142.3 | -30.3 | -133.7 | 179.6 | -175.3 | -108.3 | 6.9 | 108.2 | ||||
| 197 | S | 33.5 | Very low | 35.3 | Very low | 109 Ų | 109 | 120.5 Ų | 120.5 | 76% | 0.762 | 80% | 0.795 | S | S | * | * | trans | -94.5 | 152.1 | 168.2 | -49.5 | 0 | 0 | 0 | 0 | 111.1 | ||||
| 198 | P | 46.4 | Very low | 35.3 | Very low | 135 Ų | 135 | 119.6 Ų | 119.6 | 88% | 0.877 | 80% | 0.8 | S | S | * | * | -135.7 | -174.8 | 79 | 37.7 | -21.7 | 0 | 0 | 0 | 112.7 | |||||
| 199 | G | 30.7 | Very low | 35.1 | Very low | 62 Ų | 62 | 123.1 Ų | 123.1 | 64% | 0.639 | 81% | 0.81 | S | S | * | * | cis | 160.8 | -166.9 | -4.8 | 0 | 0 | 0 | 0 | 0 | 112.3 | ||||
| 200 | T | 34 | Very low | 35 | Very low | 152 Ų | 152 | 121.4 Ų | 121.4 | 93% | 0.933 | 81% | 0.809 | S | S | * | * | trans | 71.6 | 135.3 | 177.2 | -45.2 | 0 | 0 | 0 | 0 | 116.4 | ||||
| 201 | G | 30.2 | Very low | 34.9 | Very low | 67 Ų | 67 | 124.8 Ų | 124.8 | 69% | 0.691 | 81% | 0.812 | S | S | * | * | trans | -115.9 | -153.3 | 173.6 | 0 | 0 | 0 | 0 | 0 | 111.9 | ||||
| 202 | P | 44.7 | Very low | 35.1 | Very low | 132 Ų | 132 | 127.9 Ų | 127.9 | 86% | 0.857 | 81% | 0.81 | S | S | * | * | cis | -121.7 | -162.5 | 1.5 | 41.6 | -26 | 0 | 0 | 0 | 113.2 | ||||
| 203 | G | 35 | Very low | 35.7 | Very low | 65 Ų | 65 | 130.4 Ų | 130.4 | 67% | 0.67 | 80% | 0.803 | S | S | * | * | trans | -74.9 | -174.8 | 168.5 | 0 | 0 | 0 | 0 | 0 | 113.8 | ||||
| 204 | P | 50.2 | Low | 35.4 | Very low | 130 Ų | 130 | 132.8 Ų | 132.8 | 84% | 0.844 | 80% | 0.803 | S | S | * | * | -144.8 | -171.4 | 68.2 | 42.1 | -25.3 | 0 | 0 | 0 | 115.8 | |||||
| 205 | F | 31.2 | Very low | 35.8 | Very low | 207 Ų | 207 | 130.3 Ų | 130.3 | 91% | 0.908 | 80% | 0.798 | S | S | * | * | trans | -69.9 | 156 | 170.9 | -50.6 | -97.7 | 0 | 0 | 0 | 113 | ||||
| 206 | S | 31.2 | Very low | 36.1 | Very low | 122 Ų | 122 | 130.6 Ų | 130.6 | 85% | 0.853 | 80% | 0.801 | S | S | * | * | -165 | 162.3 | 127.5 | -159 | 0 | 0 | 0 | 0 | 112.1 | |||||
| 207 | S | 35.6 | Very low | 36.2 | Very low | 109 Ų | 109 | 122.4 Ų | 122.4 | 76% | 0.762 | 79% | 0.793 | S | S | * | * | trans | -109.5 | 157.9 | 173.3 | 54.9 | 0 | 0 | 0 | 0 | 111 | ||||
| 208 | S | 33.1 | Very low | 36 | Very low | 116 Ų | 116 | 122.5 Ų | 122.5 | 81% | 0.811 | 79% | 0.794 | S | S | * | * | trans | -166.4 | 165.5 | 148.3 | -151.7 | 0 | 0 | 0 | 0 | 114.9 | ||||
| 209 | L | 33.8 | Very low | 35.4 | Very low | 171 Ų | 171 | 123.8 Ų | 123.8 | 90% | 0.895 | 79% | 0.793 | S | S | * | * | trans | -68.2 | 169.8 | -172 | -61.8 | 149.8 | 0 | 0 | 0 | 116.8 | ||||
| 210 | G | 30.6 | Very low | 36.3 | Very low | 71 Ų | 71 | 128.3 Ų | 128.3 | 73% | 0.732 | 80% | 0.802 | S | S | * | * | trans | 123.6 | 98.5 | 164.2 | 0 | 0 | 0 | 0 | 0 | 113.4 | ||||
| 211 | H | 35.6 | Very low | 36.3 | Very low | 182 Ų | 182 | 133.1 Ų | 133.1 | 84% | 0.843 | 80% | 0.803 | S | S | * | * | cis | 74.8 | 148.3 | 47.4 | -115.1 | -67.2 | 0 | 0 | 0 | 115.7 | ||||
| 212 | L | 37.3 | Very low | 36.4 | Very low | 144 Ų | 144 | 134.3 Ų | 134.3 | 75% | 0.754 | 81% | 0.806 | S | S | * | * | trans | 78.7 | 142 | -178.7 | -46.1 | 174.9 | 0 | 0 | 0 | 114.1 | ||||
| 213 | N | 42.3 | Very low | 35.7 | Very low | 136 Ų | 136 | 132.8 Ų | 132.8 | 73% | 0.727 | 80% | 0.798 | S | S | * | * | cis | -160.6 | -176.8 | -8.9 | -106.9 | -7.6 | 0 | 0 | 0 | 107.1 | ||||
| 214 | H | 34.9 | Very low | 35.8 | Very low | 154 Ų | 154 | 141.1 Ų | 141.1 | 71% | 0.713 | 81% | 0.81 | S | S | * | * | cis | -159.4 | -170.8 | 14.6 | -162 | -127.6 | 0 | 0 | 0 | 110.9 | ||||
| 215 | L | 40.5 | Very low | 34.9 | Very low | 153 Ų | 153 | 138 Ų | 138 | 80% | 0.801 | 80% | 0.802 | S | S | * | * | trans | 69.4 | 122.5 | 168.1 | -52.3 | 171.6 | 0 | 0 | 0 | 116.9 | ||||
| 216 | G | 36.6 | Very low | 35.5 | Very low | 80 Ų | 80 | 135.1 Ų | 135.1 | 83% | 0.825 | 80% | 0.804 | S | S | * | * | cis | 112.5 | 131.2 | -0.8 | 0 | 0 | 0 | 0 | 0 | 113.2 | ||||
| 217 | G | 32.1 | Very low | 36 | Very low | 74 Ų | 74 | 138.3 Ų | 138.3 | 76% | 0.763 | 80% | 0.802 | S | S | * | * | cis | 170.9 | -168.8 | -3.8 | 0 | 0 | 0 | 0 | 0 | 112.5 | ||||
| 218 | S | 29.8 | Very low | 35.8 | Very low | 110 Ų | 110 | 141.5 Ų | 141.5 | 77% | 0.769 | 81% | 0.805 | S | S | * | * | trans | 72.3 | 116.7 | 166.3 | -163.6 | 0 | 0 | 0 | 0 | 120.5 | ||||
| 219 | L | 34.9 | Very low | 35.8 | Very low | 163 Ų | 163 | 140.8 Ų | 140.8 | 85% | 0.853 | 81% | 0.806 | S | S | * | * | -174.2 | 134.8 | 104.2 | -101.6 | 174.8 | 0 | 0 | 0 | 112.8 | |||||
| 220 | D | 47.9 | Very low | 35.6 | Very low | 156 Ų | 156 | 135.9 Ų | 135.9 | 83% | 0.834 | 80% | 0.797 | S | S | * | * | trans | -96.7 | 146.7 | 177.9 | -71.5 | -75.9 | 0 | 0 | 0 | 113.9 | ||||
| 221 | R | 35.8 | Very low | 36.7 | Very low | 254 Ų | 254 | 138.3 Ų | 138.3 | 96% | 0.958 | 80% | 0.8 | S | S | * | * | trans | -161.7 | 141.8 | 132.3 | -131.3 | 171.7 | -176.4 | 139.2 | 3.8 | 113.7 | ||||
| 222 | A | 30.7 | Very low | 37.1 | Very low | 91 Ų | 91 | 135.9 Ų | 135.9 | 75% | 0.752 | 80% | 0.8 | S | S | * | * | trans | -104 | 165.1 | 177.7 | 0 | 0 | 0 | 0 | 0 | 112.7 | ||||
| 223 | S | 31.2 | Very low | 37 | Very low | 100 Ų | 100 | 133.6 Ų | 133.6 | 70% | 0.699 | 80% | 0.802 | S | S | * | * | 169.2 | 161.3 | 110 | 65.4 | 0 | 0 | 0 | 0 | 114.9 | |||||
| 224 | R | 35.8 | Very low | 36.6 | Very low | 240 Ų | 240 | 133.2 Ų | 133.2 | 91% | 0.906 | 80% | 0.804 | S | S | * | * | trans | 67.6 | 124.8 | 156.6 | -69.1 | 174.7 | 175.7 | -168.6 | -2.7 | 120.1 | ||||
| 225 | G | 32.4 | Very low | 36.6 | Very low | 66 Ų | 66 | 132.9 Ų | 132.9 | 68% | 0.68 | 81% | 0.807 | S | S | * | * | trans | -97.3 | -173.7 | 147.4 | 0 | 0 | 0 | 0 | 0 | 111.4 | ||||
| 226 | P | 44.2 | Very low | 36.3 | Very low | 146 Ų | 146 | 130.5 Ų | 130.5 | 95% | 0.948 | 80% | 0.803 | S | S | * | * | -134.6 | -150.9 | 120.2 | 39.9 | -29.2 | 0 | 0 | 0 | 113.3 | |||||
| 227 | K | 41 | Very low | 36 | Very low | 188 Ų | 188 | 132.3 Ų | 132.3 | 82% | 0.817 | 80% | 0.802 | S | S | * | * | trans | -131.4 | 174.9 | -154.6 | -172.9 | -175.2 | 173.7 | -166.8 | 0 | 111.4 | ||||
| 228 | E | 31.9 | Very low | 36 | Very low | 177 Ų | 177 | 136.9 Ų | 136.9 | 83% | 0.827 | 81% | 0.808 | S | S | * | * | trans | 86.9 | 149.2 | 172.8 | -49.9 | -169.6 | 161.5 | 0 | 0 | 114.9 | ||||
| 229 | A | 31.6 | Very low | 36.6 | Very low | 100 Ų | 100 | 137.2 Ų | 137.2 | 83% | 0.826 | 81% | 0.807 | S | S | * | * | cis | -137.8 | -177.9 | 5.7 | 0 | 0 | 0 | 0 | 0 | 112.9 | ||||
| 230 | G | 31 | Very low | 36.7 | Very low | 68 Ų | 68 | 138 Ų | 138 | 70% | 0.701 | 81% | 0.807 | S | S | * | * | trans | -88.1 | -179 | -177.8 | 0 | 0 | 0 | 0 | 0 | 116.4 | ||||
| 231 | P | 52.9 | Low | 36.7 | Very low | 122 Ų | 122 | 135.8 Ų | 135.8 | 79% | 0.792 | 80% | 0.801 | S | S | * | * | trans | -93.5 | 179.9 | -165.1 | 39.6 | -38.9 | 0 | 0 | 0 | 114.5 | ||||
| 232 | P | 44.2 | Very low | 37.4 | Very low | 131 Ų | 131 | 129.3 Ų | 129.3 | 85% | 0.851 | 79% | 0.792 | S | S | * | * | -128.9 | 164.2 | 104.8 | 38.3 | -33.5 | 0 | 0 | 0 | 113.9 | |||||
| 233 | A | 34.9 | Very low | 38.3 | Very low | 96 Ų | 96 | 130.4 Ų | 130.4 | 79% | 0.793 | 79% | 0.791 | S | S | * | * | trans | -104.1 | 155.1 | -177.9 | 0 | 0 | 0 | 0 | 0 | 112.7 | ||||
| 234 | V | 34.3 | Very low | 39.1 | Very low | 129 Ų | 129 | 131.8 Ų | 131.8 | 78% | 0.782 | 80% | 0.798 | S | S | * | * | trans | -141.4 | 108.4 | 167.1 | -174.4 | 0 | 0 | 0 | 0 | 109.8 | ||||
| 235 | L | 35.4 | Very low | 39.3 | Very low | 146 Ų | 146 | 128.9 Ų | 128.9 | 76% | 0.764 | 79% | 0.788 | S | S | * | * | trans | 52.8 | 119 | 153.2 | -55.9 | 175.7 | 0 | 0 | 0 | 118.7 | ||||
| 236 | S | 33.6 | Very low | 39.8 | Very low | 104 Ų | 104 | 134 Ų | 134 | 73% | 0.727 | 79% | 0.794 | S | S | * | * | 68.3 | 126 | 69.7 | -64.4 | 0 | 0 | 0 | 0 | 112.9 | |||||
| 237 | C | 29.7 | Very low | 39.2 | Very low | 117 Ų | 117 | 135.1 Ų | 135.1 | 79% | 0.791 | 78% | 0.784 | S | S | * | * | cis | -151.5 | 165.9 | 7.7 | -79.4 | 0 | 0 | 0 | 0 | 111.2 | ||||
| 238 | L | 33.6 | Very low | 39.5 | Very low | 170 Ų | 170 | 131.8 Ų | 131.8 | 89% | 0.89 | 79% | 0.785 | S | S | * | * | 177.9 | 160 | 126.6 | -90.1 | 173.9 | 0 | 0 | 0 | 109.1 | |||||
| 239 | P | 41.6 | Very low | 39.4 | Very low | 117 Ų | 117 | 129.2 Ų | 129.2 | 76% | 0.76 | 79% | 0.785 | S | S | * | * | P | Polyproline II helix | trans | -99.2 | 156.7 | -151.1 | -0.8 | 21.8 | 0 | 0 | 0 | 116.6 | ||
| 240 | E | 36.6 | Very low | 39.8 | Very low | 180 Ų | 180 | 130.1 Ų | 130.1 | 84% | 0.841 | 79% | 0.785 | S | S | * | * | P | Polyproline II helix | trans | -77.8 | 138.5 | 165.7 | -177.5 | 175.7 | -170.4 | 0 | 0 | 111 | ||
| 241 | P | 49.2 | Very low | 40.2 | Very low | 110 Ų | 110 | 131.7 Ų | 131.7 | 71% | 0.714 | 79% | 0.786 | S | S | * | * | P | Polyproline II helix | trans | -80 | 136.5 | 177 | 31.6 | -33.5 | 0 | 0 | 0 | 111.9 | ||
| 242 | P | 49.3 | Very low | 39.8 | Very low | 117 Ų | 117 | 130.6 Ų | 130.6 | 76% | 0.76 | 79% | 0.787 | S | S | * | * | P | Polyproline II helix | trans | -73.2 | 156.1 | 179 | 30.7 | -35.5 | 0 | 0 | 0 | 112.8 | ||
| 243 | P | 49.9 | Very low | 40 | Very low | 114 Ų | 114 | 133 Ų | 133 | 74% | 0.74 | 79% | 0.786 | S | S | * | * | P | Polyproline II helix | trans | -68.9 | 156.9 | 176.1 | 30 | -35.8 | 0 | 0 | 0 | 112.5 | ||
| 244 | P | 47.6 | Very low | 40.7 | Very low | 130 Ų | 130 | 138 Ų | 138 | 84% | 0.844 | 79% | 0.793 | S | S | * | * | P | Polyproline II helix | trans | -67.7 | 135.3 | 178.5 | 28.8 | -34.7 | 0 | 0 | 0 | 111.7 | ||
| 245 | Y | 41.6 | Very low | 41.3 | Very low | 179 Ų | 179 | 139.8 Ų | 139.8 | 70% | 0.702 | 80% | 0.795 | S | S | * | * | P | Polyproline II helix | trans | -88.3 | 135.7 | 178.8 | 176.9 | -87.8 | 0 | 0 | 0 | 111.3 | F247 | Y245-F247 AromaticContact CD1-CD2 3.49Å; Y245-F247 HydrophobicContact CD1-CD2 3.49Å; Y245-F247 VanDerWaalsContact CD1-CD2 3.49Å; Y245-F247 AromaticContact CD1-CE2 3.48Å; Y245-F247 HydrophobicContact CD1-CE2 3.48Å; Y245-F247 VanDerWaalsContact CD1-CE2 3.48Å; Y245-F247 HydrophobicContact CD1-CG 4.03Å; Y245-F247 HydrophobicContact CD1-CZ 4.02Å; Y245-F247 AromaticContact CE1-CD1 3.9Å; Y245-F247 HydrophobicContact CE1-CD1 3.9Å; Y245-F247 AromaticContact CE1-CD2 3.69Å; Y245-F247 HydrophobicContact CE1-CD2 3.69Å; Y245-F247 AromaticContact CE1-CE1 3.78Å; Y245-F247 HydrophobicContact CE1-CE1 3.78Å; Y245-F247 AromaticContact CE1-CE2 3.57Å; Y245-F247 HydrophobicContact CE1-CE2 3.57Å; Y245-F247 AromaticContact CE1-CG 3.85Å; Y245-F247 HydrophobicContact CE1-CG 3.85Å; Y245-F247 AromaticContact CE1-CZ 3.61Å; Y245-F247 HydrophobicContact CE1-CZ 3.61Å; Y245-F247 PolarHBondContact O-N 2.91Å |
| 246 | E | 41.2 | Very low | 41.8 | Very low | 173 Ų | 173 | 136.5 Ų | 136.5 | 81% | 0.808 | 80% | 0.797 | S | S | * | * | trans | -79.4 | 114.4 | 176.3 | -63.7 | -176.3 | 163.7 | 0 | 0 | 111.3 | ||||
| 247 | F | 32.1 | Very low | 42.8 | Very low | 169 Ų | 169 | 135.9 Ų | 135.9 | 74% | 0.741 | 80% | 0.798 | S | S | * | * | trans | -97.6 | 108.3 | 168.5 | -93.6 | -71.8 | 0 | 0 | 0 | 111.1 | Y245 | Y245-F247 AromaticContact CD1-CD2 3.49Å; Y245-F247 HydrophobicContact CD1-CD2 3.49Å; Y245-F247 VanDerWaalsContact CD1-CD2 3.49Å; Y245-F247 AromaticContact CD1-CE2 3.48Å; Y245-F247 HydrophobicContact CD1-CE2 3.48Å; Y245-F247 VanDerWaalsContact CD1-CE2 3.48Å; Y245-F247 HydrophobicContact CD1-CG 4.03Å; Y245-F247 HydrophobicContact CD1-CZ 4.02Å; Y245-F247 AromaticContact CE1-CD1 3.9Å; Y245-F247 HydrophobicContact CE1-CD1 3.9Å; Y245-F247 AromaticContact CE1-CD2 3.69Å; Y245-F247 HydrophobicContact CE1-CD2 3.69Å; Y245-F247 AromaticContact CE1-CE1 3.78Å; Y245-F247 HydrophobicContact CE1-CE1 3.78Å; Y245-F247 AromaticContact CE1-CE2 3.57Å; Y245-F247 HydrophobicContact CE1-CE2 3.57Å; Y245-F247 AromaticContact CE1-CG 3.85Å; Y245-F247 HydrophobicContact CE1-CG 3.85Å; Y245-F247 AromaticContact CE1-CZ 3.61Å; Y245-F247 HydrophobicContact CE1-CZ 3.61Å; Y245-F247 PolarHBondContact O-N 2.91Å | ||
| 248 | S | 46.6 | Very low | 44 | Very low | 119 Ų | 119 | 136.6 Ų | 136.6 | 83% | 0.832 | 80% | 0.799 | S | S | * | * | trans | -76.8 | 125.3 | 161 | -66.9 | 0 | 0 | 0 | 0 | 109.6 | ||||
| 249 | C | 31.5 | Very low | 44.8 | Very low | 122 Ų | 122 | 135 Ų | 135 | 82% | 0.824 | 79% | 0.791 | S | S | * | * | trans | -117.8 | 144.9 | 174.4 | -76.2 | 0 | 0 | 0 | 0 | 111.1 | ||||
| 250 | S | 39.7 | Very low | 45.5 | Very low | 119 Ų | 119 | 134.1 Ų | 134.1 | 83% | 0.832 | 78% | 0.784 | S | S | * | * | trans | -102.3 | 134.6 | -169.6 | 176.2 | 0 | 0 | 0 | 0 | 112.8 | ||||
| 251 | S | 38 | Very low | 46.1 | Very low | 102 Ų | 102 | 133.6 Ų | 133.6 | 71% | 0.713 | 78% | 0.782 | S | S | * | * | trans | 53.6 | 148.1 | 166.6 | -156.1 | 0 | 0 | 0 | 0 | 118.6 | ||||
| 252 | A | 45 | Very low | 46.4 | Very low | 98 Ų | 98 | 131.3 Ų | 131.3 | 81% | 0.81 | 77% | 0.773 | S | S | * | * | trans | -130 | 14.4 | -166.5 | 0 | 0 | 0 | 0 | 0 | 115.1 | ||||
| 253 | E | 48.9 | Very low | 46.4 | Very low | 181 Ų | 181 | 128.8 Ų | 128.8 | 85% | 0.846 | 76% | 0.757 | S | S | * | * | trans | -96 | -10.7 | -164.6 | -62.9 | -170.4 | 120 | 0 | 0 | 116 | ||||
| 254 | E | 49.2 | Very low | 46.7 | Very low | 201 Ų | 201 | 128.2 Ų | 128.2 | 94% | 0.939 | 74% | 0.744 | S | S | * | * | S | Bend | trans | -105.6 | 16.4 | -164.7 | -130.7 | 174 | -163.4 | 0 | 0 | 116.4 | ||
| 255 | M | 48 | Very low | 47 | Very low | 167 Ų | 167 | 128 Ų | 128 | 82% | 0.823 | 73% | 0.732 | S | S | * | * | trans | -114 | 16.9 | -175.4 | -121.4 | -68.8 | 176.6 | 0 | 0 | 115.2 | ||||
| 256 | G | 45.5 | Very low | 47.6 | Very low | 77 Ų | 77 | 125.8 Ų | 125.8 | 79% | 0.794 | 73% | 0.731 | S | S | * | * | trans | -82.2 | -10.6 | -168 | 0 | 0 | 0 | 0 | 0 | 118.1 | ||||
| 257 | A | 55.1 | Low | 48.1 | Very low | 92 Ų | 92 | 122.9 Ų | 122.9 | 76% | 0.76 | 72% | 0.716 | S | S | * | * | S | Bend | trans | -105.5 | -11.1 | -154 | 0 | 0 | 0 | 0 | 0 | 118 | ||
| 258 | V | 54.2 | Low | 49.3 | Very low | 132 Ų | 132 | 123 Ų | 123 | 80% | 0.8 | 71% | 0.712 | S | S | * | * | S | Bend | trans | -121 | 8.7 | -164 | -161.8 | 0 | 0 | 0 | 0 | 113.9 | ||
| 259 | L | 50.3 | Low | 49.4 | Very low | 137 Ų | 137 | 120.5 Ų | 120.5 | 72% | 0.717 | 71% | 0.705 | S | S | * | * | trans | -85 | -18.4 | -173.2 | -129 | 73 | 0 | 0 | 0 | 119.4 | ||||
| 260 | P | 55.1 | Low | 50.4 | Low | 97 Ų | 97 | 122.2 Ų | 122.2 | 63% | 0.63 | 71% | 0.705 | S | S | * | * | H | α-helix | trans | -62 | -51.7 | -170.3 | -28.1 | 35.9 | 0 | 0 | 0 | 116.7 | C263 | P260-C263 PolarHBondContact O-N 3.43Å |
| 261 | E | 50 | Low | 50.8 | Low | 170 Ų | 170 | 119.7 Ų | 119.7 | 79% | 0.794 | 70% | 0.698 | S | S | * | * | H | α-helix | trans | -71.4 | -37.5 | -166.8 | -69.2 | -173.8 | 116.5 | 0 | 0 | 113.5 | C263 E264 | E261-C263 PolarHBondContact O-N 3.14Å; E261-E264 PolarHBondContact O-N 3.42Å; E261-E264 VanDerWaalsContact O-N 3.1Å |
| 262 | A | 55.9 | Low | 51.3 | Low | 62 Ų | 62 | 120 Ų | 120 | 51% | 0.512 | 70% | 0.7 | S | S | . | * | H | α-helix | trans | -60.1 | -22.2 | 180 | 0 | 0 | 0 | 0 | 0 | 113.4 | ||
| 263 | C | 48.5 | Very low | 52.2 | Low | 64 Ų | 64 | 123.6 Ų | 123.6 | 43% | 0.432 | 70% | 0.7 | S | S | . | * | H | α-helix | trans | -74.8 | -30.1 | 178.9 | -158.1 | 0 | 0 | 0 | 0 | 113.1 | P260 E261 K267 | P260-C263 PolarHBondContact O-N 3.43Å; E261-C263 PolarHBondContact O-N 3.14Å; C263-K267 WeakPolarHBondContact O-CG 3.47Å; C263-K267 PolarHBondContact O-N 3.29Å |
| 264 | E | 56.7 | Low | 52.6 | Low | 102 Ų | 102 | 123 Ų | 123 | 48% | 0.477 | 70% | 0.703 | S | S | . | * | H | α-helix | trans | -85 | -15.4 | -179.9 | -62.5 | -54 | 137.2 | 0 | 0 | 113.4 | E261 K267 R268 | E261-E264 PolarHBondContact O-N 3.42Å; E261-E264 VanDerWaalsContact O-N 3.1Å; E264-K267 IonicContact OE1-NZ 3.74Å; E264-K267 PolarHBondContact OE1-NZ 2.7Å; E264-K267 WeakPolarHBondContact OE2-CD 3.46Å; E264-K267 IonicContact OE2-NZ 3.82Å; E264-R268 PolarHBondContact O-NE 3.02Å; E264-R268 VanDerWaalsContact O-NE 3.08Å |
| 265 | E | 54.7 | Low | 53 | Low | 126 Ų | 126 | 116.7 Ų | 116.7 | 59% | 0.589 | 69% | 0.692 | S | S | * | * | H | α-helix | trans | -74.9 | -47.3 | 169.9 | -55.2 | -120.5 | 105.2 | 0 | 0 | 110.4 | K267 R268 G269 | E265-K267 VanDerWaalsContact C-N 3.28Å; E265-K267 PolarHBondContact O-N 3.46Å; E265-R268 PolarHBondContact O-N 2.9Å; E265-R268 VanDerWaalsContact O-N 3.14Å; E265-R268 IonicContact OE1-CZ 3.96Å; E265-R268 IonicContact OE1-NH2 2.84Å; E265-R268 PolarHBondContact OE1-NH2 3.48Å; E265-G269 PolarHBondContact O-N 3.29Å |
| 266 | L | 53.4 | Low | 53.9 | Low | 131 Ų | 131 | 113.1 Ų | 113.1 | 69% | 0.686 | 68% | 0.683 | S | S | * | * | H | α-helix | trans | -60.4 | -33.7 | 177.7 | -73.9 | 167.7 | 0 | 0 | 0 | 113.1 | G269 | L266-G269 PolarHBondContact O-N 3.08Å |
| 267 | K | 52.6 | Low | 55.5 | Low | 113 Ų | 113 | 113.9 Ų | 113.9 | 49% | 0.491 | 67% | 0.669 | S | S | . | * | H | α-helix | trans | -67.2 | -38.8 | 175.4 | -72.1 | 168.7 | -171.5 | 174.6 | 0 | 112.7 | C263 E264 E265 G269 L270 | C263-K267 WeakPolarHBondContact O-CG 3.47Å; C263-K267 PolarHBondContact O-N 3.29Å; E264-K267 IonicContact OE1-NZ 3.74Å; E264-K267 PolarHBondContact OE1-NZ 2.7Å; E264-K267 WeakPolarHBondContact OE2-CD 3.46Å; E264-K267 IonicContact OE2-NZ 3.82Å; E265-K267 VanDerWaalsContact C-N 3.28Å; E265-K267 PolarHBondContact O-N 3.46Å; K267-G269 VanDerWaalsContact C-N 3.3Å; K267-G269 PolarHBondContact O-N 3.38Å; K267-L270 PolarHBondContact O-N 2.92Å |
| 268 | R | 55.4 | Low | 56.8 | Low | 170 Ų | 170 | 114 Ų | 114 | 64% | 0.642 | 66% | 0.662 | S | S | * | * | H | α-helix | trans | -67.1 | -31.4 | 177.2 | -75.3 | 178 | -76 | 151.3 | 3.3 | 112.2 | E264 E265 L270 G271 | E264-R268 PolarHBondContact O-NE 3.02Å; E264-R268 VanDerWaalsContact O-NE 3.08Å; E265-R268 PolarHBondContact O-N 2.9Å; E265-R268 VanDerWaalsContact O-N 3.14Å; E265-R268 IonicContact OE1-CZ 3.96Å; E265-R268 IonicContact OE1-NH2 2.84Å; E265-R268 PolarHBondContact OE1-NH2 3.48Å; R268-L270 PolarHBondContact O-N 3.43Å; R268-G271 PolarHBondContact O-N 2.94Å |
| 269 | G | 49.7 | Very low | 58.1 | Low | 67 Ų | 67 | 114.7 Ų | 114.7 | 69% | 0.691 | 66% | 0.655 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -66.2 | -16.1 | 174.1 | 0 | 0 | 0 | 0 | 0 | 115.6 | E265 L266 K267 | E265-G269 PolarHBondContact O-N 3.29Å; L266-G269 PolarHBondContact O-N 3.08Å; K267-G269 VanDerWaalsContact C-N 3.3Å; K267-G269 PolarHBondContact O-N 3.38Å |
| 270 | L | 51.8 | Low | 59.9 | Low | 158 Ų | 158 | 110.9 Ų | 110.9 | 83% | 0.827 | 64% | 0.637 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -100.2 | 3.5 | 177.9 | -69.3 | 166.7 | 0 | 0 | 0 | 113.3 | K267 R268 | K267-L270 PolarHBondContact O-N 2.92Å; R268-L270 PolarHBondContact O-N 3.43Å |
| 271 | G | 49.2 | Very low | 61.6 | Low | 67 Ų | 67 | 110.7 Ų | 110.7 | 69% | 0.691 | 63% | 0.628 | S | S | * | * | trans | -98.8 | 16.5 | -171.3 | 0 | 0 | 0 | 0 | 0 | 116.5 | R268 | R268-G271 PolarHBondContact O-N 2.94Š| ||
| 272 | S | 48.2 | Very low | 63.6 | Low | 108 Ų | 108 | 107 Ų | 107 | 76% | 0.755 | 62% | 0.617 | S | S | * | * | trans | -102.6 | 129.3 | 175.4 | -173 | 0 | 0 | 0 | 0 | 111.1 | ||||
| 273 | E | 64.2 | Low | 65.3 | Low | 174 Ų | 174 | 108.5 Ų | 108.5 | 81% | 0.813 | 62% | 0.616 | S | S | * | * | S | Bend | trans | -70.8 | 177.3 | 172.1 | -65.4 | -169 | 108.4 | 0 | 0 | 112.4 | G275 | E273-G275 PolarHBondContact O-N 3.35Š|
| 274 | D | 55.9 | Low | 67.5 | Low | 168 Ų | 168 | 110.6 Ų | 110.6 | 90% | 0.898 | 62% | 0.619 | S | S | * | * | S | Bend | trans | 61.1 | -9.7 | 179.8 | -65.6 | -19.4 | 0 | 0 | 0 | 117.9 | S276 | D274-S276 VanDerWaalsContact C-N 3.3Å; D274-S276 PolarHBondContact O-N 3.03Å |
| 275 | G | 58.1 | Low | 69.2 | Low | 68 Ų | 68 | 109.2 Ų | 109.2 | 70% | 0.701 | 61% | 0.613 | S | S | * | * | trans | -74 | 68.2 | 170.4 | 0 | 0 | 0 | 0 | 0 | 114.2 | E273 N277 | E273-G275 PolarHBondContact O-N 3.35Å; G275-N277 PolarHBondContact O-N 3.16Å; G275-N277 VanDerWaalsContact O-N 3.15Å | ||
| 276 | S | 68.2 | Low | 71.1 | Confident | 92 Ų | 92 | 112 Ų | 112 | 64% | 0.643 | 62% | 0.618 | S | S | * | * | trans | -51.4 | 121 | 168.5 | -73.6 | 0 | 0 | 0 | 0 | 110.1 | D274 | D274-S276 VanDerWaalsContact C-N 3.3Å; D274-S276 PolarHBondContact O-N 3.03Å | ||
| 277 | N | 78.7 | Confident | 73 | Confident | 93 Ų | 93 | 111.9 Ų | 111.9 | 50% | 0.497 | 61% | 0.614 | S | S | . | * | trans | -53.4 | 125.5 | -171.9 | -177.2 | -34 | 0 | 0 | 0 | 110.3 | G275 F279 T280 Q281 | G275-N277 PolarHBondContact O-N 3.16Å; G275-N277 VanDerWaalsContact O-N 3.15Å; N277-F279 PolarHBondContact O-N 2.98Å; N277-F279 WeakPolarHBondContact OD1-CB 3.28Å; N277-F279 PolarHBondContact OD1-N 2.85Å; N277-F279 VanDerWaalsContact OD1-N 3.11Å; N277-T280 HydrophobicContact CB-CG2 4.42Å; N277-T280 PolarHBondContact O-N 2.92Å; N277-T280 PolarHBondContact O-OG1 3.18Å; N277-Q281 PolarHBondContact O-N 3.41Å; N277-Q281 VanDerWaalsContact O-N 3.11Å | ||
| 278 | P | 82.8 | Confident | 75.1 | Confident | 96 Ų | 96 | 113.7 Ų | 113.7 | 62% | 0.623 | 62% | 0.618 | S | S | * | * | H | α-helix | trans | -58.3 | -26.7 | -172.4 | 20.9 | -33.3 | 0 | 0 | 0 | 113 | V282 | P278-V282 WeakPolarHBondContact O-CG2 3.44Å; P278-V282 PolarHBondContact O-N 3.33Å; P278-V282 VanDerWaalsContact O-N 3.15Å |
| 279 | F | 81.6 | Confident | 77.1 | Confident | 145 Ų | 145 | 111.1 Ų | 111.1 | 64% | 0.636 | 62% | 0.616 | S | S | * | * | H | α-helix | trans | -67.6 | -39.5 | 173.2 | -176.1 | -106.1 | 0 | 0 | 0 | 113.1 | N277 L283 | N277-F279 PolarHBondContact O-N 2.98Å; N277-F279 WeakPolarHBondContact OD1-CB 3.28Å; N277-F279 PolarHBondContact OD1-N 2.85Å; N277-F279 VanDerWaalsContact OD1-N 3.11Å; F279-L283 HydrophobicContact CD1-CD1 3.97Å; F279-L283 HydrophobicContact CE1-CD1 3.55Å; F279-L283 HydrophobicContact CE1-CG 4.5Å; F279-L283 HydrophobicContact CZ-CD1 3.92Å; F279-L283 WeakPolarHBondContact O-CG 3.13Å; F279-L283 PolarHBondContact O-N 3.45Å |
| 280 | T | 86.6 | Confident | 79.3 | Confident | 58 Ų | 58 | 115.9 Ų | 115.9 | 36% | 0.356 | 61% | 0.613 | S | S | . | * | H | α-helix | trans | -72.6 | -37.8 | 176.8 | 58.3 | 0 | 0 | 0 | 0 | 111.2 | N277 V282 L283 E284 | N277-T280 HydrophobicContact CB-CG2 4.42Å; N277-T280 PolarHBondContact O-N 2.92Å; N277-T280 PolarHBondContact O-OG1 3.18Å; T280-V282 PolarHBondContact O-N 3.31Å; T280-L283 PolarHBondContact O-N 2.97Å; T280-E284 WeakPolarHBondContact O-CG 3.29Å; T280-E284 PolarHBondContact O-N 3Å |
| 281 | Q | 90.6 | Very high | 81.4 | Confident | 92 Ų | 92 | 111.7 Ų | 111.7 | 43% | 0.43 | 59% | 0.591 | S | S | . | * | H | α-helix | trans | -57.1 | -49.5 | 174.1 | -178.7 | 178.1 | -10.3 | 0 | 0 | 111.9 | N277 L283 E284 E285 | N277-Q281 PolarHBondContact O-N 3.41Å; N277-Q281 VanDerWaalsContact O-N 3.11Å; Q281-L283 VanDerWaalsContact C-N 3.29Å; Q281-L283 PolarHBondContact O-N 3.03Å; Q281-E284 PolarHBondContact O-N 3.32Å; Q281-E285 HydrophobicContact CG-CG 4.4Å; Q281-E285 WeakPolarHBondContact CG-OE1 3.34Å; Q281-E285 PolarHBondContact NE2-OE1 3Å; Q281-E285 WeakPolarHBondContact O-CB 3.49Å; Q281-E285 WeakPolarHBondContact O-CG 3.48Å; Q281-E285 PolarHBondContact O-N 3.05Å |
| 282 | V | 93.3 | Very high | 83.7 | Confident | 92 Ų | 92 | 111.1 Ų | 111.1 | 56% | 0.558 | 58% | 0.58 | S | S | * | * | H | α-helix | trans | -61.8 | -36.2 | 178.8 | 170.7 | 0 | 0 | 0 | 0 | 111.9 | P278 T280 R286 | P278-V282 WeakPolarHBondContact O-CG2 3.44Å; P278-V282 PolarHBondContact O-N 3.33Å; P278-V282 VanDerWaalsContact O-N 3.15Å; T280-V282 PolarHBondContact O-N 3.31Å; V282-R286 VanDerWaalsContact O-CB 3.23Å; V282-R286 WeakPolarHBondContact O-CB 3.27Å; V282-R286 PolarHBondContact O-N 3.33Å |
| 283 | L | 91.5 | Very high | 86.1 | Confident | 94 Ų | 94 | 109.9 Ų | 109.9 | 49% | 0.492 | 56% | 0.562 | S | S | . | * | H | α-helix | trans | -68 | -41.6 | 175.1 | -72.2 | 174.1 | 0 | 0 | 0 | 112.6 | F279 T280 Q281 R286 Q287 | F279-L283 HydrophobicContact CD1-CD1 3.97Å; F279-L283 HydrophobicContact CE1-CD1 3.55Å; F279-L283 HydrophobicContact CE1-CG 4.5Å; F279-L283 HydrophobicContact CZ-CD1 3.92Å; F279-L283 WeakPolarHBondContact O-CG 3.13Å; F279-L283 PolarHBondContact O-N 3.45Å; T280-L283 PolarHBondContact O-N 2.97Å; Q281-L283 VanDerWaalsContact C-N 3.29Å; Q281-L283 PolarHBondContact O-N 3.03Å; L283-R286 PolarHBondContact O-N 2.71Å; L283-Q287 WeakPolarHBondContact O-CB 3.43Å; L283-Q287 PolarHBondContact O-N 3.44Å |
| 284 | E | 93.4 | Very high | 87.6 | Confident | 109 Ų | 109 | 105.8 Ų | 105.8 | 51% | 0.509 | 55% | 0.545 | S | S | . | . | H | α-helix | trans | -66.4 | -41.9 | 176.1 | -74.4 | 176.6 | -153.8 | 0 | 0 | 112.2 | T280 Q281 Q287 R288 | T280-E284 WeakPolarHBondContact O-CG 3.29Å; T280-E284 PolarHBondContact O-N 3Å; Q281-E284 PolarHBondContact O-N 3.32Å; E284-Q287 PolarHBondContact O-N 3.32Å; E284-R288 WeakPolarHBondContact O-CB 3.47Å; E284-R288 PolarHBondContact O-N 2.92Å |
| 285 | E | 92.6 | Very high | 89.6 | Confident | 73 Ų | 73 | 104.8 Ų | 104.8 | 34% | 0.341 | 53% | 0.533 | S | S | . | . | H | α-helix | trans | -63.6 | -42.7 | 173.8 | -72.9 | 175.2 | -175.3 | 0 | 0 | 111.2 | Q281 Q287 R288 L289 | Q281-E285 HydrophobicContact CG-CG 4.4Å; Q281-E285 WeakPolarHBondContact CG-OE1 3.34Å; Q281-E285 PolarHBondContact NE2-OE1 3Å; Q281-E285 WeakPolarHBondContact O-CB 3.49Å; Q281-E285 WeakPolarHBondContact O-CG 3.48Å; Q281-E285 PolarHBondContact O-N 3.05Å; E285-Q287 PolarHBondContact O-N 2.86Å; E285-R288 WeakPolarHBondContact O-CB 3.46Å; E285-R288 PolarHBondContact O-N 3.18Å; E285-L289 WeakPolarHBondContact O-CB 3.31Å; E285-L289 WeakPolarHBondContact O-CG 3.24Å; E285-L289 PolarHBondContact O-N 2.91Å |
| 286 | R | 94.3 | Very high | 91.6 | Very high | 185 Ų | 185 | 107 Ų | 107 | 70% | 0.698 | 52% | 0.52 | S | S | * | . | H | α-helix | trans | -63.2 | -40.9 | 175.1 | -172.3 | 60.3 | 171.1 | -172 | -1.3 | 112.2 | V282 L283 W290 | V282-R286 VanDerWaalsContact O-CB 3.23Å; V282-R286 WeakPolarHBondContact O-CB 3.27Å; V282-R286 PolarHBondContact O-N 3.33Å; L283-R286 PolarHBondContact O-N 2.71Å; R286-W290 WeakPolarHBondContact O-CB 3.48Å; R286-W290 PolarHBondContact O-N 3.28Å |
| 287 | Q | 93.6 | Very high | 93 | Very high | 127 Ų | 127 | 106.5 Ų | 106.5 | 59% | 0.593 | 51% | 0.51 | S | S | * | . | H | α-helix | trans | -65.3 | -43.1 | 174.5 | -173.6 | -173.4 | 92.1 | 0 | 0 | 111.4 | L283 E284 E285 W290 L291 | L283-Q287 WeakPolarHBondContact O-CB 3.43Å; L283-Q287 PolarHBondContact O-N 3.44Å; E284-Q287 PolarHBondContact O-N 3.32Å; E285-Q287 PolarHBondContact O-N 2.86Å; Q287-W290 PolarHBondContact O-N 2.91Å; Q287-L291 HydrophobicContact CG-CD1 4.08Å; Q287-L291 HydrophobicContact CG-CG 4.49Å; Q287-L291 WeakPolarHBondContact O-CB 3.5Å; Q287-L291 WeakPolarHBondContact O-CG 3.29Å; Q287-L291 PolarHBondContact O-N 2.84Å |
| 288 | R | 97.3 | Very high | 93.9 | Very high | 152 Ų | 152 | 109.4 Ų | 109.4 | 57% | 0.574 | 52% | 0.515 | S | S | * | . | H | α-helix | trans | -60.5 | -45.7 | 178.2 | -168.5 | -172.3 | -50.5 | 176.4 | 6.5 | 111.6 | E284 E285 L291 A292 | E284-R288 WeakPolarHBondContact O-CB 3.47Å; E284-R288 PolarHBondContact O-N 2.92Å; E285-R288 WeakPolarHBondContact O-CB 3.46Å; E285-R288 PolarHBondContact O-N 3.18Å; R288-L291 PolarHBondContact O-N 3.11Å; R288-A292 WeakPolarHBondContact O-CB 3.37Å; R288-A292 PolarHBondContact O-N 2.76Å |
| 289 | L | 96.8 | Very high | 94.6 | Very high | 116 Ų | 116 | 108.2 Ų | 108.2 | 61% | 0.607 | 51% | 0.506 | S | S | * | . | H | α-helix | trans | -64.6 | -43.5 | 174.8 | -70.8 | 171.5 | 0 | 0 | 0 | 112 | E285 L291 A292 E293 | E285-L289 WeakPolarHBondContact O-CB 3.31Å; E285-L289 WeakPolarHBondContact O-CG 3.24Å; E285-L289 PolarHBondContact O-N 2.91Å; L289-L291 PolarHBondContact O-N 2.97Å; L289-A292 PolarHBondContact O-N 2.94Å; L289-E293 PolarHBondContact O-N 2.85Å |
| 290 | W | 95.8 | Very high | 95.4 | Very high | 167 Ų | 167 | 106 Ų | 106 | 63% | 0.633 | 50% | 0.497 | S | S | * | . | H | α-helix | trans | -62.8 | -41.6 | 176.9 | -174.9 | 83.6 | 0 | 0 | 0 | 112.4 | R286 Q287 E293 L294 | R286-W290 WeakPolarHBondContact O-CB 3.48Å; R286-W290 PolarHBondContact O-N 3.28Å; Q287-W290 PolarHBondContact O-N 2.91Å; W290-E293 PolarHBondContact O-N 2.9Å; W290-L294 HydrophobicContact CH2-CD2 3.79Å; W290-L294 HydrophobicContact CZ2-CD2 4.4Å; W290-L294 HydrophobicContact CZ3-CD2 3.89Å; W290-L294 VanDerWaalsContact O-CB 3.31Å; W290-L294 WeakPolarHBondContact O-CB 3.36Å; W290-L294 PolarHBondContact O-N 2.67Å |
| 291 | L | 97.8 | Very high | 96 | Very high | 69 Ų | 69 | 110.5 Ų | 110.5 | 36% | 0.361 | 51% | 0.508 | S | S | . | . | H | α-helix | trans | -68.3 | -32 | 174.7 | -71.5 | 172.7 | 0 | 0 | 0 | 112.8 | Q287 R288 L289 K295 | Q287-L291 HydrophobicContact CG-CD1 4.08Å; Q287-L291 HydrophobicContact CG-CG 4.49Å; Q287-L291 WeakPolarHBondContact O-CB 3.5Å; Q287-L291 WeakPolarHBondContact O-CG 3.29Å; Q287-L291 PolarHBondContact O-N 2.84Å; R288-L291 PolarHBondContact O-N 3.11Å; L289-L291 PolarHBondContact O-N 2.97Å; L291-K295 WeakPolarHBondContact O-CB 3.4Å; L291-K295 WeakPolarHBondContact O-CD 3.17Å; L291-K295 WeakPolarHBondContact O-CG 3.48Å; L291-K295 PolarHBondContact O-N 2.92Å; L291-K295 VanDerWaalsContact O-N 3.16Å |
| 292 | A | 96.8 | Very high | 96.4 | Very high | 55 Ų | 55 | 109.8 Ų | 109.8 | 46% | 0.455 | 51% | 0.507 | S | S | . | . | H | α-helix | trans | -68.4 | -46.5 | 173.9 | 0 | 0 | 0 | 0 | 0 | 111.3 | R288 L289 K295 R296 | R288-A292 WeakPolarHBondContact O-CB 3.37Å; R288-A292 PolarHBondContact O-N 2.76Å; L289-A292 PolarHBondContact O-N 2.94Å; A292-K295 WeakPolarHBondContact O-CB 3.48Å; A292-K295 PolarHBondContact O-N 3.38Å; A292-R296 PolarHBondContact O-N 3.24Å |
| 293 | E | 97.5 | Very high | 96.6 | Very high | 83 Ų | 83 | 111.6 Ų | 111.6 | 39% | 0.388 | 51% | 0.509 | S | S | . | . | H | α-helix | trans | -67.3 | -39.5 | 178.6 | -175.9 | 56.5 | -161.4 | 0 | 0 | 112 | L289 W290 K295 R296 L297 | L289-E293 PolarHBondContact O-N 2.85Å; W290-E293 PolarHBondContact O-N 2.9Å; E293-K295 VanDerWaalsContact C-N 3.31Å; E293-K295 PolarHBondContact O-N 2.9Å; E293-R296 VanDerWaalsContact CD-NE 3.34Å; E293-R296 WeakPolarHBondContact O-CB 3.39Å; E293-R296 PolarHBondContact O-N 3.43Å; E293-R296 VanDerWaalsContact O-N 3.14Å; E293-R296 IonicContact OE1-CZ 3.86Å; E293-R296 IonicContact OE1-NE 3.79Å; E293-R296 PolarHBondContact OE1-NE 2.87Å; E293-R296 VanDerWaalsContact OE1-NE 3.13Å; E293-R296 IonicContact OE1-NH2 2.68Å; E293-R296 PolarHBondContact OE1-NH2 2.94Å; E293-R296 WeakPolarHBondContact OE2-CD 3.37Å; E293-R296 IonicContact OE2-CZ 3.86Å; E293-R296 IonicContact OE2-NE 2.78Å; E293-R296 PolarHBondContact OE2-NE 2.92Å; E293-R296 IonicContact OE2-NH2 3.94Å; E293-L297 HydrophobicContact CG-CD1 4.12Å; E293-L297 WeakPolarHBondContact O-CG 3.16Å; E293-L297 PolarHBondContact O-N 3.35Å |
| 294 | L | 97.4 | Very high | 96.9 | Very high | 88 Ų | 88 | 111.8 Ų | 111.8 | 46% | 0.461 | 51% | 0.507 | S | S | . | . | H | α-helix | trans | -60.7 | -39.5 | 173.1 | -175.5 | 65.3 | 0 | 0 | 0 | 112 | W290 Y298 | W290-L294 HydrophobicContact CH2-CD2 3.79Å; W290-L294 HydrophobicContact CZ2-CD2 4.4Å; W290-L294 HydrophobicContact CZ3-CD2 3.89Å; W290-L294 VanDerWaalsContact O-CB 3.31Å; W290-L294 WeakPolarHBondContact O-CB 3.36Å; W290-L294 PolarHBondContact O-N 2.67Å; L294-Y298 VanDerWaalsContact O-CB 3.32Å; L294-Y298 WeakPolarHBondContact O-CB 3.31Å; L294-Y298 PolarHBondContact O-N 3.36Å |
| 295 | K | 98.1 | Very high | 97.1 | Very high | 146 Ų | 146 | 110.4 Ų | 110.4 | 64% | 0.635 | 51% | 0.506 | S | S | * | . | H | α-helix | trans | -65.7 | -42.3 | 172.6 | -74.6 | 168.8 | -176.2 | 178.3 | 0 | 111.7 | L291 A292 E293 Y298 V299 | L291-K295 WeakPolarHBondContact O-CB 3.4Å; L291-K295 WeakPolarHBondContact O-CD 3.17Å; L291-K295 WeakPolarHBondContact O-CG 3.48Å; L291-K295 PolarHBondContact O-N 2.92Å; L291-K295 VanDerWaalsContact O-N 3.16Å; A292-K295 WeakPolarHBondContact O-CB 3.48Å; A292-K295 PolarHBondContact O-N 3.38Å; E293-K295 VanDerWaalsContact C-N 3.31Å; E293-K295 PolarHBondContact O-N 2.9Å; K295-Y298 PolarHBondContact O-N 3.48Å; K295-V299 WeakPolarHBondContact O-CG2 3.39Å; K295-V299 PolarHBondContact O-N 3.03Å |
| 296 | R | 98.4 | Very high | 97.4 | Very high | 114 Ų | 114 | 110.6 Ų | 110.6 | 43% | 0.43 | 51% | 0.512 | S | S | . | . | H | α-helix | trans | -58.2 | -52.7 | 177.3 | -164.1 | -167.5 | 69.4 | 67.1 | 7.5 | 110.8 | A292 E293 Y298 V299 E300 | A292-R296 PolarHBondContact O-N 3.24Å; E293-R296 VanDerWaalsContact CD-NE 3.34Å; E293-R296 WeakPolarHBondContact O-CB 3.39Å; E293-R296 PolarHBondContact O-N 3.43Å; E293-R296 VanDerWaalsContact O-N 3.14Å; E293-R296 IonicContact OE1-CZ 3.86Å; E293-R296 IonicContact OE1-NE 3.79Å; E293-R296 PolarHBondContact OE1-NE 2.87Å; E293-R296 VanDerWaalsContact OE1-NE 3.13Å; E293-R296 IonicContact OE1-NH2 2.68Å; E293-R296 PolarHBondContact OE1-NH2 2.94Å; E293-R296 WeakPolarHBondContact OE2-CD 3.37Å; E293-R296 IonicContact OE2-CZ 3.86Å; E293-R296 IonicContact OE2-NE 2.78Å; E293-R296 PolarHBondContact OE2-NE 2.92Å; E293-R296 IonicContact OE2-NH2 3.94Å; R296-Y298 PolarHBondContact O-N 3.4Å; R296-V299 PolarHBondContact O-N 3.32Å; R296-E300 IonicContact CZ-OE2 2.83Å; R296-E300 IonicContact NH1-OE1 3.71Å; R296-E300 IonicContact NH1-OE2 2.64Å; R296-E300 PolarHBondContact NH1-OE2 3.32Å; R296-E300 IonicContact NH2-OE2 3.13Å; R296-E300 PolarHBondContact NH2-OE2 2.97Å; R296-E300 WeakPolarHBondContact O-CB 3.3Å; R296-E300 PolarHBondContact O-N 3Å |
| 297 | L | 98.1 | Very high | 97.6 | Very high | 83 Ų | 83 | 106.2 Ų | 106.2 | 44% | 0.435 | 50% | 0.5 | S | S | . | . | H | α-helix | trans | -62.2 | -38.2 | 178.2 | -69 | 168.5 | 0 | 0 | 0 | 112.6 | E293 R301 | E293-L297 HydrophobicContact CG-CD1 4.12Å; E293-L297 WeakPolarHBondContact O-CG 3.16Å; E293-L297 PolarHBondContact O-N 3.35Å; L297-R301 VanDerWaalsContact O-CB 3.29Å; L297-R301 WeakPolarHBondContact O-CB 3.34Å; L297-R301 PolarHBondContact O-N 2.81Å |
| 298 | Y | 97.5 | Very high | 97.8 | Very high | 153 Ų | 153 | 107.7 Ų | 107.7 | 60% | 0.6 | 50% | 0.504 | S | S | * | . | H | α-helix | trans | -65.2 | -44.3 | 175 | 178 | -103.7 | 0 | 0 | 0 | 112.3 | L294 K295 R296 R301 L302 | L294-Y298 VanDerWaalsContact O-CB 3.32Å; L294-Y298 WeakPolarHBondContact O-CB 3.31Å; L294-Y298 PolarHBondContact O-N 3.36Å; K295-Y298 PolarHBondContact O-N 3.48Å; R296-Y298 PolarHBondContact O-N 3.4Å; Y298-R301 PolarHBondContact O-N 2.93Å; Y298-L302 HydrophobicContact CD1-CD1 4.06Å; Y298-L302 HydrophobicContact CE1-CD1 3.47Å; Y298-L302 VanDerWaalsContact CE1-CD1 3.47Å; Y298-L302 HydrophobicContact CE1-CG 4.19Å; Y298-L302 WeakPolarHBondContact O-CG 3.47Å; Y298-L302 PolarHBondContact O-N 2.73Å |
| 299 | V | 98.4 | Very high | 97.8 | Very high | 72 Ų | 72 | 102.9 Ų | 102.9 | 44% | 0.436 | 50% | 0.497 | S | S | . | . | H | α-helix | trans | -66.3 | -42.6 | 176.9 | 171 | 0 | 0 | 0 | 0 | 111.2 | K295 R296 R301 L302 H303 | K295-V299 WeakPolarHBondContact O-CG2 3.39Å; K295-V299 PolarHBondContact O-N 3.03Å; R296-V299 PolarHBondContact O-N 3.32Å; V299-R301 PolarHBondContact O-N 2.91Å; V299-L302 PolarHBondContact O-N 3Å; V299-H303 PolarHBondContact O-N 3.09Å; V299-H303 VanDerWaalsContact O-N 3.09Å; V299-H303 PolarHBondContact O-ND1 2.88Å |
| 300 | E | 98.3 | Very high | 97.8 | Very high | 97 Ų | 97 | 100.9 Ų | 100.9 | 45% | 0.453 | 49% | 0.485 | S | S | . | . | H | α-helix | trans | -57.7 | -47 | 174 | -175.6 | 162.5 | -141.1 | 0 | 0 | 111 | R296 L302 H303 E304 | R296-E300 IonicContact CZ-OE2 2.83Å; R296-E300 IonicContact NH1-OE1 3.71Å; R296-E300 IonicContact NH1-OE2 2.64Å; R296-E300 PolarHBondContact NH1-OE2 3.32Å; R296-E300 IonicContact NH2-OE2 3.13Å; R296-E300 PolarHBondContact NH2-OE2 2.97Å; R296-E300 WeakPolarHBondContact O-CB 3.3Å; R296-E300 PolarHBondContact O-N 3Å; E300-L302 PolarHBondContact O-N 2.88Å; E300-H303 WeakPolarHBondContact O-CB 3.35Å; E300-H303 PolarHBondContact O-N 2.81Å; E300-H303 VanDerWaalsContact O-N 3.12Å; E300-E304 PolarHBondContact O-N 3Å |
| 301 | R | 98.4 | Very high | 98 | Very high | 153 Ų | 153 | 100.3 Ų | 100.3 | 58% | 0.577 | 48% | 0.483 | S | S | * | . | H | α-helix | trans | -63.4 | -35.4 | 176.4 | -172.3 | 53.8 | 165.1 | -162.9 | -6.9 | 113.6 | L297 Y298 V299 E304 V305 | L297-R301 VanDerWaalsContact O-CB 3.29Å; L297-R301 WeakPolarHBondContact O-CB 3.34Å; L297-R301 PolarHBondContact O-N 2.81Å; Y298-R301 PolarHBondContact O-N 2.93Å; V299-R301 PolarHBondContact O-N 2.91Å; R301-E304 WeakPolarHBondContact CD-OE2 3.17Å; R301-E304 IonicContact CZ-OE2 2.71Å; R301-E304 IonicContact NE-OE2 3.81Å; R301-E304 IonicContact NH1-OE2 3.75Å; R301-E304 PolarHBondContact NH1-OE2 2.89Å; R301-E304 PolarHBondContact O-N 2.71Å; R301-V305 VanDerWaalsContact O-CG2 3.31Å; R301-V305 WeakPolarHBondContact O-CG2 3.37Å; R301-V305 PolarHBondContact O-N 3.22Å |
| 302 | L | 98.3 | Very high | 97.8 | Very high | 78 Ų | 78 | 100 Ų | 100 | 41% | 0.408 | 49% | 0.486 | S | S | . | . | H | α-helix | trans | -64.5 | -39.5 | 173 | -76.4 | 177.3 | 0 | 0 | 0 | 111.8 | Y298 V299 E300 V305 T306 | Y298-L302 HydrophobicContact CD1-CD1 4.06Å; Y298-L302 HydrophobicContact CE1-CD1 3.47Å; Y298-L302 VanDerWaalsContact CE1-CD1 3.47Å; Y298-L302 HydrophobicContact CE1-CG 4.19Å; Y298-L302 WeakPolarHBondContact O-CG 3.47Å; Y298-L302 PolarHBondContact O-N 2.73Å; V299-L302 PolarHBondContact O-N 3Å; E300-L302 PolarHBondContact O-N 2.88Å; L302-V305 PolarHBondContact O-N 3.49Å; L302-T306 WeakPolarHBondContact O-CB 3.49Å; L302-T306 PolarHBondContact O-N 3.01Å; L302-T306 PolarHBondContact O-OG1 3.08Å |
| 303 | H | 98.6 | Very high | 97.8 | Very high | 129 Ų | 129 | 102.6 Ų | 102.6 | 60% | 0.597 | 49% | 0.489 | S | S | * | . | H | α-helix | trans | -66 | -43 | 175.2 | -72.7 | 84.6 | 0 | 0 | 0 | 111.9 | V299 E300 V305 T306 Q307 | V299-H303 PolarHBondContact O-N 3.09Å; V299-H303 VanDerWaalsContact O-N 3.09Å; V299-H303 PolarHBondContact O-ND1 2.88Å; E300-H303 WeakPolarHBondContact O-CB 3.35Å; E300-H303 PolarHBondContact O-N 2.81Å; E300-H303 VanDerWaalsContact O-N 3.12Å; H303-V305 PolarHBondContact O-N 2.9Å; H303-T306 PolarHBondContact O-N 3.07Å; H303-Q307 VanDerWaalsContact O-CB 3.3Å; H303-Q307 WeakPolarHBondContact O-CB 3.46Å; H303-Q307 PolarHBondContact O-N 3.28Å |
| 304 | E | 98.2 | Very high | 97.8 | Very high | 99 Ų | 99 | 105.4 Ų | 105.4 | 46% | 0.463 | 50% | 0.496 | S | S | . | . | H | α-helix | trans | -56.7 | -48.4 | 173.4 | -69.2 | -172.3 | 124.8 | 0 | 0 | 112.3 | E300 R301 K308 | E300-E304 PolarHBondContact O-N 3Å; R301-E304 WeakPolarHBondContact CD-OE2 3.17Å; R301-E304 IonicContact CZ-OE2 2.71Å; R301-E304 IonicContact NE-OE2 3.81Å; R301-E304 IonicContact NH1-OE2 3.75Å; R301-E304 PolarHBondContact NH1-OE2 2.89Å; R301-E304 PolarHBondContact O-N 2.71Å; E304-K308 VanDerWaalsContact O-CB 3.25Å; E304-K308 WeakPolarHBondContact O-CB 3.37Å; E304-K308 PolarHBondContact O-N 3.01Å |
| 305 | V | 98 | Very high | 97.9 | Very high | 79 Ų | 79 | 105.1 Ų | 105.1 | 48% | 0.479 | 50% | 0.495 | S | S | . | . | H | α-helix | trans | -64.4 | -42.1 | -179.2 | 169.3 | 0 | 0 | 0 | 0 | 110.8 | R301 L302 H303 K308 A309 | R301-V305 VanDerWaalsContact O-CG2 3.31Å; R301-V305 WeakPolarHBondContact O-CG2 3.37Å; R301-V305 PolarHBondContact O-N 3.22Å; L302-V305 PolarHBondContact O-N 3.49Å; H303-V305 PolarHBondContact O-N 2.9Å; V305-K308 PolarHBondContact O-N 3.02Å; V305-A309 WeakPolarHBondContact O-CB 3.4Å; V305-A309 PolarHBondContact O-N 2.88Å |
| 306 | T | 97.6 | Very high | 97.9 | Very high | 78 Ų | 78 | 102.8 Ų | 102.8 | 48% | 0.479 | 49% | 0.489 | S | S | . | . | H | α-helix | trans | -65.2 | -48.9 | 178.5 | -55.4 | 0 | 0 | 0 | 0 | 111.1 | L302 H303 K308 A309 E310 | L302-T306 WeakPolarHBondContact O-CB 3.49Å; L302-T306 PolarHBondContact O-N 3.01Å; L302-T306 PolarHBondContact O-OG1 3.08Å; H303-T306 PolarHBondContact O-N 3.07Å; T306-K308 VanDerWaalsContact C-N 3.3Å; T306-K308 PolarHBondContact O-N 3.43Å; T306-A309 WeakPolarHBondContact O-CB 3.43Å; T306-A309 PolarHBondContact O-N 3.5Å; T306-A309 VanDerWaalsContact O-N 3.1Å; T306-E310 PolarHBondContact O-N 2.98Å |
| 307 | Q | 98.3 | Very high | 97.9 | Very high | 93 Ų | 93 | 102.3 Ų | 102.3 | 44% | 0.435 | 49% | 0.491 | S | S | . | . | H | α-helix | trans | -63.3 | -35.3 | 177.5 | -170.3 | -173.8 | 85.4 | 0 | 0 | 112.1 | H303 R311 | H303-Q307 VanDerWaalsContact O-CB 3.3Å; H303-Q307 WeakPolarHBondContact O-CB 3.46Å; H303-Q307 PolarHBondContact O-N 3.28Å; Q307-R311 WeakPolarHBondContact O-CB 3.43Å; Q307-R311 VanDerWaalsContact O-CG 3.24Å; Q307-R311 WeakPolarHBondContact O-CG 3.22Å; Q307-R311 PolarHBondContact O-N 3.28Å; Q307-R311 VanDerWaalsContact O-N 3.09Å |
| 308 | K | 97.8 | Very high | 97.9 | Very high | 157 Ų | 157 | 103.2 Ų | 103.2 | 68% | 0.683 | 50% | 0.496 | S | S | * | . | H | α-helix | trans | -67.6 | -39.8 | 173.2 | -172.3 | 175.4 | -178.9 | 178.4 | 0 | 111.7 | E304 V305 T306 R311 S312 | E304-K308 VanDerWaalsContact O-CB 3.25Å; E304-K308 WeakPolarHBondContact O-CB 3.37Å; E304-K308 PolarHBondContact O-N 3.01Å; V305-K308 PolarHBondContact O-N 3.02Å; T306-K308 VanDerWaalsContact C-N 3.3Å; T306-K308 PolarHBondContact O-N 3.43Å; K308-R311 PolarHBondContact O-N 2.89Å; K308-S312 PolarHBondContact O-N 3.23Å |
| 309 | A | 97.2 | Very high | 97.9 | Very high | 52 Ų | 52 | 101.2 Ų | 101.2 | 43% | 0.43 | 49% | 0.492 | S | S | . | . | H | α-helix | trans | -61.1 | -51.8 | 174.6 | 0 | 0 | 0 | 0 | 0 | 111 | V305 T306 R311 S312 E313 | V305-A309 WeakPolarHBondContact O-CB 3.4Å; V305-A309 PolarHBondContact O-N 2.88Å; T306-A309 WeakPolarHBondContact O-CB 3.43Å; T306-A309 PolarHBondContact O-N 3.5Å; T306-A309 VanDerWaalsContact O-N 3.1Å; A309-R311 VanDerWaalsContact C-N 3.34Å; A309-R311 PolarHBondContact O-N 2.91Å; A309-S312 CarbonylContact O-C 3.6Å; A309-S312 WeakPolarHBondContact O-CA 3.25Å; A309-S312 PolarHBondContact O-N 2.97Å; A309-S312 PolarHBondContact O-OG 3.33Å; A309-E313 PolarHBondContact O-N 3.5Å |
| 310 | E | 98.3 | Very high | 97.9 | Very high | 74 Ų | 74 | 103 Ų | 103 | 35% | 0.346 | 50% | 0.498 | S | S | . | . | H | α-helix | trans | -54.6 | -45.5 | 175.8 | -71.9 | 179.4 | -148.6 | 0 | 0 | 113.1 | T306 S312 E313 R314 | T306-E310 PolarHBondContact O-N 2.98Å; E310-S312 VanDerWaalsContact C-N 3.3Å; E310-S312 PolarHBondContact O-N 3.31Å; E310-E313 PolarHBondContact O-N 3.21Å; E310-R314 WeakPolarHBondContact O-CG 3.25Å; E310-R314 PolarHBondContact O-N 3.08Å; E310-R314 IonicContact OE2-CZ 2.72Å; E310-R314 IonicContact OE2-NH1 2.7Å; E310-R314 PolarHBondContact OE2-NH1 2.69Å; E310-R314 IonicContact OE2-NH2 3.79Å; E310-R314 PolarHBondContact OE2-NH2 3.04Å |
| 311 | R | 98.3 | Very high | 97.9 | Very high | 155 Ų | 155 | 104.4 Ų | 104.4 | 59% | 0.585 | 50% | 0.504 | S | S | * | . | H | α-helix | trans | -61.8 | -39.5 | 177.6 | -74.3 | 169.6 | 177.6 | 167.6 | 1.5 | 111.4 | Q307 K308 A309 N315 | Q307-R311 WeakPolarHBondContact O-CB 3.43Å; Q307-R311 VanDerWaalsContact O-CG 3.24Å; Q307-R311 WeakPolarHBondContact O-CG 3.22Å; Q307-R311 PolarHBondContact O-N 3.28Å; Q307-R311 VanDerWaalsContact O-N 3.09Å; K308-R311 PolarHBondContact O-N 2.89Å; A309-R311 VanDerWaalsContact C-N 3.34Å; A309-R311 PolarHBondContact O-N 2.91Å; R311-N315 PolarHBondContact O-N 3.47Å |
| 312 | S | 94 | Very high | 97.9 | Very high | 61 Ų | 61 | 101.7 Ų | 101.7 | 43% | 0.427 | 50% | 0.498 | S | S | . | . | H | α-helix | trans | -69.2 | -38.5 | 175.5 | 74.9 | 0 | 0 | 0 | 0 | 112.4 | K308 A309 E310 N315 L316 | K308-S312 PolarHBondContact O-N 3.23Å; A309-S312 CarbonylContact O-C 3.6Å; A309-S312 WeakPolarHBondContact O-CA 3.25Å; A309-S312 PolarHBondContact O-N 2.97Å; A309-S312 PolarHBondContact O-OG 3.33Å; E310-S312 VanDerWaalsContact C-N 3.3Å; E310-S312 PolarHBondContact O-N 3.31Å; S312-N315 PolarHBondContact O-N 3.26Å; S312-L316 WeakPolarHBondContact O-CG 3.47Å; S312-L316 PolarHBondContact O-N 2.88Å |
| 313 | E | 97.8 | Very high | 97.8 | Very high | 110 Ų | 110 | 100.7 Ų | 100.7 | 51% | 0.514 | 50% | 0.502 | S | S | . | . | H | α-helix | trans | -64 | -49.8 | 177.4 | -164.8 | -161.8 | 156.7 | 0 | 0 | 111 | A309 E310 N315 L316 Q317 | A309-E313 PolarHBondContact O-N 3.5Å; E310-E313 PolarHBondContact O-N 3.21Å; E313-N315 PolarHBondContact O-N 3.48Å; E313-L316 PolarHBondContact O-N 3.19Å; E313-L316 VanDerWaalsContact O-N 3.09Å; E313-Q317 HydrophobicContact CG-CG 4.47Å; E313-Q317 WeakPolarHBondContact O-CB 3.38Å; E313-Q317 VanDerWaalsContact O-CG 3.31Å; E313-Q317 WeakPolarHBondContact O-CG 3.37Å; E313-Q317 PolarHBondContact O-N 3.03Å; E313-Q317 PolarHBondContact OE1-NE2 3.44Å |
| 314 | R | 97.9 | Very high | 97.8 | Very high | 142 Ų | 142 | 98.9 Ų | 98.9 | 54% | 0.536 | 49% | 0.493 | S | S | . | . | H | α-helix | trans | -57.3 | -36.4 | 176.1 | -68.9 | 170.8 | -174 | 130.5 | 12.4 | 111.9 | E310 L318 | E310-R314 WeakPolarHBondContact O-CG 3.25Å; E310-R314 PolarHBondContact O-N 3.08Å; E310-R314 IonicContact OE2-CZ 2.72Å; E310-R314 IonicContact OE2-NH1 2.7Å; E310-R314 PolarHBondContact OE2-NH1 2.69Å; E310-R314 IonicContact OE2-NH2 3.79Å; E310-R314 PolarHBondContact OE2-NH2 3.04Å; R314-L318 PolarHBondContact O-N 3.45Å |
| 315 | N | 98.1 | Very high | 97.8 | Very high | 83 Ų | 83 | 99.2 Ų | 99.2 | 44% | 0.444 | 50% | 0.495 | S | S | . | . | H | α-helix | trans | -69 | -45.1 | 174.8 | -166.9 | -92.6 | 0 | 0 | 0 | 112.2 | R311 S312 E313 L318 Q319 | R311-N315 PolarHBondContact O-N 3.47Å; S312-N315 PolarHBondContact O-N 3.26Å; E313-N315 PolarHBondContact O-N 3.48Å; N315-L318 PolarHBondContact O-N 2.93Å; N315-Q319 WeakPolarHBondContact O-CG 3.49Å; N315-Q319 PolarHBondContact O-N 2.92Å; N315-Q319 PolarHBondContact OD1-NE2 2.66Å |
| 316 | L | 98.3 | Very high | 97.7 | Very high | 97 Ų | 97 | 100.1 Ų | 100.1 | 51% | 0.508 | 49% | 0.494 | S | S | . | . | H | α-helix | trans | -64.8 | -39.1 | 177.2 | -71.1 | 169.2 | 0 | 0 | 0 | 112.3 | S312 E313 L318 Q319 L320 | S312-L316 WeakPolarHBondContact O-CG 3.47Å; S312-L316 PolarHBondContact O-N 2.88Å; E313-L316 PolarHBondContact O-N 3.19Å; E313-L316 VanDerWaalsContact O-N 3.09Å; L316-L318 VanDerWaalsContact C-N 3.33Å; L316-L318 PolarHBondContact O-N 3.46Å; L316-Q319 PolarHBondContact O-N 3.26Å; L316-L320 WeakPolarHBondContact O-CB 3.38Å; L316-L320 VanDerWaalsContact O-CG 3.28Å; L316-L320 WeakPolarHBondContact O-CG 3.45Å; L316-L320 PolarHBondContact O-N 3.39Å |
| 317 | Q | 98.4 | Very high | 97.7 | Very high | 104 Ų | 104 | 100.9 Ų | 100.9 | 49% | 0.486 | 49% | 0.492 | S | S | . | . | H | α-helix | trans | -58.4 | -43.8 | 172.7 | -71.3 | 175.4 | 6.2 | 0 | 0 | 111.4 | E313 L320 F321 | E313-Q317 HydrophobicContact CG-CG 4.47Å; E313-Q317 WeakPolarHBondContact O-CB 3.38Å; E313-Q317 VanDerWaalsContact O-CG 3.31Å; E313-Q317 WeakPolarHBondContact O-CG 3.37Å; E313-Q317 PolarHBondContact O-N 3.03Å; E313-Q317 PolarHBondContact OE1-NE2 3.44Å; Q317-L320 PolarHBondContact O-N 2.85Å; Q317-F321 PolarHBondContact O-N 2.95Å |
| 318 | L | 98.4 | Very high | 97.7 | Very high | 101 Ų | 101 | 103.6 Ų | 103.6 | 53% | 0.529 | 50% | 0.498 | S | S | . | . | H | α-helix | trans | -65.7 | -44 | 175.4 | -179.3 | 61.7 | 0 | 0 | 0 | 112.2 | R314 N315 L316 L320 F321 M322 | R314-L318 PolarHBondContact O-N 3.45Å; N315-L318 PolarHBondContact O-N 2.93Å; L316-L318 VanDerWaalsContact C-N 3.33Å; L316-L318 PolarHBondContact O-N 3.46Å; L318-L320 VanDerWaalsContact C-N 3.33Å; L318-L320 PolarHBondContact O-N 3.24Å; L318-F321 PolarHBondContact O-N 3.38Å; L318-M322 HydrophobicContact CD1-CG 4.49Å; L318-M322 WeakPolarHBondContact O-CG 3.45Å; L318-M322 PolarHBondContact O-N 2.89Å |
| 319 | Q | 97.7 | Very high | 97.7 | Very high | 112 Ų | 112 | 101.5 Ų | 101.5 | 52% | 0.523 | 49% | 0.486 | S | S | . | . | H | α-helix | trans | -60 | -42.5 | 175.2 | -69.7 | -176.6 | 20.7 | 0 | 0 | 111.8 | N315 L316 M322 A323 | N315-Q319 WeakPolarHBondContact O-CG 3.49Å; N315-Q319 PolarHBondContact O-N 2.92Å; N315-Q319 PolarHBondContact OD1-NE2 2.66Å; L316-Q319 PolarHBondContact O-N 3.26Å; Q319-M322 PolarHBondContact O-N 3.39Å; Q319-A323 WeakPolarHBondContact O-CB 3.37Å; Q319-A323 PolarHBondContact O-N 2.88Å |
| 320 | L | 98.3 | Very high | 97.6 | Very high | 108 Ų | 108 | 103.4 Ų | 103.4 | 57% | 0.565 | 49% | 0.488 | S | S | * | . | H | α-helix | trans | -63.2 | -40.2 | 175.5 | -74.5 | 168.9 | 0 | 0 | 0 | 112.1 | L316 Q317 L318 Q324 | L316-L320 WeakPolarHBondContact O-CB 3.38Å; L316-L320 VanDerWaalsContact O-CG 3.28Å; L316-L320 WeakPolarHBondContact O-CG 3.45Å; L316-L320 PolarHBondContact O-N 3.39Å; Q317-L320 PolarHBondContact O-N 2.85Å; L318-L320 VanDerWaalsContact C-N 3.33Å; L318-L320 PolarHBondContact O-N 3.24Å; L320-Q324 WeakPolarHBondContact O-CB 3.01Å; L320-Q324 VanDerWaalsContact O-CG 3.28Å; L320-Q324 WeakPolarHBondContact O-CG 3.44Å; L320-Q324 PolarHBondContact O-N 3.37Å |
| 321 | F | 98.6 | Very high | 97.5 | Very high | 128 Ų | 128 | 106.4 Ų | 106.4 | 56% | 0.561 | 50% | 0.497 | S | S | * | . | H | α-helix | trans | -62.3 | -48.6 | 174.4 | 178.1 | -92.3 | 0 | 0 | 0 | 111.6 | Q317 L318 A323 Q324 Q325 | Q317-F321 PolarHBondContact O-N 2.95Å; L318-F321 PolarHBondContact O-N 3.38Å; F321-A323 PolarHBondContact O-N 3.09Å; F321-Q324 PolarHBondContact O-N 2.96Å; F321-Q325 PolarHBondContact O-N 3.5Å |
| 322 | M | 98.3 | Very high | 97.4 | Very high | 95 Ų | 95 | 106.6 Ų | 106.6 | 47% | 0.468 | 50% | 0.502 | S | S | . | . | H | α-helix | trans | -60 | -47.6 | 177.7 | -68.9 | -60.7 | -64.8 | 0 | 0 | 111.6 | L318 Q319 Q324 Q325 E326 | L318-M322 HydrophobicContact CD1-CG 4.49Å; L318-M322 WeakPolarHBondContact O-CG 3.45Å; L318-M322 PolarHBondContact O-N 2.89Å; Q319-M322 PolarHBondContact O-N 3.39Å; M322-Q324 VanDerWaalsContact C-N 3.32Å; M322-Q324 PolarHBondContact O-N 3.1Å; M322-Q325 WeakPolarHBondContact O-CB 3.4Å; M322-Q325 PolarHBondContact O-N 2.72Å; M322-Q325 VanDerWaalsContact O-N 3.09Å; M322-E326 PolarHBondContact O-N 2.9Å |
| 323 | A | 96.4 | Very high | 97.4 | Very high | 58 Ų | 58 | 107.6 Ų | 107.6 | 48% | 0.479 | 50% | 0.5 | S | S | . | . | H | α-helix | trans | -62.2 | -36.6 | 177.1 | 0 | 0 | 0 | 0 | 0 | 112.5 | Q319 F321 Q327 | Q319-A323 WeakPolarHBondContact O-CB 3.37Å; Q319-A323 PolarHBondContact O-N 2.88Å; F321-A323 PolarHBondContact O-N 3.09Å; A323-Q327 VanDerWaalsContact O-CB 3.28Å; A323-Q327 WeakPolarHBondContact O-CB 3.37Å; A323-Q327 PolarHBondContact O-N 3.33Å |
| 324 | Q | 97.9 | Very high | 97.1 | Very high | 90 Ų | 90 | 106.5 Ų | 106.5 | 42% | 0.421 | 50% | 0.497 | S | S | . | . | H | α-helix | trans | -67.6 | -38.1 | 171.9 | -76.8 | -176.6 | 44.9 | 0 | 0 | 112.6 | L320 F321 M322 Q327 R328 | L320-Q324 WeakPolarHBondContact O-CB 3.01Å; L320-Q324 VanDerWaalsContact O-CG 3.28Å; L320-Q324 WeakPolarHBondContact O-CG 3.44Å; L320-Q324 PolarHBondContact O-N 3.37Å; F321-Q324 PolarHBondContact O-N 2.96Å; M322-Q324 VanDerWaalsContact C-N 3.32Å; M322-Q324 PolarHBondContact O-N 3.1Å; Q324-Q327 PolarHBondContact O-N 3.17Å; Q324-R328 WeakPolarHBondContact O-CB 3.28Å; Q324-R328 WeakPolarHBondContact O-CG 3.37Å; Q324-R328 PolarHBondContact O-N 2.89Å |
| 325 | Q | 98.2 | Very high | 96.8 | Very high | 107 Ų | 107 | 108.5 Ų | 108.5 | 50% | 0.5 | 51% | 0.505 | S | S | . | . | H | α-helix | trans | -64.5 | -45.4 | 175.8 | -175.2 | -179.5 | -3.2 | 0 | 0 | 110.9 | F321 M322 R328 R329 | F321-Q325 PolarHBondContact O-N 3.5Å; M322-Q325 WeakPolarHBondContact O-CB 3.4Å; M322-Q325 PolarHBondContact O-N 2.72Å; M322-Q325 VanDerWaalsContact O-N 3.09Å; Q325-R328 WeakPolarHBondContact O-CB 3.39Å; Q325-R328 PolarHBondContact O-N 3.36Å; Q325-R329 PolarHBondContact O-N 2.7Å |
| 326 | E | 96.6 | Very high | 96.4 | Very high | 98 Ų | 98 | 107.5 Ų | 107.5 | 46% | 0.458 | 51% | 0.507 | S | S | . | . | H | α-helix | trans | -65.2 | -42.3 | 175 | -68.8 | -144.4 | 102.8 | 0 | 0 | 112.2 | M322 R328 R329 L330 | M322-E326 PolarHBondContact O-N 2.9Å; E326-R328 VanDerWaalsContact C-N 3.25Å; E326-R328 PolarHBondContact O-N 3.38Å; E326-R329 CarbonylContact O-C 3.54Å; E326-R329 WeakPolarHBondContact O-CA 3.17Å; E326-R329 WeakPolarHBondContact O-CB 3.38Å; E326-R329 PolarHBondContact O-N 2.99Å; E326-R329 IonicContact OE1-CZ 3.65Å; E326-R329 IonicContact OE1-NH1 3.66Å; E326-R329 PolarHBondContact OE1-NH1 3.03Å; E326-L330 WeakPolarHBondContact O-CB 3.48Å; E326-L330 WeakPolarHBondContact O-CG 3.44Å; E326-L330 PolarHBondContact O-N 3.48Å |
| 327 | Q | 97.8 | Very high | 95.7 | Very high | 93 Ų | 93 | 109.3 Ų | 109.3 | 44% | 0.435 | 51% | 0.513 | S | S | . | . | H | α-helix | trans | -57.4 | -38.9 | 172.6 | -173.2 | -171.3 | 81.5 | 0 | 0 | 111.8 | A323 Q324 R331 | A323-Q327 VanDerWaalsContact O-CB 3.28Å; A323-Q327 WeakPolarHBondContact O-CB 3.37Å; A323-Q327 PolarHBondContact O-N 3.33Å; Q324-Q327 PolarHBondContact O-N 3.17Å; Q327-R331 VanDerWaalsContact O-CB 3.25Å; Q327-R331 WeakPolarHBondContact O-CB 3.18Å; Q327-R331 WeakPolarHBondContact O-CG 3.31Å; Q327-R331 PolarHBondContact O-N 2.91Å; Q327-R331 VanDerWaalsContact OE1-CZ 3.3Å |
| 328 | R | 97.6 | Very high | 94.9 | Very high | 150 Ų | 150 | 110.4 Ų | 110.4 | 57% | 0.566 | 52% | 0.519 | S | S | * | . | H | α-helix | trans | -70 | -31.8 | 174.1 | -68.5 | 167.9 | -161 | -159.5 | 8.9 | 112.2 | Q324 Q325 E326 K332 | Q324-R328 WeakPolarHBondContact O-CB 3.28Å; Q324-R328 WeakPolarHBondContact O-CG 3.37Å; Q324-R328 PolarHBondContact O-N 2.89Å; Q325-R328 WeakPolarHBondContact O-CB 3.39Å; Q325-R328 PolarHBondContact O-N 3.36Å; E326-R328 VanDerWaalsContact C-N 3.25Å; E326-R328 PolarHBondContact O-N 3.38Å; R328-K332 WeakPolarHBondContact O-CG 3.41Å; R328-K332 PolarHBondContact O-N 3.29Å |
| 329 | R | 98 | Very high | 93.4 | Very high | 114 Ų | 114 | 108.8 Ų | 108.8 | 43% | 0.43 | 53% | 0.526 | S | S | . | . | H | α-helix | trans | -69.3 | -55.3 | 175.2 | -153.7 | -165.5 | 79.4 | -129.6 | -6.4 | 110.9 | Q325 E326 R331 K332 E333 | Q325-R329 PolarHBondContact O-N 2.7Å; E326-R329 CarbonylContact O-C 3.54Å; E326-R329 WeakPolarHBondContact O-CA 3.17Å; E326-R329 WeakPolarHBondContact O-CB 3.38Å; E326-R329 PolarHBondContact O-N 2.99Å; E326-R329 IonicContact OE1-CZ 3.65Å; E326-R329 IonicContact OE1-NH1 3.66Å; E326-R329 PolarHBondContact OE1-NH1 3.03Å; R329-R331 VanDerWaalsContact C-N 3.31Å; R329-R331 PolarHBondContact O-N 3.29Å; R329-K332 WeakPolarHBondContact O-CA 3.44Å; R329-K332 WeakPolarHBondContact O-CB 3.49Å; R329-K332 PolarHBondContact O-N 3.43Å; R329-E333 WeakPolarHBondContact CD-OE1 3.46Å; R329-E333 WeakPolarHBondContact CG-OE1 3.5Å; R329-E333 IonicContact CZ-OE1 3.57Å; R329-E333 IonicContact NE-OE1 2.69Å; R329-E333 PolarHBondContact NE-OE1 2.8Å; R329-E333 IonicContact NE-OE2 2.84Å; R329-E333 IonicContact NH2-OE1 3.52Å; R329-E333 IonicContact NH2-OE2 2.67Å; R329-E333 PolarHBondContact O-N 3.38Å |
| 330 | L | 95.4 | Very high | 91.7 | Very high | 91 Ų | 91 | 110.2 Ų | 110.2 | 48% | 0.476 | 54% | 0.537 | S | S | . | . | H | α-helix | trans | -59.5 | -37.7 | 178.2 | -64.7 | 171.2 | 0 | 0 | 0 | 112 | E326 K332 E333 L334 | E326-L330 WeakPolarHBondContact O-CB 3.48Å; E326-L330 WeakPolarHBondContact O-CG 3.44Å; E326-L330 PolarHBondContact O-N 3.48Å; L330-K332 VanDerWaalsContact C-N 3.3Å; L330-K332 PolarHBondContact O-N 3Å; L330-E333 PolarHBondContact O-N 2.9Å; L330-L334 WeakPolarHBondContact O-CB 3.29Å; L330-L334 PolarHBondContact O-N 3.32Å |
| 331 | R | 95.1 | Very high | 89.4 | Confident | 137 Ų | 137 | 108.7 Ų | 108.7 | 52% | 0.517 | 54% | 0.54 | S | S | . | . | H | α-helix | trans | -65 | -28.2 | 172.4 | -80.8 | 175.9 | 174 | 151.1 | 3.7 | 114 | Q327 R329 R335 | Q327-R331 VanDerWaalsContact O-CB 3.25Å; Q327-R331 WeakPolarHBondContact O-CB 3.18Å; Q327-R331 WeakPolarHBondContact O-CG 3.31Å; Q327-R331 PolarHBondContact O-N 2.91Å; Q327-R331 VanDerWaalsContact OE1-CZ 3.3Å; R329-R331 VanDerWaalsContact C-N 3.31Å; R329-R331 PolarHBondContact O-N 3.29Å; R331-R335 WeakPolarHBondContact O-CB 3.46Å; R331-R335 VanDerWaalsContact O-CG 3.25Å; R331-R335 WeakPolarHBondContact O-CG 3.33Å; R331-R335 PolarHBondContact O-N 3.28Å |
| 332 | K | 95.6 | Very high | 87.3 | Confident | 159 Ų | 159 | 108.5 Ų | 108.5 | 69% | 0.691 | 55% | 0.551 | S | S | * | * | H | α-helix | trans | -77.2 | -42.4 | 172.6 | -72.9 | 175.5 | 178 | -173.3 | 0 | 110.9 | R328 R329 L330 R335 A336 | R328-K332 WeakPolarHBondContact O-CG 3.41Å; R328-K332 PolarHBondContact O-N 3.29Å; R329-K332 WeakPolarHBondContact O-CA 3.44Å; R329-K332 WeakPolarHBondContact O-CB 3.49Å; R329-K332 PolarHBondContact O-N 3.43Å; L330-K332 VanDerWaalsContact C-N 3.3Å; L330-K332 PolarHBondContact O-N 3Å; K332-R335 PolarHBondContact O-N 2.95Å; K332-A336 WeakPolarHBondContact O-CB 3.28Å; K332-A336 PolarHBondContact O-N 3.35Å |
| 333 | E | 94.5 | Very high | 85.1 | Confident | 82 Ų | 82 | 111.8 Ų | 111.8 | 38% | 0.383 | 57% | 0.565 | S | S | . | * | H | α-helix | trans | -59.6 | -48.1 | 176.2 | -70.1 | 164.2 | -159.9 | 0 | 0 | 111.1 | R329 L330 R335 A336 Q337 | R329-E333 WeakPolarHBondContact CD-OE1 3.46Å; R329-E333 WeakPolarHBondContact CG-OE1 3.5Å; R329-E333 IonicContact CZ-OE1 3.57Å; R329-E333 IonicContact NE-OE1 2.69Å; R329-E333 PolarHBondContact NE-OE1 2.8Å; R329-E333 IonicContact NE-OE2 2.84Å; R329-E333 IonicContact NH2-OE1 3.52Å; R329-E333 IonicContact NH2-OE2 2.67Å; R329-E333 PolarHBondContact O-N 3.38Å; L330-E333 PolarHBondContact O-N 2.9Å; E333-R335 PolarHBondContact O-N 2.87Å; E333-A336 WeakPolarHBondContact O-CB 3.34Å; E333-A336 PolarHBondContact O-N 3.27Å; E333-Q337 PolarHBondContact O-N 2.85Å |
| 334 | L | 91.8 | Very high | 83 | Confident | 87 Ų | 87 | 114.6 Ų | 114.6 | 46% | 0.455 | 58% | 0.578 | S | S | . | * | H | α-helix | trans | -60.8 | -41.6 | 175.6 | -178.4 | 64.4 | 0 | 0 | 0 | 112.8 | L330 A336 Q337 Q338 | L330-L334 WeakPolarHBondContact O-CB 3.29Å; L330-L334 PolarHBondContact O-N 3.32Å; L334-A336 VanDerWaalsContact C-N 3.35Å; L334-Q337 PolarHBondContact O-N 2.81Å; L334-Q338 VanDerWaalsContact O-CG 3.31Å; L334-Q338 WeakPolarHBondContact O-CG 3.33Å; L334-Q338 PolarHBondContact O-N 3.13Å |
| 335 | R | 92.2 | Very high | 80.5 | Confident | 185 Ų | 185 | 121.6 Ų | 121.6 | 70% | 0.698 | 60% | 0.601 | S | S | * | * | H | α-helix | trans | -67 | -35.1 | 175.6 | -78 | 176.2 | 179.4 | -170.3 | -0.9 | 112.6 | R331 K332 E333 Q337 Q338 G339 | R331-R335 WeakPolarHBondContact O-CB 3.46Å; R331-R335 VanDerWaalsContact O-CG 3.25Å; R331-R335 WeakPolarHBondContact O-CG 3.33Å; R331-R335 PolarHBondContact O-N 3.28Å; K332-R335 PolarHBondContact O-N 2.95Å; E333-R335 PolarHBondContact O-N 2.87Å; R335-Q337 VanDerWaalsContact C-N 3.34Å; R335-Q338 PolarHBondContact O-N 3.49Å; R335-G339 PolarHBondContact O-N 3.38Å |
| 336 | A | 90.4 | Very high | 78.1 | Confident | 61 Ų | 61 | 120.7 Ų | 120.7 | 50% | 0.504 | 61% | 0.612 | S | S | . | * | H | α-helix | trans | -67.2 | -36.4 | 175.6 | 0 | 0 | 0 | 0 | 0 | 111.7 | K332 E333 L334 L340 | K332-A336 WeakPolarHBondContact O-CB 3.28Å; K332-A336 PolarHBondContact O-N 3.35Å; E333-A336 WeakPolarHBondContact O-CB 3.34Å; E333-A336 PolarHBondContact O-N 3.27Å; L334-A336 VanDerWaalsContact C-N 3.35Å; A336-L340 WeakPolarHBondContact O-CD1 3.44Å; A336-L340 WeakPolarHBondContact O-CG 3.19Å |
| 337 | Q | 81.9 | Confident | 76.1 | Confident | 136 Ų | 136 | 122.7 Ų | 122.7 | 64% | 0.636 | 63% | 0.634 | S | S | * | * | H | α-helix | trans | -67.6 | -45.1 | 171.7 | -69.4 | 170.3 | -17.9 | 0 | 0 | 111.9 | E333 L334 R335 G339 L340 | E333-Q337 PolarHBondContact O-N 2.85Å; L334-Q337 PolarHBondContact O-N 2.81Å; R335-Q337 VanDerWaalsContact C-N 3.34Å; Q337-G339 VanDerWaalsContact C-N 3.3Å; Q337-G339 PolarHBondContact O-N 3.11Å; Q337-L340 PolarHBondContact O-N 2.86Å; Q337-L340 VanDerWaalsContact O-N 3.08Å |
| 338 | Q | 81.7 | Confident | 73.7 | Confident | 127 Ų | 127 | 121.2 Ų | 121.2 | 59% | 0.593 | 64% | 0.643 | S | S | * | * | H | α-helix | trans | -63.8 | -33.3 | 177.6 | -72.7 | 171.4 | -12.7 | 0 | 0 | 113 | L334 R335 L340 A341 | L334-Q338 VanDerWaalsContact O-CG 3.31Å; L334-Q338 WeakPolarHBondContact O-CG 3.33Å; L334-Q338 PolarHBondContact O-N 3.13Å; R335-Q338 PolarHBondContact O-N 3.49Å; Q338-L340 PolarHBondContact O-N 3.49Å; Q338-A341 PolarHBondContact O-N 2.92Å |
| 339 | G | 68.1 | Low | 71 | Confident | 66 Ų | 66 | 120.6 Ų | 120.6 | 68% | 0.68 | 66% | 0.656 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -74.8 | 2.1 | 173.8 | 0 | 0 | 0 | 0 | 0 | 115.2 | R335 Q337 | R335-G339 PolarHBondContact O-N 3.38Å; Q337-G339 VanDerWaalsContact C-N 3.3Å; Q337-G339 PolarHBondContact O-N 3.11Å |
| 340 | L | 60.5 | Low | 68.4 | Low | 143 Ų | 143 | 123.3 Ų | 123.3 | 75% | 0.749 | 68% | 0.678 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -112.3 | 10 | 175.6 | -70.7 | 168.8 | 0 | 0 | 0 | 112.8 | A336 Q337 Q338 | A336-L340 WeakPolarHBondContact O-CD1 3.44Å; A336-L340 WeakPolarHBondContact O-CG 3.19Å; Q337-L340 PolarHBondContact O-N 2.86Å; Q337-L340 VanDerWaalsContact O-N 3.08Å; Q338-L340 PolarHBondContact O-N 3.49Å |
| 341 | A | 49.9 | Very low | 66.3 | Low | 76 Ų | 76 | 124.9 Ų | 124.9 | 63% | 0.628 | 70% | 0.697 | S | S | * | * | P | Polyproline II helix | trans | -61.2 | 134.1 | 171.2 | 0 | 0 | 0 | 0 | 0 | 110.4 | Q338 | Q338-A341 PolarHBondContact O-N 2.92Š|
| 342 | P | 56.4 | Low | 63.8 | Low | 123 Ų | 123 | 127 Ų | 127 | 80% | 0.799 | 71% | 0.712 | S | S | * | * | P | Polyproline II helix | trans | -73.9 | 140.6 | -171.7 | 28.2 | -34.7 | 0 | 0 | 0 | 113.3 | ||
| 343 | E | 50.7 | Low | 62 | Low | 164 Ų | 164 | 124 Ų | 124 | 77% | 0.766 | 72% | 0.718 | S | S | * | * | P | Polyproline II helix | trans | -55 | 139.2 | 165.5 | -95.5 | -76.6 | 120.8 | 0 | 0 | 111.4 | R345 | E343-R345 PolarHBondContact O-N 2.94Š|
| 344 | P | 52.6 | Low | 60.2 | Low | 117 Ų | 117 | 125.3 Ų | 125.3 | 76% | 0.76 | 73% | 0.727 | S | S | * | * | trans | -72.4 | 95.9 | -176 | 29.9 | -35.1 | 0 | 0 | 0 | 111.7 | ||||
| 345 | R | 45.2 | Very low | 58.6 | Low | 237 Ų | 237 | 126.6 Ų | 126.6 | 89% | 0.894 | 74% | 0.741 | S | S | * | * | trans | -77.7 | 150.2 | 174.8 | -70.7 | -171.9 | 179.6 | 169.8 | 1.9 | 112.7 | E343 | E343-R345 PolarHBondContact O-N 2.94Š| ||
| 346 | A | 47.4 | Very low | 57 | Low | 88 Ų | 88 | 119.5 Ų | 119.5 | 73% | 0.727 | 73% | 0.726 | S | S | * | * | trans | -62.7 | 154.5 | -176.6 | 0 | 0 | 0 | 0 | 0 | 113.5 | G348 | A346-G348 PolarHBondContact O-N 2.97Š| ||
| 347 | P | 56.3 | Low | 55.7 | Low | 141 Ų | 141 | 119.3 Ų | 119.3 | 92% | 0.916 | 72% | 0.724 | S | S | * | * | trans | -70.9 | 115.4 | -176.9 | 28.5 | -35 | 0 | 0 | 0 | 111.8 | ||||
| 348 | G | 46.3 | Very low | 54.9 | Low | 61 Ų | 61 | 121.9 Ų | 121.9 | 63% | 0.629 | 73% | 0.728 | S | S | * | * | trans | -167.7 | 106.3 | 178.6 | 0 | 0 | 0 | 0 | 0 | 114.5 | A346 | A346-G348 PolarHBondContact O-N 2.97Š| ||
| 349 | T | 41.5 | Very low | 54.6 | Low | 137 Ų | 137 | 119.5 Ų | 119.5 | 84% | 0.84 | 72% | 0.723 | S | S | * | * | trans | 61.6 | 129.7 | 157 | 40.5 | 0 | 0 | 0 | 0 | 121.2 | ||||
| 350 | L | 43.1 | Very low | 55.1 | Low | 171 Ų | 171 | 121.6 Ų | 121.6 | 90% | 0.895 | 72% | 0.715 | S | S | * | * | trans | 76.5 | 130.7 | 154.4 | -61.5 | 170.9 | 0 | 0 | 0 | 119 | E352 | L350-E352 PolarHBondContact O-N 3.15Š| ||
| 351 | S | 50.9 | Low | 56.3 | Low | 125 Ų | 125 | 119.8 Ų | 119.8 | 87% | 0.874 | 70% | 0.703 | S | S | * | * | trans | -89.9 | 84.2 | 179.3 | 168 | 0 | 0 | 0 | 0 | 110.6 | ||||
| 352 | E | 43 | Very low | 57.9 | Low | 180 Ų | 180 | 122.3 Ų | 122.3 | 84% | 0.841 | 70% | 0.702 | S | S | * | * | trans | -76.3 | 149 | 152.6 | -74.9 | -154.4 | 116.7 | 0 | 0 | 109.8 | L350 D354 | L350-E352 PolarHBondContact O-N 3.15Å; E352-D354 PolarHBondContact O-N 2.89Å; E352-D354 VanDerWaalsContact O-N 3.11Å | ||
| 353 | A | 56.6 | Low | 59.5 | Low | 97 Ų | 97 | 118.8 Ų | 118.8 | 80% | 0.802 | 68% | 0.683 | S | S | * | * | trans | -74.2 | 101.9 | 175.9 | 0 | 0 | 0 | 0 | 0 | 109.5 | P355 | A353-P355 WeakPolarHBondContact O-CD 3.31Å; A353-P355 VanDerWaalsContact O-N 3.14Å | ||
| 354 | D | 57.5 | Low | 61.5 | Low | 110 Ų | 110 | 118.3 Ų | 118.3 | 59% | 0.588 | 67% | 0.674 | S | S | * | * | trans | -50.5 | 115.6 | -173.6 | -174.2 | -13 | 0 | 0 | 0 | 112 | E352 G356 A357 | E352-D354 PolarHBondContact O-N 2.89Å; E352-D354 VanDerWaalsContact O-N 3.11Å; D354-G356 PolarHBondContact O-N 2.99Å; D354-G356 VanDerWaalsContact O-N 3.15Å; D354-G356 PolarHBondContact OD1-N 2.88Å; D354-A357 HydrophobicContact CB-CB 4.45Å; D354-A357 WeakPolarHBondContact O-CB 3.46Å; D354-A357 PolarHBondContact O-N 3.38Å | ||
| 355 | P | 59.4 | Low | 63.4 | Low | 113 Ų | 113 | 120.9 Ų | 120.9 | 73% | 0.734 | 67% | 0.669 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -65.2 | -16.3 | -179.6 | 27 | -34.6 | 0 | 0 | 0 | 113.3 | A353 P359 | A353-P355 WeakPolarHBondContact O-CD 3.31Å; A353-P355 VanDerWaalsContact O-N 3.14Å; P355-P359 VanDerWaalsContact O-CD 3.28Å; P355-P359 WeakPolarHBondContact O-CD 3.39Å |
| 356 | G | 58.4 | Low | 65.8 | Low | 37 Ų | 37 | 116 Ų | 116 | 38% | 0.381 | 66% | 0.656 | S | S | . | * | T | Hydrogen-bonded Turn | trans | -72.2 | -24.9 | 171.4 | 0 | 0 | 0 | 0 | 0 | 114.1 | D354 R358 P359 | D354-G356 PolarHBondContact O-N 2.99Å; D354-G356 VanDerWaalsContact O-N 3.15Å; D354-G356 PolarHBondContact OD1-N 2.88Å; G356-R358 PolarHBondContact O-N 3.39Å; G356-P359 WeakPolarHBondContact O-CD 3.38Å |
| 357 | A | 61.5 | Low | 68.2 | Low | 56 Ų | 56 | 116.2 Ų | 116.2 | 46% | 0.463 | 65% | 0.648 | S | S | . | * | H | α-helix | trans | -68.8 | -32 | -176.5 | 0 | 0 | 0 | 0 | 0 | 113.2 | D354 E360 E361 | D354-A357 HydrophobicContact CB-CB 4.45Å; D354-A357 WeakPolarHBondContact O-CB 3.46Å; D354-A357 PolarHBondContact O-N 3.38Å; A357-E360 PolarHBondContact O-N 3Å; A357-E361 PolarHBondContact O-N 3.45Å |
| 358 | R | 66.9 | Low | 70.1 | Confident | 191 Ų | 191 | 113.2 Ų | 113.2 | 72% | 0.721 | 63% | 0.63 | S | S | * | * | H | α-helix | trans | -65.9 | -52.3 | -178.7 | -93.2 | 179.1 | 165.6 | 160.6 | -3.2 | 113.6 | G356 E360 E361 E362 | G356-R358 PolarHBondContact O-N 3.39Å; R358-E360 PolarHBondContact O-N 2.98Å; R358-E361 PolarHBondContact O-N 2.96Å; R358-E361 VanDerWaalsContact O-N 3.1Å; R358-E362 WeakPolarHBondContact O-CG 3.34Å; R358-E362 PolarHBondContact O-N 2.94Å |
| 359 | P | 74.7 | Confident | 72.5 | Confident | 76 Ų | 76 | 116.2 Ų | 116.2 | 49% | 0.494 | 63% | 0.627 | S | S | . | * | H | α-helix | trans | -58 | -33.9 | 174.1 | -27.5 | 35.5 | 0 | 0 | 0 | 113.7 | P355 G356 A363 | P355-P359 VanDerWaalsContact O-CD 3.28Å; P355-P359 WeakPolarHBondContact O-CD 3.39Å; G356-P359 WeakPolarHBondContact O-CD 3.38Å; P359-A363 VanDerWaalsContact O-CB 3.29Å; P359-A363 WeakPolarHBondContact O-CB 3.44Å; P359-A363 PolarHBondContact O-N 3.28Å |
| 360 | E | 77.8 | Confident | 75.1 | Confident | 110 Ų | 110 | 114.5 Ų | 114.5 | 51% | 0.514 | 61% | 0.608 | S | S | . | * | H | α-helix | trans | -68.2 | -41.3 | 173.1 | -77.5 | -159.1 | -153.5 | 0 | 0 | 112.6 | A357 R358 A363 R364 | A357-E360 PolarHBondContact O-N 3Å; R358-E360 PolarHBondContact O-N 2.98Å; E360-A363 PolarHBondContact O-N 3.39Å; E360-R364 WeakPolarHBondContact O-CB 3.38Å; E360-R364 WeakPolarHBondContact O-CD 3.47Å; E360-R364 WeakPolarHBondContact O-CG 3.24Å; E360-R364 PolarHBondContact O-N 3.19Å; E360-R364 IonicContact OE2-CZ 3.62Å; E360-R364 IonicContact OE2-NE 3.84Å; E360-R364 IonicContact OE2-NH2 2.66Å; E360-R364 PolarHBondContact OE2-NH2 3.46Å |
| 361 | E | 85.8 | Confident | 77.7 | Confident | 106 Ų | 106 | 110 Ų | 110 | 50% | 0.495 | 59% | 0.588 | S | S | . | * | H | α-helix | trans | -64.7 | -46.4 | 176.5 | -155.3 | -164.1 | 148.7 | 0 | 0 | 111.4 | A357 R358 A363 R364 W365 | A357-E361 PolarHBondContact O-N 3.45Å; R358-E361 PolarHBondContact O-N 2.96Å; R358-E361 VanDerWaalsContact O-N 3.1Å; E361-A363 VanDerWaalsContact C-N 3.35Å; E361-A363 PolarHBondContact O-N 2.98Å; E361-R364 WeakPolarHBondContact O-CB 3.4Å; E361-R364 PolarHBondContact O-N 2.95Å; E361-R364 VanDerWaalsContact O-N 3.14Å; E361-W365 PolarHBondContact O-N 3.3Å; E361-W365 PolarHBondContact OE1-NE1 2.94Å |
| 362 | E | 84.3 | Confident | 79.9 | Confident | 128 Ų | 128 | 107 Ų | 107 | 60% | 0.598 | 57% | 0.571 | S | S | * | * | H | α-helix | trans | -56.7 | -46.6 | 174.9 | -71.7 | 177.5 | 175 | 0 | 0 | 111.2 | R358 R364 W365 E366 | R358-E362 WeakPolarHBondContact O-CG 3.34Å; R358-E362 PolarHBondContact O-N 2.94Å; E362-R364 PolarHBondContact O-N 2.86Å; E362-W365 PolarHBondContact O-N 2.98Å; E362-E366 PolarHBondContact O-N 3.24Å |
| 363 | A | 90.4 | Very high | 82.5 | Confident | 49 Ų | 49 | 102.6 Ų | 102.6 | 41% | 0.405 | 55% | 0.55 | S | S | . | * | H | α-helix | trans | -63.9 | -36.3 | 176.3 | 0 | 0 | 0 | 0 | 0 | 113.1 | P359 E360 E361 V367 | P359-A363 VanDerWaalsContact O-CB 3.29Å; P359-A363 WeakPolarHBondContact O-CB 3.44Å; P359-A363 PolarHBondContact O-N 3.28Å; E360-A363 PolarHBondContact O-N 3.39Å; E361-A363 VanDerWaalsContact C-N 3.35Å; E361-A363 PolarHBondContact O-N 2.98Å; A363-V367 WeakPolarHBondContact O-CB 3.25Å; A363-V367 VanDerWaalsContact O-CG2 3.27Å; A363-V367 WeakPolarHBondContact O-CG2 3.33Å; A363-V367 PolarHBondContact O-N 2.69Å |
| 364 | R | 92.3 | Very high | 84.4 | Confident | 155 Ų | 155 | 102 Ų | 102 | 59% | 0.585 | 53% | 0.532 | S | S | * | . | H | α-helix | trans | -65.4 | -43.8 | 174.2 | -69.3 | 161.2 | -165.1 | -159.2 | 6.6 | 110.8 | E360 E361 E362 V367 C368 | E360-R364 WeakPolarHBondContact O-CB 3.38Å; E360-R364 WeakPolarHBondContact O-CD 3.47Å; E360-R364 WeakPolarHBondContact O-CG 3.24Å; E360-R364 PolarHBondContact O-N 3.19Å; E360-R364 IonicContact OE2-CZ 3.62Å; E360-R364 IonicContact OE2-NE 3.84Å; E360-R364 IonicContact OE2-NH2 2.66Å; E360-R364 PolarHBondContact OE2-NH2 3.46Å; E361-R364 WeakPolarHBondContact O-CB 3.4Å; E361-R364 PolarHBondContact O-N 2.95Å; E361-R364 VanDerWaalsContact O-N 3.14Å; E362-R364 PolarHBondContact O-N 2.86Å; R364-V367 PolarHBondContact O-N 3.44Å; R364-C368 PolarHBondContact O-N 3.43Å; R364-C368 PolarHBondContact O-SG 3.38Å; R364-C368 VanDerWaalsContact O-SG 3.36Å |
| 365 | W | 92.6 | Very high | 86.4 | Confident | 171 Ų | 171 | 99.6 Ų | 99.6 | 65% | 0.648 | 52% | 0.524 | S | S | * | . | H | α-helix | trans | -63.1 | -44.1 | 175.2 | -76.6 | 113.6 | 0 | 0 | 0 | 112.5 | E361 E362 V367 C368 Q369 | E361-W365 PolarHBondContact O-N 3.3Å; E361-W365 PolarHBondContact OE1-NE1 2.94Å; E362-W365 PolarHBondContact O-N 2.98Å; W365-V367 PolarHBondContact O-N 3.23Å; W365-C368 PolarHBondContact O-N 2.93Å; W365-Q369 WeakPolarHBondContact O-CB 3.31Å; W365-Q369 PolarHBondContact O-N 2.82Å |
| 366 | E | 95.8 | Very high | 88.2 | Confident | 133 Ų | 133 | 98.7 Ų | 98.7 | 62% | 0.621 | 51% | 0.513 | S | S | * | . | H | α-helix | trans | -60.6 | -43.8 | 174 | -74.9 | -165.9 | 167.8 | 0 | 0 | 112 | E362 C368 Q369 K370 | E362-E366 PolarHBondContact O-N 3.24Å; E366-C368 PolarHBondContact O-N 2.88Å; E366-Q369 PolarHBondContact O-N 3.12Å; E366-K370 WeakPolarHBondContact O-CB 3.36Å; E366-K370 VanDerWaalsContact O-CG 3.29Å; E366-K370 WeakPolarHBondContact O-CG 3.21Å; E366-K370 PolarHBondContact O-N 2.8Å |
| 367 | V | 96.4 | Very high | 90.1 | Very high | 93 Ų | 93 | 101.6 Ų | 101.6 | 56% | 0.564 | 52% | 0.519 | S | S | * | . | H | α-helix | trans | -63 | -40.8 | 176.4 | 167.2 | 0 | 0 | 0 | 0 | 111.5 | A363 R364 W365 T371 | A363-V367 WeakPolarHBondContact O-CB 3.25Å; A363-V367 VanDerWaalsContact O-CG2 3.27Å; A363-V367 WeakPolarHBondContact O-CG2 3.33Å; A363-V367 PolarHBondContact O-N 2.69Å; R364-V367 PolarHBondContact O-N 3.44Å; W365-V367 PolarHBondContact O-N 3.23Å; V367-T371 VanDerWaalsContact O-CB 3.24Å; V367-T371 WeakPolarHBondContact O-CB 3.13Å; V367-T371 PolarHBondContact O-N 3.49Å; V367-T371 PolarHBondContact O-OG1 2.93Å |
| 368 | C | 96.3 | Very high | 91.8 | Very high | 79 Ų | 79 | 104.7 Ų | 104.7 | 53% | 0.534 | 52% | 0.522 | S | S | . | . | H | α-helix | trans | -63.7 | -45.9 | 174.1 | -72.6 | 0 | 0 | 0 | 0 | 112 | R364 W365 E366 T371 A372 | R364-C368 PolarHBondContact O-N 3.43Å; R364-C368 PolarHBondContact O-SG 3.38Å; R364-C368 VanDerWaalsContact O-SG 3.36Å; W365-C368 PolarHBondContact O-N 2.93Å; E366-C368 PolarHBondContact O-N 2.88Å; C368-T371 PolarHBondContact O-N 3.24Å; C368-A372 PolarHBondContact O-N 3.15Å |
| 369 | Q | 97.6 | Very high | 93.3 | Very high | 123 Ų | 123 | 99.7 Ų | 99.7 | 58% | 0.575 | 51% | 0.507 | S | S | * | . | H | α-helix | trans | -58.7 | -50.6 | 176.1 | -173.6 | -170.8 | 16.6 | 0 | 0 | 111.4 | W365 E366 T371 A372 E373 | W365-Q369 WeakPolarHBondContact O-CB 3.31Å; W365-Q369 PolarHBondContact O-N 2.82Å; E366-Q369 PolarHBondContact O-N 3.12Å; Q369-T371 VanDerWaalsContact C-N 3.31Å; Q369-T371 PolarHBondContact O-N 2.9Å; Q369-A372 WeakPolarHBondContact O-CB 3.42Å; Q369-A372 PolarHBondContact O-N 2.98Å; Q369-A372 VanDerWaalsContact O-N 3.16Å; Q369-E373 WeakPolarHBondContact O-CB 3.42Å; Q369-E373 PolarHBondContact O-N 3.41Å |
| 370 | K | 96.8 | Very high | 94.4 | Very high | 101 Ų | 101 | 100.8 Ų | 100.8 | 44% | 0.439 | 51% | 0.506 | S | S | . | . | H | α-helix | trans | -66.6 | -32.3 | -179.6 | -67 | -71.6 | 153.7 | -161.9 | 0 | 112.1 | E366 E373 I374 | E366-K370 WeakPolarHBondContact O-CB 3.36Å; E366-K370 VanDerWaalsContact O-CG 3.29Å; E366-K370 WeakPolarHBondContact O-CG 3.21Å; E366-K370 PolarHBondContact O-N 2.8Å; K370-E373 WeakPolarHBondContact CD-OE2 3.23Å; K370-E373 WeakPolarHBondContact CE-OE2 3.44Å; K370-E373 IonicContact NZ-OE1 2.71Å; K370-E373 IonicContact NZ-OE2 3.19Å; K370-E373 PolarHBondContact NZ-OE2 3.07Å; K370-I374 VanDerWaalsContact O-CB 3.3Å; K370-I374 WeakPolarHBondContact O-CB 3.39Å; K370-I374 WeakPolarHBondContact O-CD1 3.39Å; K370-I374 WeakPolarHBondContact O-CG1 3.5Å; K370-I374 PolarHBondContact O-N 3.34Å |
| 371 | T | 96.9 | Very high | 95.4 | Very high | 78 Ų | 78 | 100.4 Ų | 100.4 | 48% | 0.479 | 51% | 0.507 | S | S | . | . | H | α-helix | trans | -67.3 | -38.5 | 172.7 | -59.9 | 0 | 0 | 0 | 0 | 111.8 | V367 C368 Q369 S375 | V367-T371 VanDerWaalsContact O-CB 3.24Å; V367-T371 WeakPolarHBondContact O-CB 3.13Å; V367-T371 PolarHBondContact O-N 3.49Å; V367-T371 PolarHBondContact O-OG1 2.93Å; C368-T371 PolarHBondContact O-N 3.24Å; Q369-T371 VanDerWaalsContact C-N 3.31Å; Q369-T371 PolarHBondContact O-N 2.9Å; T371-S375 WeakPolarHBondContact O-CB 3.1Å; T371-S375 PolarHBondContact O-N 3.33Å; T371-S375 PolarHBondContact O-OG 3.23Å |
| 372 | A | 97.1 | Very high | 96 | Very high | 62 Ų | 62 | 102.1 Ų | 102.1 | 51% | 0.512 | 51% | 0.509 | S | S | . | . | H | α-helix | trans | -67 | -45.2 | 174.1 | 0 | 0 | 0 | 0 | 0 | 111.8 | C368 Q369 S375 L376 | C368-A372 PolarHBondContact O-N 3.15Å; Q369-A372 WeakPolarHBondContact O-CB 3.42Å; Q369-A372 PolarHBondContact O-N 2.98Å; Q369-A372 VanDerWaalsContact O-N 3.16Å; A372-S375 WeakPolarHBondContact O-CA 3.46Å; A372-S375 WeakPolarHBondContact O-CB 3.26Å; A372-S375 PolarHBondContact O-N 2.95Å; A372-L376 PolarHBondContact O-N 3.19Å |
| 373 | E | 97.5 | Very high | 96.6 | Very high | 86 Ų | 86 | 100.2 Ų | 100.2 | 40% | 0.402 | 50% | 0.5 | S | S | . | . | H | α-helix | trans | -59.2 | -47.4 | 175.6 | -173.3 | 179.5 | 169.4 | 0 | 0 | 112 | Q369 K370 S375 L376 L377 | Q369-E373 WeakPolarHBondContact O-CB 3.42Å; Q369-E373 PolarHBondContact O-N 3.41Å; K370-E373 WeakPolarHBondContact CD-OE2 3.23Å; K370-E373 WeakPolarHBondContact CE-OE2 3.44Å; K370-E373 IonicContact NZ-OE1 2.71Å; K370-E373 IonicContact NZ-OE2 3.19Å; K370-E373 PolarHBondContact NZ-OE2 3.07Å; E373-S375 PolarHBondContact O-N 2.88Å; E373-L376 PolarHBondContact O-N 3.48Å; E373-L377 HydrophobicContact CG-CD1 4.35Å; E373-L377 WeakPolarHBondContact O-CG 3.48Å; E373-L377 PolarHBondContact O-N 2.96Å |
| 374 | I | 97.2 | Very high | 96.9 | Very high | 84 Ų | 84 | 100.3 Ų | 100.3 | 43% | 0.431 | 50% | 0.501 | S | S | . | . | H | α-helix | trans | -60.6 | -33.9 | 173 | -72.2 | 166.1 | 0 | 0 | 0 | 111.6 | K370 K378 | K370-I374 VanDerWaalsContact O-CB 3.3Å; K370-I374 WeakPolarHBondContact O-CB 3.39Å; K370-I374 WeakPolarHBondContact O-CD1 3.39Å; K370-I374 WeakPolarHBondContact O-CG1 3.5Å; K370-I374 PolarHBondContact O-N 3.34Å; I374-K378 HydrophobicContact CG2-CD 4Å; I374-K378 VanDerWaalsContact CG2-CE 3.44Å; I374-K378 VanDerWaalsContact O-CB 3.31Å; I374-K378 WeakPolarHBondContact O-CB 3.46Å; I374-K378 WeakPolarHBondContact O-CD 3.45Å; I374-K378 WeakPolarHBondContact O-CG 3.31Å; I374-K378 PolarHBondContact O-N 2.88Å |
| 375 | S | 97.8 | Very high | 97.1 | Very high | 60 Ų | 60 | 98.3 Ų | 98.3 | 42% | 0.42 | 50% | 0.498 | S | S | . | . | H | α-helix | trans | -72.6 | -38.9 | 178.6 | -60.7 | 0 | 0 | 0 | 0 | 112.3 | T371 A372 E373 K378 Q379 | T371-S375 WeakPolarHBondContact O-CB 3.1Å; T371-S375 PolarHBondContact O-N 3.33Å; T371-S375 PolarHBondContact O-OG 3.23Å; A372-S375 WeakPolarHBondContact O-CA 3.46Å; A372-S375 WeakPolarHBondContact O-CB 3.26Å; A372-S375 PolarHBondContact O-N 2.95Å; E373-S375 PolarHBondContact O-N 2.88Å; S375-K378 PolarHBondContact O-N 3.06Å; S375-Q379 PolarHBondContact O-N 3.29Å |
| 376 | L | 98.3 | Very high | 97.4 | Very high | 95 Ų | 95 | 93.1 Ų | 93.1 | 50% | 0.497 | 49% | 0.491 | S | S | . | . | H | α-helix | trans | -63.8 | -49 | 172.3 | 177.9 | 61.9 | 0 | 0 | 0 | 111.4 | A372 E373 K378 Q379 Q380 | A372-L376 PolarHBondContact O-N 3.19Å; E373-L376 PolarHBondContact O-N 3.48Å; L376-K378 VanDerWaalsContact C-N 3.29Å; L376-K378 PolarHBondContact O-N 3.35Å; L376-Q379 WeakPolarHBondContact O-CA 3.38Å; L376-Q379 WeakPolarHBondContact O-CB 3.46Å; L376-Q379 PolarHBondContact O-N 2.96Å; L376-Q380 HydrophobicContact CD1-CG 4.41Å; L376-Q380 PolarHBondContact O-N 3.45Å |
| 377 | L | 98.3 | Very high | 97.4 | Very high | 97 Ų | 97 | 92.7 Ų | 92.7 | 51% | 0.508 | 49% | 0.489 | S | S | . | . | H | α-helix | trans | -60.5 | -38.5 | 176.6 | -69.2 | 169.4 | 0 | 0 | 0 | 111.9 | E373 Q379 L381 | E373-L377 HydrophobicContact CG-CD1 4.35Å; E373-L377 WeakPolarHBondContact O-CG 3.48Å; E373-L377 PolarHBondContact O-N 2.96Å; L377-Q379 VanDerWaalsContact C-N 3.28Å; L377-Q379 PolarHBondContact O-N 2.88Å; L377-L381 WeakPolarHBondContact O-CB 3.4Å; L377-L381 PolarHBondContact O-N 3.44Å |
| 378 | K | 97.9 | Very high | 97.5 | Very high | 121 Ų | 121 | 93.4 Ų | 93.4 | 53% | 0.526 | 49% | 0.489 | S | S | . | . | H | α-helix | trans | -66.7 | -26.1 | 172.4 | -77.6 | 171.5 | -175.5 | 173.4 | 0 | 113.3 | I374 S375 L376 R382 | I374-K378 HydrophobicContact CG2-CD 4Å; I374-K378 VanDerWaalsContact CG2-CE 3.44Å; I374-K378 VanDerWaalsContact O-CB 3.31Å; I374-K378 WeakPolarHBondContact O-CB 3.46Å; I374-K378 WeakPolarHBondContact O-CD 3.45Å; I374-K378 WeakPolarHBondContact O-CG 3.31Å; I374-K378 PolarHBondContact O-N 2.88Å; S375-K378 PolarHBondContact O-N 3.06Å; L376-K378 VanDerWaalsContact C-N 3.29Å; L376-K378 PolarHBondContact O-N 3.35Å; K378-R382 VanDerWaalsContact C-NH2 3.34Å; K378-R382 PolarHBondContact O-NE 3.4Å; K378-R382 PolarHBondContact O-NH2 2.85Å |
| 379 | Q | 97.8 | Very high | 97.5 | Very high | 87 Ų | 87 | 92.4 Ų | 92.4 | 41% | 0.407 | 49% | 0.487 | S | S | . | . | H | α-helix | trans | -76.7 | -51 | 174.5 | 170.7 | 170.1 | -13.3 | 0 | 0 | 110.5 | S375 L376 L377 L381 R382 E383 | S375-Q379 PolarHBondContact O-N 3.29Å; L376-Q379 WeakPolarHBondContact O-CA 3.38Å; L376-Q379 WeakPolarHBondContact O-CB 3.46Å; L376-Q379 PolarHBondContact O-N 2.96Å; L377-Q379 VanDerWaalsContact C-N 3.28Å; L377-Q379 PolarHBondContact O-N 2.88Å; Q379-L381 PolarHBondContact O-N 3.45Å; Q379-R382 WeakPolarHBondContact O-CA 3.42Å; Q379-R382 WeakPolarHBondContact O-CB 3.31Å; Q379-R382 PolarHBondContact O-N 2.86Å; Q379-E383 HydrophobicContact CG-CG 4.4Å; Q379-E383 WeakPolarHBondContact CG-OE1 3.25Å; Q379-E383 PolarHBondContact NE2-OE1 3.41Å; Q379-E383 PolarHBondContact O-N 3.42Å |
| 380 | Q | 98.1 | Very high | 97.6 | Very high | 99 Ų | 99 | 92.4 Ų | 92.4 | 46% | 0.463 | 49% | 0.487 | S | S | . | . | H | α-helix | trans | -56.7 | -38 | 176.5 | -68.7 | 174.6 | -38.3 | 0 | 0 | 112.3 | L376 R382 E383 A384 | L376-Q380 HydrophobicContact CD1-CG 4.41Å; L376-Q380 PolarHBondContact O-N 3.45Å; Q380-R382 PolarHBondContact O-N 3.01Å; Q380-E383 WeakPolarHBondContact CA-OE2 3.3Å; Q380-E383 PolarHBondContact O-N 3.29Å; Q380-A384 WeakPolarHBondContact O-CB 3.28Å; Q380-A384 PolarHBondContact O-N 3.39Å |
| 381 | L | 97.9 | Very high | 97.5 | Very high | 102 Ų | 102 | 92.7 Ų | 92.7 | 53% | 0.534 | 49% | 0.488 | S | S | . | . | H | α-helix | trans | -63.9 | -37 | 173.3 | -179.5 | 61.1 | 0 | 0 | 0 | 113 | L377 Q379 Q385 | L377-L381 WeakPolarHBondContact O-CB 3.4Å; L377-L381 PolarHBondContact O-N 3.44Å; Q379-L381 PolarHBondContact O-N 3.45Å; L381-Q385 WeakPolarHBondContact O-CB 3.43Å; L381-Q385 WeakPolarHBondContact O-CG 3.41Å; L381-Q385 PolarHBondContact O-N 2.74Å; L381-Q385 VanDerWaalsContact O-N 3.08Å |
| 382 | R | 98.2 | Very high | 97.6 | Very high | 142 Ų | 142 | 93 Ų | 93 | 54% | 0.536 | 49% | 0.487 | S | S | . | . | H | α-helix | trans | -72 | -37.4 | 176.1 | -81.9 | 176.4 | -87.1 | 118.7 | -5.7 | 111.8 | K378 Q379 Q380 Q385 A386 | K378-R382 VanDerWaalsContact C-NH2 3.34Å; K378-R382 PolarHBondContact O-NE 3.4Å; K378-R382 PolarHBondContact O-NH2 2.85Å; Q379-R382 WeakPolarHBondContact O-CA 3.42Å; Q379-R382 WeakPolarHBondContact O-CB 3.31Å; Q379-R382 PolarHBondContact O-N 2.86Å; Q380-R382 PolarHBondContact O-N 3.01Å; R382-Q385 PolarHBondContact O-N 3.21Å; R382-A386 PolarHBondContact O-N 3.12Å |
| 383 | E | 97.8 | Very high | 97.5 | Very high | 88 Ų | 88 | 93 Ų | 93 | 41% | 0.411 | 49% | 0.486 | S | S | . | . | H | α-helix | trans | -65 | -50.5 | 175.7 | -71 | 159.8 | 170.5 | 0 | 0 | 110.5 | Q379 Q380 Q385 A386 E387 | Q379-E383 HydrophobicContact CG-CG 4.4Å; Q379-E383 WeakPolarHBondContact CG-OE1 3.25Å; Q379-E383 PolarHBondContact NE2-OE1 3.41Å; Q379-E383 PolarHBondContact O-N 3.42Å; Q380-E383 WeakPolarHBondContact CA-OE2 3.3Å; Q380-E383 PolarHBondContact O-N 3.29Å; E383-Q385 VanDerWaalsContact C-N 3.29Å; E383-Q385 PolarHBondContact O-N 3.05Å; E383-A386 WeakPolarHBondContact O-CB 3.45Å; E383-A386 PolarHBondContact O-N 2.94Å; E383-E387 PolarHBondContact O-N 2.82Å |
| 384 | A | 96.3 | Very high | 97.6 | Very high | 51 Ų | 51 | 92.7 Ų | 92.7 | 42% | 0.421 | 49% | 0.485 | S | S | . | . | H | α-helix | trans | -60.9 | -32.9 | 174.8 | 0 | 0 | 0 | 0 | 0 | 113.6 | Q380 L388 | Q380-A384 WeakPolarHBondContact O-CB 3.28Å; Q380-A384 PolarHBondContact O-N 3.39Å; A384-L388 WeakPolarHBondContact O-CB 3.35Å; A384-L388 PolarHBondContact O-N 3.34Å |
| 385 | Q | 97.4 | Very high | 97.5 | Very high | 112 Ų | 112 | 93.3 Ų | 93.3 | 52% | 0.523 | 49% | 0.488 | S | S | . | . | H | α-helix | trans | -68.4 | -37.5 | 172.4 | -78.5 | 171.3 | -0.9 | 0 | 0 | 112.5 | L381 R382 E383 A389 | L381-Q385 WeakPolarHBondContact O-CB 3.43Å; L381-Q385 WeakPolarHBondContact O-CG 3.41Å; L381-Q385 PolarHBondContact O-N 2.74Å; L381-Q385 VanDerWaalsContact O-N 3.08Å; R382-Q385 PolarHBondContact O-N 3.21Å; E383-Q385 VanDerWaalsContact C-N 3.29Å; E383-Q385 PolarHBondContact O-N 3.05Å; Q385-A389 PolarHBondContact O-N 3.3Å; Q385-A389 VanDerWaalsContact O-N 3.07Å |
| 386 | A | 97.1 | Very high | 97.6 | Very high | 62 Ų | 62 | 96.7 Ų | 96.7 | 51% | 0.512 | 50% | 0.495 | S | S | . | . | H | α-helix | trans | -69.2 | -42.3 | 175 | 0 | 0 | 0 | 0 | 0 | 111.8 | R382 E383 L388 A389 Q390 | R382-A386 PolarHBondContact O-N 3.12Å; E383-A386 WeakPolarHBondContact O-CB 3.45Å; E383-A386 PolarHBondContact O-N 2.94Å; A386-L388 PolarHBondContact O-N 3.3Å; A386-A389 PolarHBondContact O-N 2.87Å; A386-Q390 PolarHBondContact O-N 2.89Å |
| 387 | E | 97.4 | Very high | 97.5 | Very high | 124 Ų | 124 | 94.9 Ų | 94.9 | 58% | 0.579 | 49% | 0.49 | S | S | * | . | H | α-helix | trans | -59.5 | -44.5 | 173.3 | -71.9 | 178.8 | -177 | 0 | 0 | 111.8 | E383 A389 Q390 K391 | E383-E387 PolarHBondContact O-N 2.82Å; E387-A389 VanDerWaalsContact C-N 3.34Å; E387-A389 PolarHBondContact O-N 3.21Å; E387-Q390 PolarHBondContact O-N 3.2Å; E387-K391 WeakPolarHBondContact O-CB 3.33Å; E387-K391 VanDerWaalsContact O-CG 3.31Å; E387-K391 WeakPolarHBondContact O-CG 3.31Å; E387-K391 PolarHBondContact O-N 3.4Å |
| 388 | L | 98.1 | Very high | 97.4 | Very high | 108 Ų | 108 | 94.9 Ų | 94.9 | 57% | 0.565 | 49% | 0.491 | S | S | * | . | H | α-helix | trans | -61 | -42.2 | 175.2 | 178.7 | 60.3 | 0 | 0 | 0 | 111.8 | A384 A386 K391 L392 | A384-L388 WeakPolarHBondContact O-CB 3.35Å; A384-L388 PolarHBondContact O-N 3.34Å; A386-L388 PolarHBondContact O-N 3.3Å; L388-K391 PolarHBondContact O-N 2.92Å; L388-L392 HydrophobicContact CD1-CD1 4.36Å; L388-L392 HydrophobicContact CD1-CG 4.36Å; L388-L392 HydrophobicContact CG-CD1 4.22Å; L388-L392 WeakPolarHBondContact O-CB 3.49Å; L388-L392 VanDerWaalsContact O-CG 3.29Å; L388-L392 WeakPolarHBondContact O-CG 3.46Å; L388-L392 PolarHBondContact O-N 3.3Å |
| 389 | A | 97.1 | Very high | 97.4 | Very high | 59 Ų | 59 | 94 Ų | 94 | 49% | 0.488 | 49% | 0.487 | S | S | . | . | H | α-helix | trans | -63.6 | -41.7 | 175.9 | 0 | 0 | 0 | 0 | 0 | 112.1 | Q385 A386 E387 L392 A393 | Q385-A389 PolarHBondContact O-N 3.3Å; Q385-A389 VanDerWaalsContact O-N 3.07Å; A386-A389 PolarHBondContact O-N 2.87Å; E387-A389 VanDerWaalsContact C-N 3.34Å; E387-A389 PolarHBondContact O-N 3.21Å; A389-L392 PolarHBondContact O-N 3.09Å; A389-A393 PolarHBondContact O-N 3.25Å |
| 390 | Q | 97.8 | Very high | 97.3 | Very high | 123 Ų | 123 | 94.2 Ų | 94.2 | 58% | 0.575 | 49% | 0.494 | S | S | * | . | H | α-helix | trans | -62.4 | -46.2 | 174.3 | -178.3 | -179.4 | -7.6 | 0 | 0 | 111.6 | A386 E387 L392 A393 E394 | A386-Q390 PolarHBondContact O-N 2.89Å; E387-Q390 PolarHBondContact O-N 3.2Å; Q390-L392 VanDerWaalsContact C-N 3.34Å; Q390-L392 PolarHBondContact O-N 2.68Å; Q390-A393 WeakPolarHBondContact O-CB 3.44Å; Q390-A393 PolarHBondContact O-N 2.97Å; Q390-E394 WeakPolarHBondContact O-CB 3.46Å; Q390-E394 PolarHBondContact O-N 3Å |
| 391 | K | 96.1 | Very high | 97.2 | Very high | 107 Ų | 107 | 95.3 Ų | 95.3 | 47% | 0.465 | 50% | 0.499 | S | S | . | . | H | α-helix | trans | -65.6 | -35.1 | 178.9 | -69.5 | -72.8 | 147.8 | -163.1 | 0 | 112.3 | E387 L388 E394 I395 | E387-K391 WeakPolarHBondContact O-CB 3.33Å; E387-K391 VanDerWaalsContact O-CG 3.31Å; E387-K391 WeakPolarHBondContact O-CG 3.31Å; E387-K391 PolarHBondContact O-N 3.4Å; L388-K391 PolarHBondContact O-N 2.92Å; K391-E394 WeakPolarHBondContact CD-OE2 3.22Å; K391-E394 WeakPolarHBondContact CE-OE2 3.4Å; K391-E394 IonicContact NZ-OE1 3.59Å; K391-E394 PolarHBondContact NZ-OE1 2.93Å; K391-E394 IonicContact NZ-OE2 3.68Å; K391-E394 PolarHBondContact NZ-OE2 3.3Å; K391-E394 PolarHBondContact O-N 3.31Å; K391-I395 WeakPolarHBondContact O-CD1 3.27Å; K391-I395 VanDerWaalsContact O-CG1 3.25Å; K391-I395 WeakPolarHBondContact O-CG1 3.4Å; K391-I395 PolarHBondContact O-N 2.94Å |
| 392 | L | 97.9 | Very high | 97.2 | Very high | 85 Ų | 85 | 96.4 Ų | 96.4 | 45% | 0.445 | 51% | 0.505 | S | S | . | . | H | α-helix | trans | -64.2 | -44.3 | 170.9 | -73.7 | 169 | 0 | 0 | 0 | 111.8 | L388 A389 Q390 E394 I395 F396 | L388-L392 HydrophobicContact CD1-CD1 4.36Å; L388-L392 HydrophobicContact CD1-CG 4.36Å; L388-L392 HydrophobicContact CG-CD1 4.22Å; L388-L392 WeakPolarHBondContact O-CB 3.49Å; L388-L392 VanDerWaalsContact O-CG 3.29Å; L388-L392 WeakPolarHBondContact O-CG 3.46Å; L388-L392 PolarHBondContact O-N 3.3Å; A389-L392 PolarHBondContact O-N 3.09Å; Q390-L392 VanDerWaalsContact C-N 3.34Å; Q390-L392 PolarHBondContact O-N 2.68Å; L392-E394 VanDerWaalsContact C-N 3.34Å; L392-E394 PolarHBondContact O-N 3.42Å; L392-I395 PolarHBondContact O-N 3.21Å; L392-F396 WeakPolarHBondContact O-CD2 3.44Å; L392-F396 PolarHBondContact O-N 3.44Å |
| 393 | A | 96.7 | Very high | 97.1 | Very high | 60 Ų | 60 | 98 Ų | 98 | 50% | 0.496 | 51% | 0.511 | S | S | . | . | H | α-helix | trans | -62.1 | -40.5 | 176.4 | 0 | 0 | 0 | 0 | 0 | 112.5 | A389 Q390 F396 S397 | A389-A393 PolarHBondContact O-N 3.25Å; Q390-A393 WeakPolarHBondContact O-CB 3.44Å; Q390-A393 PolarHBondContact O-N 2.97Å; A393-F396 PolarHBondContact O-N 2.97Å; A393-S397 PolarHBondContact O-N 3.11Å |
| 394 | E | 97.8 | Very high | 97.1 | Very high | 80 Ų | 80 | 95.4 Ų | 95.4 | 37% | 0.374 | 51% | 0.508 | S | S | . | . | H | α-helix | trans | -63.9 | -40.8 | 174.5 | -168 | 178.6 | -115.7 | 0 | 0 | 112 | Q390 K391 L392 F396 S397 L398 | Q390-E394 WeakPolarHBondContact O-CB 3.46Å; Q390-E394 PolarHBondContact O-N 3Å; K391-E394 WeakPolarHBondContact CD-OE2 3.22Å; K391-E394 WeakPolarHBondContact CE-OE2 3.4Å; K391-E394 IonicContact NZ-OE1 3.59Å; K391-E394 PolarHBondContact NZ-OE1 2.93Å; K391-E394 IonicContact NZ-OE2 3.68Å; K391-E394 PolarHBondContact NZ-OE2 3.3Å; K391-E394 PolarHBondContact O-N 3.31Å; L392-E394 VanDerWaalsContact C-N 3.34Å; L392-E394 PolarHBondContact O-N 3.42Å; E394-F396 VanDerWaalsContact C-N 3.32Å; E394-F396 PolarHBondContact O-N 3.2Å; E394-S397 PolarHBondContact O-N 2.97Å; E394-S397 PolarHBondContact O-OG 3.46Å; E394-L398 HydrophobicContact CG-CD1 4.26Å; E394-L398 WeakPolarHBondContact O-CB 3.32Å; E394-L398 VanDerWaalsContact O-CG 3.26Å; E394-L398 WeakPolarHBondContact O-CG 3.49Å; E394-L398 PolarHBondContact O-N 3.03Å |
| 395 | I | 96.8 | Very high | 96.9 | Very high | 98 Ų | 98 | 96.2 Ų | 96.2 | 50% | 0.503 | 51% | 0.511 | S | S | . | . | H | α-helix | trans | -62.9 | -38.6 | 171.6 | -70.8 | 163.5 | 0 | 0 | 0 | 111.2 | K391 L392 K399 | K391-I395 WeakPolarHBondContact O-CD1 3.27Å; K391-I395 VanDerWaalsContact O-CG1 3.25Å; K391-I395 WeakPolarHBondContact O-CG1 3.4Å; K391-I395 PolarHBondContact O-N 2.94Å; L392-I395 PolarHBondContact O-N 3.21Å; I395-K399 WeakPolarHBondContact O-CB 3.46Å; I395-K399 PolarHBondContact O-N 2.92Å |
| 396 | F | 98.2 | Very high | 96.9 | Very high | 130 Ų | 130 | 99.1 Ų | 99.1 | 57% | 0.57 | 52% | 0.517 | S | S | * | . | H | α-helix | trans | -68.4 | -38.9 | 176.8 | -80.3 | -65.9 | 0 | 0 | 0 | 113.2 | L392 A393 E394 T400 | L392-F396 WeakPolarHBondContact O-CD2 3.44Å; L392-F396 PolarHBondContact O-N 3.44Å; A393-F396 PolarHBondContact O-N 2.97Å; E394-F396 VanDerWaalsContact C-N 3.32Å; E394-F396 PolarHBondContact O-N 3.2Å; F396-T400 WeakPolarHBondContact O-CB 3.32Å; F396-T400 PolarHBondContact O-N 3.33Å; F396-T400 VanDerWaalsContact O-N 3.12Å; F396-T400 PolarHBondContact O-OG1 3.05Å |
| 397 | S | 96.8 | Very high | 96.9 | Very high | 57 Ų | 57 | 98.9 Ų | 98.9 | 40% | 0.399 | 52% | 0.515 | S | S | . | . | H | α-helix | trans | -68.4 | -47.2 | 175.7 | 62.7 | 0 | 0 | 0 | 0 | 111.5 | A393 E394 K399 T400 Q401 | A393-S397 PolarHBondContact O-N 3.11Å; E394-S397 PolarHBondContact O-N 2.97Å; E394-S397 PolarHBondContact O-OG 3.46Å; S397-K399 VanDerWaalsContact C-N 3.35Å; S397-K399 PolarHBondContact O-N 3.34Å; S397-T400 WeakPolarHBondContact O-CA 3.2Å; S397-T400 WeakPolarHBondContact O-CB 3.47Å; S397-T400 PolarHBondContact O-N 2.89Å; S397-Q401 WeakPolarHBondContact O-CG 3.36Å; S397-Q401 PolarHBondContact O-N 2.93Å |
| 398 | L | 97.1 | Very high | 96.9 | Very high | 98 Ų | 98 | 99 Ų | 99 | 51% | 0.513 | 52% | 0.515 | S | S | . | . | H | α-helix | trans | -58.9 | -42.7 | 175.4 | -70.6 | 169.3 | 0 | 0 | 0 | 112.2 | E394 T400 Q401 L402 | E394-L398 HydrophobicContact CG-CD1 4.26Å; E394-L398 WeakPolarHBondContact O-CB 3.32Å; E394-L398 VanDerWaalsContact O-CG 3.26Å; E394-L398 WeakPolarHBondContact O-CG 3.49Å; E394-L398 PolarHBondContact O-N 3.03Å; L398-T400 PolarHBondContact O-N 3.35Å; L398-Q401 PolarHBondContact O-N 2.87Å; L398-L402 WeakPolarHBondContact O-CB 3.33Å; L398-L402 PolarHBondContact O-N 3.07Å |
| 399 | K | 97.2 | Very high | 96.6 | Very high | 102 Ų | 102 | 95.8 Ų | 95.8 | 44% | 0.443 | 50% | 0.504 | S | S | . | . | H | α-helix | trans | -64.8 | -24.8 | 175.2 | -175.3 | 173.6 | -175.5 | 173.2 | 0 | 113.1 | I395 S397 R403 | I395-K399 WeakPolarHBondContact O-CB 3.46Å; I395-K399 PolarHBondContact O-N 2.92Å; S397-K399 VanDerWaalsContact C-N 3.35Å; S397-K399 PolarHBondContact O-N 3.34Å; K399-R403 WeakPolarHBondContact O-CD 3.45Å; K399-R403 WeakPolarHBondContact O-CG 3.44Å |
| 400 | T | 96.4 | Very high | 96.5 | Very high | 91 Ų | 91 | 98.2 Ų | 98.2 | 56% | 0.558 | 51% | 0.506 | S | S | * | . | H | α-helix | trans | -82.6 | -43.3 | 175.8 | -57.3 | 0 | 0 | 0 | 0 | 110.9 | F396 S397 L398 R403 G404 | F396-T400 WeakPolarHBondContact O-CB 3.32Å; F396-T400 PolarHBondContact O-N 3.33Å; F396-T400 VanDerWaalsContact O-N 3.12Å; F396-T400 PolarHBondContact O-OG1 3.05Å; S397-T400 WeakPolarHBondContact O-CA 3.2Å; S397-T400 WeakPolarHBondContact O-CB 3.47Å; S397-T400 PolarHBondContact O-N 2.89Å; L398-T400 PolarHBondContact O-N 3.35Å; T400-R403 WeakPolarHBondContact O-CB 3.07Å; T400-R403 PolarHBondContact O-N 2.93Å; T400-G404 PolarHBondContact O-N 3.41Å |
| 401 | Q | 95.8 | Very high | 96.4 | Very high | 122 Ų | 122 | 95.3 Ų | 95.3 | 57% | 0.57 | 50% | 0.503 | S | S | * | . | H | α-helix | trans | -57.9 | -48.6 | 171.7 | -70.7 | 172.4 | -15.5 | 0 | 0 | 111.6 | S397 L398 R403 G404 S405 | S397-Q401 WeakPolarHBondContact O-CG 3.36Å; S397-Q401 PolarHBondContact O-N 2.93Å; L398-Q401 PolarHBondContact O-N 2.87Å; Q401-R403 PolarHBondContact O-N 3.37Å; Q401-G404 CarbonylContact O-C 3.6Å; Q401-G404 WeakPolarHBondContact O-CA 3.31Å; Q401-G404 PolarHBondContact O-N 3.48Å; Q401-S405 PolarHBondContact O-N 3.19Å; Q401-S405 PolarHBondContact O-OG 3.4Å |
| 402 | L | 96.9 | Very high | 96.3 | Very high | 126 Ų | 126 | 96.4 Ų | 96.4 | 66% | 0.66 | 51% | 0.509 | S | S | * | . | H | α-helix | trans | -57.7 | -34 | 177.2 | -178.2 | 63.4 | 0 | 0 | 0 | 113 | L398 R406 | L398-L402 WeakPolarHBondContact O-CB 3.33Å; L398-L402 PolarHBondContact O-N 3.07Å; L402-R406 VanDerWaalsContact O-CB 3.27Å; L402-R406 WeakPolarHBondContact O-CB 3.5Å; L402-R406 PolarHBondContact O-N 2.92Å |
| 403 | R | 96.7 | Very high | 96.3 | Very high | 174 Ų | 174 | 96.9 Ų | 96.9 | 66% | 0.657 | 51% | 0.512 | S | S | * | . | H | α-helix | trans | -70.1 | -41 | 173.1 | -76.1 | 169.7 | 167 | -169.3 | -6.1 | 111.9 | K399 T400 Q401 A407 | K399-R403 WeakPolarHBondContact O-CD 3.45Å; K399-R403 WeakPolarHBondContact O-CG 3.44Å; T400-R403 WeakPolarHBondContact O-CB 3.07Å; T400-R403 PolarHBondContact O-N 2.93Å; Q401-R403 PolarHBondContact O-N 3.37Å; R403-A407 WeakPolarHBondContact O-CB 3.5Å; R403-A407 PolarHBondContact O-N 3.07Å |
| 404 | G | 96.9 | Very high | 96.3 | Very high | 34 Ų | 34 | 97 Ų | 97 | 35% | 0.351 | 51% | 0.513 | S | S | . | . | H | α-helix | trans | -60.2 | -54.2 | 174.1 | 0 | 0 | 0 | 0 | 0 | 112 | T400 Q401 R406 A407 Q408 | T400-G404 PolarHBondContact O-N 3.41Å; Q401-G404 CarbonylContact O-C 3.6Å; Q401-G404 WeakPolarHBondContact O-CA 3.31Å; Q401-G404 PolarHBondContact O-N 3.48Å; G404-R406 VanDerWaalsContact C-N 3.3Å; G404-R406 PolarHBondContact O-N 3.37Å; G404-A407 PolarHBondContact O-N 3.01Å; G404-A407 VanDerWaalsContact O-N 3.07Å; G404-Q408 WeakPolarHBondContact O-CG 3.24Å; G404-Q408 PolarHBondContact O-N 2.96Å |
| 405 | S | 93.9 | Very high | 96.2 | Very high | 68 Ų | 68 | 97.9 Ų | 97.9 | 48% | 0.476 | 52% | 0.517 | S | S | . | . | H | α-helix | trans | -60.8 | -36.8 | 178.4 | -53.7 | 0 | 0 | 0 | 0 | 112.7 | Q401 Q408 A409 | Q401-S405 PolarHBondContact O-N 3.19Å; Q401-S405 PolarHBondContact O-OG 3.4Å; S405-Q408 PolarHBondContact O-N 3.21Å; S405-A409 PolarHBondContact O-N 3.49Å |
| 406 | R | 97.1 | Very high | 96.2 | Very high | 174 Ų | 174 | 97.4 Ų | 97.4 | 66% | 0.657 | 52% | 0.515 | S | S | * | . | H | α-helix | trans | -65.4 | -40.7 | 173.3 | -175.5 | 174 | -177.5 | 153.7 | 7.6 | 112.4 | L402 G404 Q408 A409 Q410 | L402-R406 VanDerWaalsContact O-CB 3.27Å; L402-R406 WeakPolarHBondContact O-CB 3.5Å; L402-R406 PolarHBondContact O-N 2.92Å; G404-R406 VanDerWaalsContact C-N 3.3Å; G404-R406 PolarHBondContact O-N 3.37Å; R406-Q408 VanDerWaalsContact C-N 3.34Å; R406-A409 PolarHBondContact O-N 2.96Å; R406-Q410 WeakPolarHBondContact O-CB 3.47Å; R406-Q410 VanDerWaalsContact O-CG 3.28Å; R406-Q410 WeakPolarHBondContact O-CG 3.38Å; R406-Q410 PolarHBondContact O-N 3.07Å |
| 407 | A | 96.4 | Very high | 96.1 | Very high | 56 Ų | 56 | 94.6 Ų | 94.6 | 46% | 0.463 | 51% | 0.509 | S | S | . | . | H | α-helix | trans | -67.2 | -36.2 | 176.1 | 0 | 0 | 0 | 0 | 0 | 112 | R403 G404 Q410 A411 | R403-A407 WeakPolarHBondContact O-CB 3.5Å; R403-A407 PolarHBondContact O-N 3.07Å; G404-A407 PolarHBondContact O-N 3.01Å; G404-A407 VanDerWaalsContact O-N 3.07Å; A407-Q410 PolarHBondContact O-N 3.33Å; A407-A411 PolarHBondContact O-N 2.9Å |
| 408 | Q | 96.6 | Very high | 96.1 | Very high | 126 Ų | 126 | 98.1 Ų | 98.1 | 59% | 0.589 | 51% | 0.513 | S | S | * | . | H | α-helix | trans | -63.9 | -47.7 | 173.8 | -71.6 | 170.4 | -40.9 | 0 | 0 | 111.8 | G404 S405 R406 Q410 A411 Q412 | G404-Q408 WeakPolarHBondContact O-CG 3.24Å; G404-Q408 PolarHBondContact O-N 2.96Å; S405-Q408 PolarHBondContact O-N 3.21Å; R406-Q408 VanDerWaalsContact C-N 3.34Å; Q408-Q410 PolarHBondContact O-N 2.78Å; Q408-A411 WeakPolarHBondContact O-CB 3.47Å; Q408-A411 PolarHBondContact O-N 3.1Å; Q408-Q412 WeakPolarHBondContact O-CG 3.24Å; Q408-Q412 PolarHBondContact O-N 3.05Å |
| 409 | A | 91.7 | Very high | 96.1 | Very high | 41 Ų | 41 | 97.2 Ų | 97.2 | 34% | 0.339 | 51% | 0.509 | S | S | . | . | H | α-helix | trans | -58.1 | -46.8 | 174.7 | 0 | 0 | 0 | 0 | 0 | 111.6 | S405 R406 A411 Q412 D413 | S405-A409 PolarHBondContact O-N 3.49Å; R406-A409 PolarHBondContact O-N 2.96Å; A409-A411 VanDerWaalsContact C-N 3.26Å; A409-A411 PolarHBondContact O-N 2.85Å; A409-Q412 CarbonylContact O-C 3.49Å; A409-Q412 WeakPolarHBondContact O-CB 3.28Å; A409-Q412 PolarHBondContact O-N 3.01Å; A409-D413 VanDerWaalsContact O-CG 3.3Å; A409-D413 PolarHBondContact O-N 3.09Å |
| 410 | Q | 96.6 | Very high | 96 | Very high | 111 Ų | 111 | 100.4 Ų | 100.4 | 52% | 0.519 | 52% | 0.518 | S | S | . | . | H | α-helix | trans | -63.7 | -28.1 | 177.9 | -71.3 | -178.7 | -56.3 | 0 | 0 | 113.8 | R406 A407 Q408 A414 | R406-Q410 WeakPolarHBondContact O-CB 3.47Å; R406-Q410 VanDerWaalsContact O-CG 3.28Å; R406-Q410 WeakPolarHBondContact O-CG 3.38Å; R406-Q410 PolarHBondContact O-N 3.07Å; A407-Q410 PolarHBondContact O-N 3.33Å; Q408-Q410 PolarHBondContact O-N 2.78Å; Q410-A414 WeakPolarHBondContact O-CB 3.27Å; Q410-A414 PolarHBondContact O-N 2.94Å |
| 411 | A | 95.3 | Very high | 95.9 | Very high | 62 Ų | 62 | 101.3 Ų | 101.3 | 51% | 0.512 | 52% | 0.515 | S | S | . | . | H | α-helix | trans | -72.8 | -40.3 | 171.8 | 0 | 0 | 0 | 0 | 0 | 111.8 | A407 Q408 A409 A414 E415 | A407-A411 PolarHBondContact O-N 2.9Å; Q408-A411 WeakPolarHBondContact O-CB 3.47Å; Q408-A411 PolarHBondContact O-N 3.1Å; A409-A411 VanDerWaalsContact C-N 3.26Å; A409-A411 PolarHBondContact O-N 2.85Å; A411-A414 PolarHBondContact O-N 3.28Å; A411-E415 PolarHBondContact O-N 2.69Å |
| 412 | Q | 94.8 | Very high | 95.8 | Very high | 130 Ų | 130 | 97.3 Ų | 97.3 | 61% | 0.607 | 50% | 0.503 | S | S | * | . | H | α-helix | trans | -65.2 | -42.1 | 174.3 | -69.6 | 174.6 | -36.2 | 0 | 0 | 111.7 | Q408 A409 A414 E415 L416 | Q408-Q412 WeakPolarHBondContact O-CG 3.24Å; Q408-Q412 PolarHBondContact O-N 3.05Å; A409-Q412 CarbonylContact O-C 3.49Å; A409-Q412 WeakPolarHBondContact O-CB 3.28Å; A409-Q412 PolarHBondContact O-N 3.01Å; Q412-A414 VanDerWaalsContact C-N 3.33Å; Q412-A414 PolarHBondContact O-N 3.45Å; Q412-E415 PolarHBondContact O-N 3.32Å; Q412-L416 WeakPolarHBondContact O-CB 3.41Å; Q412-L416 WeakPolarHBondContact O-CG 3.43Å; Q412-L416 PolarHBondContact O-N 3.46Å |
| 413 | D | 96.6 | Very high | 95.6 | Very high | 95 Ų | 95 | 95.7 Ų | 95.7 | 51% | 0.508 | 50% | 0.499 | S | S | . | . | H | α-helix | trans | -57.9 | -44.9 | 173.7 | -67.2 | -37.5 | 0 | 0 | 0 | 111.4 | A409 L416 V417 | A409-D413 VanDerWaalsContact O-CG 3.3Å; A409-D413 PolarHBondContact O-N 3.09Å; D413-L416 PolarHBondContact O-N 2.96Å; D413-V417 WeakPolarHBondContact O-CG2 3.4Å; D413-V417 PolarHBondContact O-N 3.48Å |
| 414 | A | 96.6 | Very high | 95.4 | Very high | 61 Ų | 61 | 93.6 Ų | 93.6 | 50% | 0.504 | 49% | 0.491 | S | S | . | . | H | α-helix | trans | -65.4 | -38.3 | 177.7 | 0 | 0 | 0 | 0 | 0 | 112.4 | Q410 A411 Q412 V417 R418 | Q410-A414 WeakPolarHBondContact O-CB 3.27Å; Q410-A414 PolarHBondContact O-N 2.94Å; A411-A414 PolarHBondContact O-N 3.28Å; Q412-A414 VanDerWaalsContact C-N 3.33Å; Q412-A414 PolarHBondContact O-N 3.45Å; A414-V417 PolarHBondContact O-N 3.11Å; A414-R418 WeakPolarHBondContact O-CB 3.27Å; A414-R418 PolarHBondContact O-N 2.96Å |
| 415 | E | 96.7 | Very high | 95 | Very high | 100 Ų | 100 | 94.1 Ų | 94.1 | 47% | 0.467 | 49% | 0.489 | S | S | . | . | H | α-helix | trans | -67.4 | -43.1 | 173.5 | 176.1 | 145.2 | -122.7 | 0 | 0 | 112.3 | A411 Q412 V417 R418 L419 | A411-E415 PolarHBondContact O-N 2.69Å; Q412-E415 PolarHBondContact O-N 3.32Å; E415-V417 VanDerWaalsContact C-N 3.29Å; E415-V417 PolarHBondContact O-N 3.21Å; E415-R418 WeakPolarHBondContact O-CB 3.44Å; E415-R418 PolarHBondContact O-N 2.87Å; E415-R418 VanDerWaalsContact O-N 3.13Å; E415-R418 IonicContact OE1-CZ 2.76Å; E415-R418 IonicContact OE1-NE 3.46Å; E415-R418 IonicContact OE1-NH2 3.48Å; E415-R418 PolarHBondContact OE1-NH2 3.33Å; E415-L419 HydrophobicContact CG-CD1 3.93Å; E415-L419 HydrophobicContact CG-CG 4.27Å; E415-L419 WeakPolarHBondContact O-CG 3.33Å; E415-L419 PolarHBondContact O-N 2.89Å |
| 416 | L | 95.8 | Very high | 94.8 | Very high | 87 Ų | 87 | 96.3 Ų | 96.3 | 46% | 0.455 | 50% | 0.495 | S | S | . | . | H | α-helix | trans | -60.2 | -38.9 | 174.4 | -72.2 | 172 | 0 | 0 | 0 | 111.7 | Q412 D413 R420 | Q412-L416 WeakPolarHBondContact O-CB 3.41Å; Q412-L416 WeakPolarHBondContact O-CG 3.43Å; Q412-L416 PolarHBondContact O-N 3.46Å; D413-L416 PolarHBondContact O-N 2.96Å; L416-R420 VanDerWaalsContact O-CB 3.28Å; L416-R420 WeakPolarHBondContact O-CB 3.41Å; L416-R420 WeakPolarHBondContact O-CD 3.49Å; L416-R420 WeakPolarHBondContact O-CG 3.42Å; L416-R420 PolarHBondContact O-N 2.85Å |
| 417 | V | 97 | Very high | 94 | Very high | 72 Ų | 72 | 94.9 Ų | 94.9 | 44% | 0.436 | 50% | 0.496 | S | S | . | . | H | α-helix | trans | -64.4 | -44.9 | 172.7 | 169.8 | 0 | 0 | 0 | 0 | 111.4 | D413 A414 E415 L419 R420 Q421 | D413-V417 WeakPolarHBondContact O-CG2 3.4Å; D413-V417 PolarHBondContact O-N 3.48Å; A414-V417 PolarHBondContact O-N 3.11Å; E415-V417 VanDerWaalsContact C-N 3.29Å; E415-V417 PolarHBondContact O-N 3.21Å; V417-L419 PolarHBondContact O-N 3.35Å; V417-R420 CarbonylContact O-C 3.59Å; V417-R420 PolarHBondContact O-N 3.46Å; V417-Q421 WeakPolarHBondContact O-CG 3.4Å; V417-Q421 PolarHBondContact O-N 3.33Å |
| 418 | R | 96.9 | Very high | 93.1 | Very high | 131 Ų | 131 | 99.6 Ų | 99.6 | 49% | 0.494 | 51% | 0.508 | S | S | . | . | H | α-helix | trans | -59.4 | -45.5 | 176.3 | -176.1 | -171.5 | 69.2 | 83.5 | -4.2 | 111.9 | A414 E415 Q421 A422 | A414-R418 WeakPolarHBondContact O-CB 3.27Å; A414-R418 PolarHBondContact O-N 2.96Å; E415-R418 WeakPolarHBondContact O-CB 3.44Å; E415-R418 PolarHBondContact O-N 2.87Å; E415-R418 VanDerWaalsContact O-N 3.13Å; E415-R418 IonicContact OE1-CZ 2.76Å; E415-R418 IonicContact OE1-NE 3.46Å; E415-R418 IonicContact OE1-NH2 3.48Å; E415-R418 PolarHBondContact OE1-NH2 3.33Å; R418-Q421 WeakPolarHBondContact O-CB 3.25Å; R418-Q421 PolarHBondContact O-N 2.82Å; R418-A422 PolarHBondContact O-N 3.09Å |
| 419 | L | 95.6 | Very high | 91.7 | Very high | 79 Ų | 79 | 100.6 Ų | 100.6 | 41% | 0.414 | 51% | 0.513 | S | S | . | . | H | α-helix | trans | -65.6 | -43.8 | 177.7 | -68.1 | 171.3 | 0 | 0 | 0 | 111.3 | E415 V417 Q421 A422 V423 | E415-L419 HydrophobicContact CG-CD1 3.93Å; E415-L419 HydrophobicContact CG-CG 4.27Å; E415-L419 WeakPolarHBondContact O-CG 3.33Å; E415-L419 PolarHBondContact O-N 2.89Å; V417-L419 PolarHBondContact O-N 3.35Å; L419-Q421 PolarHBondContact O-N 3.22Å; L419-A422 PolarHBondContact O-N 3.08Å; L419-V423 WeakPolarHBondContact O-CG2 3.4Å; L419-V423 PolarHBondContact O-N 3.02Å |
| 420 | R | 95.6 | Very high | 90.1 | Very high | 168 Ų | 168 | 101.5 Ų | 101.5 | 63% | 0.634 | 52% | 0.521 | S | S | * | . | H | α-helix | trans | -64.1 | -20.5 | 173 | -73.9 | 169.9 | 173.6 | 174.9 | -1.9 | 113.7 | L416 V417 R424 | L416-R420 VanDerWaalsContact O-CB 3.28Å; L416-R420 WeakPolarHBondContact O-CB 3.41Å; L416-R420 WeakPolarHBondContact O-CD 3.49Å; L416-R420 WeakPolarHBondContact O-CG 3.42Å; L416-R420 PolarHBondContact O-N 2.85Å; V417-R420 CarbonylContact O-C 3.59Å; V417-R420 PolarHBondContact O-N 3.46Å; R420-R424 PolarHBondContact O-NE 3.06Å; R420-R424 PolarHBondContact O-NH2 3.44Å |
| 421 | Q | 95.1 | Very high | 88.1 | Confident | 110 Ų | 110 | 101.7 Ų | 101.7 | 51% | 0.514 | 53% | 0.531 | S | S | . | . | H | α-helix | trans | -81.4 | -45.8 | 170.2 | -75.4 | 169.6 | -27.7 | 0 | 0 | 110.9 | V417 R418 L419 V423 R424 S425 | V417-Q421 WeakPolarHBondContact O-CG 3.4Å; V417-Q421 PolarHBondContact O-N 3.33Å; R418-Q421 WeakPolarHBondContact O-CB 3.25Å; R418-Q421 PolarHBondContact O-N 2.82Å; L419-Q421 PolarHBondContact O-N 3.22Å; Q421-V423 PolarHBondContact O-N 2.82Å; Q421-R424 PolarHBondContact O-N 3.45Å; Q421-S425 PolarHBondContact O-N 2.84Å; Q421-S425 PolarHBondContact O-OG 3.38Å |
| 422 | A | 93.6 | Very high | 86.3 | Confident | 38 Ų | 38 | 110 Ų | 110 | 31% | 0.314 | 55% | 0.549 | S | S | . | . | H | α-helix | trans | -57.4 | -47.5 | 177.2 | 0 | 0 | 0 | 0 | 0 | 112.3 | R418 L419 R424 S425 L426 | R418-A422 PolarHBondContact O-N 3.09Å; L419-A422 PolarHBondContact O-N 3.08Å; A422-R424 VanDerWaalsContact C-N 3.35Å; A422-R424 PolarHBondContact O-N 3.26Å; A422-S425 WeakPolarHBondContact CA-OG 3.24Å; A422-S425 PolarHBondContact O-N 2.9Å; A422-S425 PolarHBondContact O-OG 3.34Å; A422-L426 WeakPolarHBondContact O-CG 3.04Å; A422-L426 PolarHBondContact O-N 2.91Å |
| 423 | V | 92.7 | Very high | 84.2 | Confident | 93 Ų | 93 | 112.3 Ų | 112.3 | 56% | 0.564 | 56% | 0.56 | S | S | * | * | H | α-helix | trans | -58.5 | -44.1 | 176.9 | 172 | 0 | 0 | 0 | 0 | 111.6 | L419 Q421 L426 Q427 | L419-V423 WeakPolarHBondContact O-CG2 3.4Å; L419-V423 PolarHBondContact O-N 3.02Å; Q421-V423 PolarHBondContact O-N 2.82Å; V423-L426 PolarHBondContact O-N 3.03Å; V423-Q427 WeakPolarHBondContact O-CB 3.36Å; V423-Q427 PolarHBondContact O-N 3.48Å |
| 424 | R | 92.4 | Very high | 81.8 | Confident | 129 Ų | 129 | 116 Ų | 116 | 49% | 0.487 | 57% | 0.574 | S | S | . | * | H | α-helix | trans | -63.4 | -44 | 175.4 | -83.3 | 178.8 | -71.8 | 166.9 | -1.3 | 112.4 | R420 Q421 A422 L426 Q427 E428 | R420-R424 PolarHBondContact O-NE 3.06Å; R420-R424 PolarHBondContact O-NH2 3.44Å; Q421-R424 PolarHBondContact O-N 3.45Å; A422-R424 VanDerWaalsContact C-N 3.35Å; A422-R424 PolarHBondContact O-N 3.26Å; R424-L426 VanDerWaalsContact C-N 3.26Å; R424-L426 PolarHBondContact O-N 3.26Å; R424-Q427 CarbonylContact O-C 3.6Å; R424-Q427 WeakPolarHBondContact O-CB 3.3Å; R424-Q427 PolarHBondContact O-N 2.83Å; R424-Q427 VanDerWaalsContact O-N 3.12Å; R424-E428 WeakPolarHBondContact O-CB 3.45Å; R424-E428 VanDerWaalsContact O-CG 3.32Å; R424-E428 WeakPolarHBondContact O-CG 3.47Å; R424-E428 PolarHBondContact O-N 3.35Å |
| 425 | S | 88.6 | Confident | 79.2 | Confident | 45 Ų | 45 | 117.9 Ų | 117.9 | 32% | 0.315 | 59% | 0.59 | S | S | . | * | H | α-helix | trans | -64.5 | -29.1 | 177.4 | 59.1 | 0 | 0 | 0 | 0 | 113.5 | Q421 A422 Q429 | Q421-S425 PolarHBondContact O-N 2.84Å; Q421-S425 PolarHBondContact O-OG 3.38Å; A422-S425 WeakPolarHBondContact CA-OG 3.24Å; A422-S425 PolarHBondContact O-N 2.9Å; A422-S425 PolarHBondContact O-OG 3.34Å; S425-Q429 WeakPolarHBondContact O-CB 3.3Å; S425-Q429 WeakPolarHBondContact O-CG 3.46Å; S425-Q429 PolarHBondContact O-N 2.99Å; S425-Q429 PolarHBondContact O-NE2 3.23Å |
| 426 | L | 88.3 | Confident | 76.9 | Confident | 115 Ų | 115 | 119 Ų | 119 | 60% | 0.602 | 61% | 0.606 | S | S | * | * | H | α-helix | trans | -73.8 | -39.5 | 171.9 | -68.1 | 170.3 | 0 | 0 | 0 | 111.5 | A422 V423 R424 E428 Q429 A430 | A422-L426 WeakPolarHBondContact O-CG 3.04Å; A422-L426 PolarHBondContact O-N 2.91Å; V423-L426 PolarHBondContact O-N 3.03Å; R424-L426 VanDerWaalsContact C-N 3.26Å; R424-L426 PolarHBondContact O-N 3.26Å; L426-E428 VanDerWaalsContact C-N 3.33Å; L426-Q429 CarbonylContact O-C 3.59Å; L426-Q429 PolarHBondContact O-N 2.84Å; L426-A430 PolarHBondContact O-N 3.17Å; L426-A430 VanDerWaalsContact O-N 3.1Å |
| 427 | Q | 82.2 | Confident | 74.4 | Confident | 143 Ų | 143 | 118.6 Ų | 118.6 | 67% | 0.668 | 62% | 0.623 | S | S | * | * | H | α-helix | trans | -65.7 | -34.6 | 175.1 | -168.5 | 175.3 | 18.4 | 0 | 0 | 112.5 | V423 R424 Q429 | V423-Q427 WeakPolarHBondContact O-CB 3.36Å; V423-Q427 PolarHBondContact O-N 3.48Å; R424-Q427 CarbonylContact O-C 3.6Å; R424-Q427 WeakPolarHBondContact O-CB 3.3Å; R424-Q427 PolarHBondContact O-N 2.83Å; R424-Q427 VanDerWaalsContact O-N 3.12Å; Q427-Q429 VanDerWaalsContact C-N 3.33Å |
| 428 | E | 76.5 | Confident | 72 | Confident | 156 Ų | 156 | 120.7 Ų | 120.7 | 73% | 0.729 | 64% | 0.64 | S | S | * | * | H | α-helix | trans | -75.8 | -18.8 | 173.6 | -71.1 | 165.2 | -175.9 | 0 | 0 | 113 | R424 L426 | R424-E428 WeakPolarHBondContact O-CB 3.45Å; R424-E428 VanDerWaalsContact O-CG 3.32Å; R424-E428 WeakPolarHBondContact O-CG 3.47Å; R424-E428 PolarHBondContact O-N 3.35Å; L426-E428 VanDerWaalsContact C-N 3.33Å |
| 429 | Q | 68.3 | Low | 69.2 | Low | 146 Ų | 146 | 120 Ų | 120 | 68% | 0.682 | 66% | 0.655 | S | S | * | * | H | α-helix | trans | -95.3 | -6 | 175.6 | -74.3 | 167.1 | 31.7 | 0 | 0 | 113.4 | S425 L426 Q427 | S425-Q429 WeakPolarHBondContact O-CB 3.3Å; S425-Q429 WeakPolarHBondContact O-CG 3.46Å; S425-Q429 PolarHBondContact O-N 2.99Å; S425-Q429 PolarHBondContact O-NE2 3.23Å; L426-Q429 CarbonylContact O-C 3.59Å; L426-Q429 PolarHBondContact O-N 2.84Å; Q427-Q429 VanDerWaalsContact C-N 3.33Å |
| 430 | A | 57 | Low | 67 | Low | 61 Ų | 61 | 125.7 Ų | 125.7 | 50% | 0.504 | 68% | 0.679 | S | S | . | * | S | Bend | trans | -63.4 | 129.4 | 169 | 0 | 0 | 0 | 0 | 0 | 109.3 | L426 R432 | L426-A430 PolarHBondContact O-N 3.17Å; L426-A430 VanDerWaalsContact O-N 3.1Å; A430-R432 PolarHBondContact O-N 3.43Å |
| 431 | P | 55.7 | Low | 64.6 | Low | 114 Ų | 114 | 123.9 Ų | 123.9 | 74% | 0.74 | 69% | 0.687 | S | S | * | * | trans | -64.6 | 130.2 | -175.6 | 25.7 | -33.6 | 0 | 0 | 0 | 110.8 | E433 | P431-E433 PolarHBondContact O-N 3.06Š| ||
| 432 | R | 57.2 | Low | 62.9 | Low | 236 Ų | 236 | 124.8 Ų | 124.8 | 89% | 0.891 | 70% | 0.695 | S | S | * | * | trans | -67.9 | 99.5 | 157.1 | -84.5 | -174.5 | 168.7 | -167.9 | -3.4 | 107.8 | A430 E434 | A430-R432 PolarHBondContact O-N 3.43Å; R432-E434 PolarHBondContact O-N 3.02Å; R432-E434 VanDerWaalsContact O-N 3.15Å | ||
| 433 | E | 50.8 | Low | 60.5 | Low | 179 Ų | 179 | 129.2 Ų | 129.2 | 84% | 0.836 | 71% | 0.714 | S | S | * | * | trans | -66.9 | 106 | 156.8 | -67 | -168.5 | 149 | 0 | 0 | 107.6 | P431 A435 | P431-E433 PolarHBondContact O-N 3.06Å; E433-A435 PolarHBondContact O-N 3.45Å | ||
| 434 | E | 45.8 | Very low | 58.7 | Low | 172 Ų | 172 | 130.1 Ų | 130.1 | 80% | 0.804 | 72% | 0.723 | S | S | * | * | trans | -67.9 | 128.5 | 165.3 | -63.9 | -168.5 | 150.3 | 0 | 0 | 108 | R432 P436 | R432-E434 PolarHBondContact O-N 3.02Å; R432-E434 VanDerWaalsContact O-N 3.15Å; E434-P436 WeakPolarHBondContact O-CD 3.35Å | ||
| 435 | A | 42.5 | Very low | 56.7 | Low | 102 Ų | 102 | 133 Ų | 133 | 84% | 0.843 | 74% | 0.739 | S | S | * | * | trans | -100.6 | 97.6 | -177.6 | 0 | 0 | 0 | 0 | 0 | 110.9 | E433 | E433-A435 PolarHBondContact O-N 3.45Š| ||
| 436 | P | 48.4 | Very low | 54.7 | Low | 123 Ų | 123 | 136.2 Ų | 136.2 | 80% | 0.799 | 76% | 0.761 | S | S | * | * | trans | -83.3 | 148.6 | 165.1 | 34.8 | -34.9 | 0 | 0 | 0 | 110.8 | E434 | E434-P436 WeakPolarHBondContact O-CD 3.35Š| ||
| 437 | G | 42.9 | Very low | 52.8 | Low | 78 Ų | 78 | 142.8 Ų | 142.8 | 80% | 0.804 | 78% | 0.778 | S | S | * | * | trans | 96.5 | 111.5 | 157.1 | 0 | 0 | 0 | 0 | 0 | 116 | ||||
| 438 | S | 46.7 | Very low | 51.2 | Low | 116 Ų | 116 | 138.4 Ų | 138.4 | 81% | 0.811 | 77% | 0.771 | S | S | * | * | trans | -59.9 | 135.5 | 152.2 | 170.6 | 0 | 0 | 0 | 0 | 110.5 | ||||
| 439 | C | 38.3 | Very low | 49.9 | Very low | 118 Ų | 118 | 139.3 Ų | 139.3 | 80% | 0.797 | 78% | 0.78 | S | S | * | * | trans | -161 | 117.7 | 145.7 | -106.9 | 0 | 0 | 0 | 0 | 110 | T441 | C439-T441 PolarHBondContact O-N 3.02Š| ||
| 440 | E | 48.3 | Very low | 48.8 | Very low | 197 Ų | 197 | 140.5 Ų | 140.5 | 92% | 0.921 | 79% | 0.79 | S | S | * | * | trans | -84.3 | 100.8 | 166.2 | -66.8 | -175.5 | 128.3 | 0 | 0 | 109.9 | ||||
| 441 | T | 45.8 | Very low | 48.3 | Very low | 130 Ų | 130 | 140.5 Ų | 140.5 | 80% | 0.798 | 80% | 0.796 | S | S | * | * | trans | -142.9 | 139.5 | 161.5 | -35.1 | 0 | 0 | 0 | 0 | 111.1 | C439 | C439-T441 PolarHBondContact O-N 3.02Š| ||
| 442 | D | 59.3 | Low | 48 | Very low | 129 Ų | 129 | 142.7 Ų | 142.7 | 69% | 0.69 | 80% | 0.797 | S | S | * | * | trans | -59.7 | 130.1 | 175.6 | 175.4 | 26.5 | 0 | 0 | 0 | 112.9 | C444 | D442-C444 PolarHBondContact OD1-N 2.95Å; D442-C444 PolarHBondContact OD1-SG 3.36Å | ||
| 443 | D | 42.2 | Very low | 47.7 | Very low | 131 Ų | 131 | 135.1 Ų | 135.1 | 70% | 0.701 | 78% | 0.784 | S | S | * | * | trans | -152.7 | 86.2 | 146.6 | -144.6 | -24.5 | 0 | 0 | 0 | 112.3 | K445 | D443-K445 VanDerWaalsContact C-N 3.32Å; D443-K445 PolarHBondContact O-N 3.4Å | ||
| 444 | C | 55.3 | Low | 47.8 | Very low | 112 Ų | 112 | 129 Ų | 129 | 76% | 0.757 | 77% | 0.769 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -69.5 | 72.9 | -179.9 | -67.2 | 0 | 0 | 0 | 0 | 114.1 | D442 | D442-C444 PolarHBondContact OD1-N 2.95Å; D442-C444 PolarHBondContact OD1-SG 3.36Å |
| 445 | K | 51.3 | Low | 48.3 | Very low | 190 Ų | 190 | 122.8 Ų | 122.8 | 83% | 0.826 | 75% | 0.751 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -149.5 | -7.5 | 174.2 | -104 | 126.9 | -166.5 | 171.7 | 0 | 120.3 | D443 | D443-K445 VanDerWaalsContact C-N 3.32Å; D443-K445 PolarHBondContact O-N 3.4Å |
| 446 | S | 45.4 | Very low | 49.2 | Very low | 112 Ų | 112 | 120.6 Ų | 120.6 | 78% | 0.783 | 73% | 0.73 | S | S | * | * | trans | -99.6 | -3.4 | -170.8 | 53.7 | 0 | 0 | 0 | 0 | 116.5 | G448 | S446-G448 PolarHBondContact O-N 3.47Š| ||
| 447 | R | 49 | Very low | 49.9 | Very low | 254 Ų | 254 | 122 Ų | 122 | 96% | 0.958 | 73% | 0.726 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -78.5 | 54.7 | 178.8 | -158.1 | -175 | 78.3 | -171.8 | 4.6 | 113.1 | ||
| 448 | G | 48.7 | Very low | 51.1 | Low | 51 Ų | 51 | 121.8 Ų | 121.8 | 53% | 0.526 | 72% | 0.716 | S | S | . | * | T | Hydrogen-bonded Turn | trans | -132.2 | -30.5 | -172.5 | 0 | 0 | 0 | 0 | 0 | 117.4 | S446 | S446-G448 PolarHBondContact O-N 3.47Š|
| 449 | L | 48.5 | Very low | 52.5 | Low | 174 Ų | 174 | 123.7 Ų | 123.7 | 91% | 0.911 | 71% | 0.706 | S | S | * | * | S | Bend | trans | -136.3 | 8.3 | -166.8 | -69.3 | 174.9 | 0 | 0 | 0 | 116.2 | ||
| 450 | L | 46.7 | Very low | 54.4 | Low | 171 Ų | 171 | 121.9 Ų | 121.9 | 90% | 0.895 | 69% | 0.688 | S | S | * | * | S | Bend | trans | -129.7 | -4 | 179.6 | -99.9 | 157 | 0 | 0 | 0 | 114.5 | ||
| 451 | G | 46.4 | Very low | 56.2 | Low | 61 Ų | 61 | 113.9 Ų | 113.9 | 63% | 0.629 | 66% | 0.658 | S | S | * | * | S | Bend | trans | -91.3 | -18.1 | -177.7 | 0 | 0 | 0 | 0 | 0 | 115.7 | G455 | G451-G455 PolarHBondContact O-N 3.46Š|
| 452 | E | 49 | Very low | 58.1 | Low | 161 Ų | 161 | 109.3 Ų | 109.3 | 75% | 0.752 | 63% | 0.634 | S | S | * | * | H | α-helix | trans | -82 | -30 | -167.4 | -60.2 | -159.1 | 137.4 | 0 | 0 | 114.1 | G455 S456 | E452-G455 PolarHBondContact O-N 3.04Å; E452-S456 WeakPolarHBondContact O-CB 3.47Å; E452-S456 PolarHBondContact O-N 2.89Å |
| 453 | A | 50.6 | Low | 59.4 | Low | 76 Ų | 76 | 107 Ų | 107 | 63% | 0.628 | 62% | 0.619 | S | S | * | * | H | α-helix | trans | -64.4 | -61.5 | -177.8 | 0 | 0 | 0 | 0 | 0 | 112.4 | G455 S456 E457 | A453-G455 PolarHBondContact O-N 3.35Å; A453-S456 PolarHBondContact O-N 2.69Å; A453-S456 VanDerWaalsContact O-N 3.16Å; A453-E457 PolarHBondContact O-N 2.83Å; A453-E457 VanDerWaalsContact O-N 3.13Å |
| 454 | G | 52.3 | Low | 61.7 | Low | 50 Ų | 50 | 106.6 Ų | 106.6 | 52% | 0.515 | 61% | 0.613 | S | S | . | * | H | α-helix | trans | -66.6 | -26.3 | 176.2 | 0 | 0 | 0 | 0 | 0 | 113.2 | A458 | G454-A458 WeakPolarHBondContact O-CB 3.08Å; G454-A458 PolarHBondContact O-N 2.71Å; G454-A458 VanDerWaalsContact O-N 3.14Å |
| 455 | G | 56.3 | Low | 63.5 | Low | 42 Ų | 42 | 106.8 Ų | 106.8 | 43% | 0.433 | 61% | 0.606 | S | S | . | * | H | α-helix | trans | -66.1 | -37.7 | 171.4 | 0 | 0 | 0 | 0 | 0 | 113.4 | G451 E452 A453 R459 | G451-G455 PolarHBondContact O-N 3.46Å; E452-G455 PolarHBondContact O-N 3.04Å; A453-G455 PolarHBondContact O-N 3.35Å; G455-R459 WeakPolarHBondContact O-CB 3.44Å; G455-R459 PolarHBondContact O-N 2.84Å |
| 456 | S | 61.1 | Low | 65.4 | Low | 56 Ų | 56 | 104.9 Ų | 104.9 | 39% | 0.392 | 59% | 0.593 | S | S | . | * | H | α-helix | trans | -67.8 | -56 | 172.3 | -157.9 | 0 | 0 | 0 | 0 | 110.5 | E452 A453 A458 R459 D460 | E452-S456 WeakPolarHBondContact O-CB 3.47Å; E452-S456 PolarHBondContact O-N 2.89Å; A453-S456 PolarHBondContact O-N 2.69Å; A453-S456 VanDerWaalsContact O-N 3.16Å; S456-A458 VanDerWaalsContact C-N 3.3Å; S456-A458 PolarHBondContact O-N 2.91Å; S456-R459 CarbonylContact O-C 3.51Å; S456-R459 WeakPolarHBondContact O-CA 3.31Å; S456-R459 WeakPolarHBondContact O-CB 3.43Å; S456-R459 PolarHBondContact O-N 3.28Å; S456-D460 WeakPolarHBondContact O-CB 3.49Å; S456-D460 PolarHBondContact O-N 3.36Å; S456-D460 PolarHBondContact OG-OD2 2.7Å |
| 457 | E | 63.3 | Low | 67.6 | Low | 154 Ų | 154 | 102.2 Ų | 102.2 | 72% | 0.72 | 58% | 0.578 | S | S | * | * | H | α-helix | trans | -57.3 | -40.3 | -175.3 | -66.3 | -172.8 | 158.3 | 0 | 0 | 113.3 | A453 G461 | A453-E457 PolarHBondContact O-N 2.83Å; A453-E457 VanDerWaalsContact O-N 3.13Å; E457-G461 PolarHBondContact O-N 3.44Å |
| 458 | A | 69.3 | Low | 69.6 | Low | 73 Ų | 73 | 94.7 Ų | 94.7 | 60% | 0.603 | 55% | 0.554 | S | S | * | * | H | α-helix | trans | -67.2 | -34.6 | 174.8 | 0 | 0 | 0 | 0 | 0 | 112.9 | G454 S456 A462 | G454-A458 WeakPolarHBondContact O-CB 3.08Å; G454-A458 PolarHBondContact O-N 2.71Å; G454-A458 VanDerWaalsContact O-N 3.14Å; S456-A458 VanDerWaalsContact C-N 3.3Å; S456-A458 PolarHBondContact O-N 2.91Å; A458-A462 WeakPolarHBondContact O-CB 3.49Å; A458-A462 PolarHBondContact O-N 3.49Å; A458-A462 VanDerWaalsContact O-N 3.11Å |
| 459 | R | 75 | Confident | 71.8 | Confident | 156 Ų | 156 | 96.9 Ų | 96.9 | 59% | 0.589 | 55% | 0.553 | S | S | * | * | H | α-helix | trans | -72.9 | -45.2 | 175.5 | 175.2 | -178.6 | 172.8 | -168.2 | -10.8 | 111.8 | G455 S456 G461 A462 E463 | G455-R459 WeakPolarHBondContact O-CB 3.44Å; G455-R459 PolarHBondContact O-N 2.84Å; S456-R459 CarbonylContact O-C 3.51Å; S456-R459 WeakPolarHBondContact O-CA 3.31Å; S456-R459 WeakPolarHBondContact O-CB 3.43Å; S456-R459 PolarHBondContact O-N 3.28Å; R459-G461 VanDerWaalsContact C-N 3.34Å; R459-A462 CarbonylContact O-C 3.59Å; R459-A462 WeakPolarHBondContact O-CA 3.49Å; R459-A462 WeakPolarHBondContact O-CB 3.33Å; R459-A462 PolarHBondContact O-N 2.98Å; R459-A462 VanDerWaalsContact O-N 3.08Å; R459-E463 IonicContact CZ-OE1 3.77Å; R459-E463 IonicContact NE-OE1 2.7Å; R459-E463 PolarHBondContact NE-OE1 3.01Å; R459-E463 IonicContact NH2-OE1 2.8Å; R459-E463 PolarHBondContact NH2-OE1 3.07Å; R459-E463 WeakPolarHBondContact O-CG 2.96Å; R459-E463 PolarHBondContact O-N 2.92Å |
| 460 | D | 79.1 | Confident | 74 | Confident | 80 Ų | 80 | 93.4 Ų | 93.4 | 43% | 0.428 | 54% | 0.535 | S | S | . | . | H | α-helix | trans | -63.9 | -41.9 | 179.8 | -64.1 | -41.8 | 0 | 0 | 0 | 109.9 | S456 A462 E463 Q464 | S456-D460 WeakPolarHBondContact O-CB 3.49Å; S456-D460 PolarHBondContact O-N 3.36Å; S456-D460 PolarHBondContact OG-OD2 2.7Å; D460-A462 PolarHBondContact O-N 2.69Å; D460-E463 PolarHBondContact O-N 3.07Å; D460-Q464 WeakPolarHBondContact O-CB 3.3Å; D460-Q464 PolarHBondContact O-N 3.48Å |
| 461 | G | 86.8 | Confident | 76.2 | Confident | 28 Ų | 28 | 91.4 Ų | 91.4 | 29% | 0.289 | 52% | 0.521 | S | S | . | . | H | α-helix | trans | -62.1 | -38.8 | 169.3 | 0 | 0 | 0 | 0 | 0 | 113.5 | E457 R459 Q464 L465 | E457-G461 PolarHBondContact O-N 3.44Å; R459-G461 VanDerWaalsContact C-N 3.34Å; G461-Q464 PolarHBondContact O-N 3.07Å; G461-L465 WeakPolarHBondContact O-CB 3.46Å; G461-L465 WeakPolarHBondContact O-CG 3.48Å; G461-L465 PolarHBondContact O-N 2.76Å |
| 462 | A | 84.1 | Confident | 78.4 | Confident | 35 Ų | 35 | 92.8 Ų | 92.8 | 29% | 0.289 | 51% | 0.511 | S | S | . | . | H | α-helix | trans | -69.6 | -33.9 | 174.5 | 0 | 0 | 0 | 0 | 0 | 112.9 | A458 R459 D460 R466 | A458-A462 WeakPolarHBondContact O-CB 3.49Å; A458-A462 PolarHBondContact O-N 3.49Å; A458-A462 VanDerWaalsContact O-N 3.11Å; R459-A462 CarbonylContact O-C 3.59Å; R459-A462 WeakPolarHBondContact O-CA 3.49Å; R459-A462 WeakPolarHBondContact O-CB 3.33Å; R459-A462 PolarHBondContact O-N 2.98Å; R459-A462 VanDerWaalsContact O-N 3.08Å; D460-A462 PolarHBondContact O-N 2.69Å; A462-R466 WeakPolarHBondContact O-CD 3.28Å; A462-R466 WeakPolarHBondContact O-CG 3.35Å; A462-R466 PolarHBondContact O-N 2.98Å; A462-R466 VanDerWaalsContact O-N 3.07Å |
| 463 | E | 86.7 | Confident | 80.5 | Confident | 80 Ų | 80 | 92.4 Ų | 92.4 | 37% | 0.374 | 50% | 0.503 | S | S | . | . | H | α-helix | trans | -72.3 | -35.6 | 173.7 | -70.9 | -175.7 | -156.1 | 0 | 0 | 111.4 | R459 D460 R466 A467 | R459-E463 IonicContact CZ-OE1 3.77Å; R459-E463 IonicContact NE-OE1 2.7Å; R459-E463 PolarHBondContact NE-OE1 3.01Å; R459-E463 IonicContact NH2-OE1 2.8Å; R459-E463 PolarHBondContact NH2-OE1 3.07Å; R459-E463 WeakPolarHBondContact O-CG 2.96Å; R459-E463 PolarHBondContact O-N 2.92Å; D460-E463 PolarHBondContact O-N 3.07Å; E463-R466 WeakPolarHBondContact O-CB 3.31Å; E463-R466 PolarHBondContact O-N 3.34Å; E463-A467 PolarHBondContact O-N 3.26Å |
| 464 | Q | 91.8 | Very high | 82.7 | Confident | 123 Ų | 123 | 93.8 Ų | 93.8 | 58% | 0.575 | 50% | 0.499 | S | S | * | . | H | α-helix | trans | -64 | -47.2 | 171 | -172.5 | 169.8 | 2.2 | 0 | 0 | 112.2 | D460 G461 R466 A467 E468 | D460-Q464 WeakPolarHBondContact O-CB 3.3Å; D460-Q464 PolarHBondContact O-N 3.48Å; G461-Q464 PolarHBondContact O-N 3.07Å; Q464-R466 VanDerWaalsContact C-N 3.29Å; Q464-R466 PolarHBondContact O-N 3.41Å; Q464-A467 WeakPolarHBondContact O-CB 3.41Å; Q464-A467 PolarHBondContact O-N 3.05Å; Q464-A467 VanDerWaalsContact O-N 3.07Å; Q464-E468 PolarHBondContact O-N 2.93Å |
| 465 | L | 92 | Very high | 84.6 | Confident | 115 Ų | 115 | 98 Ų | 98 | 60% | 0.602 | 50% | 0.499 | S | S | * | . | H | α-helix | trans | -62.9 | -32.5 | 174.8 | -72.6 | 170 | 0 | 0 | 0 | 112.8 | G461 L469 | G461-L465 WeakPolarHBondContact O-CB 3.46Å; G461-L465 WeakPolarHBondContact O-CG 3.48Å; G461-L465 PolarHBondContact O-N 2.76Å; L465-L469 WeakPolarHBondContact O-CB 3.46Å; L465-L469 PolarHBondContact O-N 3.38Å |
| 466 | R | 91.4 | Very high | 86.4 | Confident | 150 Ų | 150 | 97.6 Ų | 97.6 | 57% | 0.566 | 50% | 0.495 | S | S | * | . | H | α-helix | trans | -66.9 | -39.7 | 171.3 | -72.8 | 162.5 | -172.5 | 160.8 | 1.4 | 111.6 | A462 E463 Q464 L469 L470 | A462-R466 WeakPolarHBondContact O-CD 3.28Å; A462-R466 WeakPolarHBondContact O-CG 3.35Å; A462-R466 PolarHBondContact O-N 2.98Å; A462-R466 VanDerWaalsContact O-N 3.07Å; E463-R466 WeakPolarHBondContact O-CB 3.31Å; E463-R466 PolarHBondContact O-N 3.34Å; Q464-R466 VanDerWaalsContact C-N 3.29Å; Q464-R466 PolarHBondContact O-N 3.41Å; R466-L469 PolarHBondContact O-N 2.9Å; R466-L470 WeakPolarHBondContact O-CG 3.43Å; R466-L470 PolarHBondContact O-N 2.84Å |
| 467 | A | 90.8 | Very high | 87.9 | Confident | 57 Ų | 57 | 100.4 Ų | 100.4 | 47% | 0.471 | 50% | 0.502 | S | S | . | . | H | α-helix | trans | -65.6 | -43.9 | 175.8 | 0 | 0 | 0 | 0 | 0 | 111.9 | E463 Q464 L470 Q471 | E463-A467 PolarHBondContact O-N 3.26Å; Q464-A467 WeakPolarHBondContact O-CB 3.41Å; Q464-A467 PolarHBondContact O-N 3.05Å; Q464-A467 VanDerWaalsContact O-N 3.07Å; A467-L470 PolarHBondContact O-N 3.49Å; A467-Q471 WeakPolarHBondContact O-CB 3.33Å; A467-Q471 PolarHBondContact O-N 3.21Å |
| 468 | E | 91.8 | Very high | 89.4 | Confident | 96 Ų | 96 | 97.9 Ų | 97.9 | 45% | 0.449 | 49% | 0.49 | S | S | . | . | H | α-helix | trans | -61.1 | -43.8 | 174.1 | -70.4 | 178.2 | -172.2 | 0 | 0 | 111.8 | Q464 L470 Q471 E472 | Q464-E468 PolarHBondContact O-N 2.93Å; E468-L470 VanDerWaalsContact C-N 3.33Å; E468-L470 PolarHBondContact O-N 2.95Å; E468-Q471 PolarHBondContact O-N 2.98Å; E468-E472 PolarHBondContact O-N 3.13Å |
| 469 | L | 94.8 | Very high | 90.4 | Very high | 96 Ų | 96 | 98.3 Ų | 98.3 | 50% | 0.503 | 48% | 0.48 | S | S | . | . | H | α-helix | trans | -62.3 | -37.7 | 175.4 | 179.8 | 63.8 | 0 | 0 | 0 | 112.6 | L465 R466 R473 | L465-L469 WeakPolarHBondContact O-CB 3.46Å; L465-L469 PolarHBondContact O-N 3.38Å; R466-L469 PolarHBondContact O-N 2.9Å; L469-R473 WeakPolarHBondContact O-CB 3.16Å; L469-R473 WeakPolarHBondContact O-CG 3.49Å; L469-R473 PolarHBondContact O-N 3.46Å |
| 470 | L | 95.2 | Very high | 91.2 | Very high | 101 Ų | 101 | 93.1 Ų | 93.1 | 53% | 0.529 | 47% | 0.47 | S | S | . | . | H | α-helix | trans | -69.6 | -39.8 | 174.1 | -73.1 | 170.5 | 0 | 0 | 0 | 111.7 | R466 A467 E468 R473 L474 | R466-L470 WeakPolarHBondContact O-CG 3.43Å; R466-L470 PolarHBondContact O-N 2.84Å; A467-L470 PolarHBondContact O-N 3.49Å; E468-L470 VanDerWaalsContact C-N 3.33Å; E468-L470 PolarHBondContact O-N 2.95Å; L470-R473 PolarHBondContact O-N 3.38Å; L470-L474 WeakPolarHBondContact O-CG 3.37Å; L470-L474 PolarHBondContact O-N 2.97Å |
| 471 | Q | 92.8 | Very high | 92.1 | Very high | 130 Ų | 130 | 93.8 Ų | 93.8 | 61% | 0.607 | 47% | 0.474 | S | S | * | . | H | α-helix | trans | -62.2 | -47.7 | 176 | -173 | 177 | 44.8 | 0 | 0 | 111.6 | A467 E468 R473 L474 R475 | A467-Q471 WeakPolarHBondContact O-CB 3.33Å; A467-Q471 PolarHBondContact O-N 3.21Å; E468-Q471 PolarHBondContact O-N 2.98Å; Q471-R473 VanDerWaalsContact C-N 3.34Å; Q471-R473 PolarHBondContact O-N 3.24Å; Q471-L474 PolarHBondContact O-N 3.47Å; Q471-R475 VanDerWaalsContact O-CB 3.3Å; Q471-R475 WeakPolarHBondContact O-CB 3.34Å; Q471-R475 PolarHBondContact O-N 2.93Å |
| 472 | E | 92.5 | Very high | 92.5 | Very high | 90 Ų | 90 | 98.9 Ų | 98.9 | 42% | 0.421 | 48% | 0.484 | S | S | . | . | H | α-helix | trans | -67.4 | -32.1 | 176.6 | -76.3 | -59.8 | 123.8 | 0 | 0 | 112.6 | E468 R475 G476 | E468-E472 PolarHBondContact O-N 3.13Å; E472-R475 PolarHBondContact O-N 3Å; E472-R475 WeakPolarHBondContact OE1-CD 3.43Å; E472-R475 IonicContact OE1-CZ 3.32Å; E472-R475 IonicContact OE1-NE 3.92Å; E472-R475 IonicContact OE1-NH1 2.69Å; E472-R475 PolarHBondContact OE1-NH1 2.85Å; E472-R475 IonicContact OE2-NH1 3.55Å; E472-G476 PolarHBondContact O-N 3.13Å |
| 473 | R | 93.8 | Very high | 93 | Very high | 153 Ų | 153 | 102.2 Ų | 102.2 | 58% | 0.577 | 49% | 0.492 | S | S | * | . | H | α-helix | trans | -64.2 | -39.9 | 170.5 | -79.4 | 172.4 | 176.4 | -162.9 | -0.3 | 112.8 | L469 L470 Q471 Q477 | L469-R473 WeakPolarHBondContact O-CB 3.16Å; L469-R473 WeakPolarHBondContact O-CG 3.49Å; L469-R473 PolarHBondContact O-N 3.46Å; L470-R473 PolarHBondContact O-N 3.38Å; Q471-R473 VanDerWaalsContact C-N 3.34Å; Q471-R473 PolarHBondContact O-N 3.24Å; R473-Q477 WeakPolarHBondContact O-CG 3.5Å; R473-Q477 PolarHBondContact O-N 3.39Å; R473-Q477 VanDerWaalsContact O-N 3.08Å; R473-Q477 PolarHBondContact O-NE2 3.34Å; R473-Q477 VanDerWaalsContact O-NE2 3.09Å |
| 474 | L | 95.4 | Very high | 93.5 | Very high | 104 Ų | 104 | 101.9 Ų | 101.9 | 55% | 0.545 | 49% | 0.491 | S | S | . | . | H | α-helix | trans | -69.8 | -44.4 | 175.5 | -70.9 | 166.4 | 0 | 0 | 0 | 110.9 | L470 Q471 G476 Q477 E478 | L470-L474 WeakPolarHBondContact O-CG 3.37Å; L470-L474 PolarHBondContact O-N 2.97Å; Q471-L474 PolarHBondContact O-N 3.47Å; L474-G476 VanDerWaalsContact C-N 3.28Å; L474-G476 PolarHBondContact O-N 2.72Å; L474-Q477 WeakPolarHBondContact O-CB 3.2Å; L474-Q477 PolarHBondContact O-N 3.09Å; L474-Q477 VanDerWaalsContact O-N 3.11Å; L474-E478 PolarHBondContact O-N 3.12Å |
| 475 | R | 92.6 | Very high | 93.8 | Very high | 139 Ų | 139 | 101.8 Ų | 101.8 | 53% | 0.525 | 49% | 0.49 | S | S | . | . | H | α-helix | trans | -58.8 | -38 | 174.5 | -166.5 | -170.5 | -178.8 | -179 | -0.2 | 112.1 | Q471 E472 Q479 | Q471-R475 VanDerWaalsContact O-CB 3.3Å; Q471-R475 WeakPolarHBondContact O-CB 3.34Å; Q471-R475 PolarHBondContact O-N 2.93Å; E472-R475 PolarHBondContact O-N 3Å; E472-R475 WeakPolarHBondContact OE1-CD 3.43Å; E472-R475 IonicContact OE1-CZ 3.32Å; E472-R475 IonicContact OE1-NE 3.92Å; E472-R475 IonicContact OE1-NH1 2.69Å; E472-R475 PolarHBondContact OE1-NH1 2.85Å; E472-R475 IonicContact OE2-NH1 3.55Å; R475-Q479 VanDerWaalsContact O-CG 3.3Å; R475-Q479 WeakPolarHBondContact O-CG 3.48Å; R475-Q479 PolarHBondContact O-N 3.11Å; R475-Q479 PolarHBondContact O-NE2 3.49Å |
| 476 | G | 93.9 | Very high | 94 | Very high | 34 Ų | 34 | 101.1 Ų | 101.1 | 35% | 0.351 | 48% | 0.484 | S | S | . | . | H | α-helix | trans | -67.8 | -40.2 | 173.3 | 0 | 0 | 0 | 0 | 0 | 113.1 | E472 L474 Q479 A480 | E472-G476 PolarHBondContact O-N 3.13Å; L474-G476 VanDerWaalsContact C-N 3.28Å; L474-G476 PolarHBondContact O-N 2.72Å; G476-Q479 PolarHBondContact O-N 2.95Å; G476-A480 WeakPolarHBondContact O-CB 3.2Å; G476-A480 PolarHBondContact O-N 3.16Å |
| 477 | Q | 93.6 | Very high | 94.3 | Very high | 115 Ų | 115 | 101 Ų | 101 | 54% | 0.537 | 48% | 0.484 | S | S | . | . | H | α-helix | trans | -64.3 | -42.9 | 173.1 | -74.6 | 167.1 | 66.3 | 0 | 0 | 111.9 | R473 L474 Q479 A480 L481 | R473-Q477 WeakPolarHBondContact O-CG 3.5Å; R473-Q477 PolarHBondContact O-N 3.39Å; R473-Q477 VanDerWaalsContact O-N 3.08Å; R473-Q477 PolarHBondContact O-NE2 3.34Å; R473-Q477 VanDerWaalsContact O-NE2 3.09Å; L474-Q477 WeakPolarHBondContact O-CB 3.2Å; L474-Q477 PolarHBondContact O-N 3.09Å; L474-Q477 VanDerWaalsContact O-N 3.11Å; Q477-Q479 VanDerWaalsContact C-N 3.33Å; Q477-Q479 PolarHBondContact O-N 3.18Å; Q477-A480 PolarHBondContact O-N 3.25Å; Q477-L481 WeakPolarHBondContact O-CG 3.28Å; Q477-L481 PolarHBondContact O-N 3.08Å |
| 478 | E | 93.4 | Very high | 94.7 | Very high | 101 Ų | 101 | 105.7 Ų | 105.7 | 47% | 0.472 | 49% | 0.489 | S | S | . | . | H | α-helix | trans | -59.3 | -43.1 | 173 | -76.5 | -170.2 | -149.1 | 0 | 0 | 112.3 | L474 L481 R482 | L474-E478 PolarHBondContact O-N 3.12Å; E478-L481 PolarHBondContact O-N 2.73Å; E478-R482 VanDerWaalsContact O-CG 3.24Å; E478-R482 WeakPolarHBondContact O-CG 3.46Å; E478-R482 PolarHBondContact O-N 2.88Å; E478-R482 IonicContact OE2-CZ 3.79Å; E478-R482 IonicContact OE2-NH2 3.39Å; E478-R482 PolarHBondContact OE2-NH2 3.44Å |
| 479 | Q | 90.8 | Very high | 94.9 | Very high | 82 Ų | 82 | 105 Ų | 105 | 38% | 0.383 | 49% | 0.491 | S | S | . | . | H | α-helix | trans | -63.5 | -43.6 | 175.6 | -73.5 | 171.7 | 46.4 | 0 | 0 | 111.5 | R475 G476 Q477 L481 R482 F483 | R475-Q479 VanDerWaalsContact O-CG 3.3Å; R475-Q479 WeakPolarHBondContact O-CG 3.48Å; R475-Q479 PolarHBondContact O-N 3.11Å; R475-Q479 PolarHBondContact O-NE2 3.49Å; G476-Q479 PolarHBondContact O-N 2.95Å; Q477-Q479 VanDerWaalsContact C-N 3.33Å; Q477-Q479 PolarHBondContact O-N 3.18Å; Q479-L481 VanDerWaalsContact C-N 3.34Å; Q479-L481 PolarHBondContact O-N 2.94Å; Q479-R482 PolarHBondContact O-N 2.94Å; Q479-F483 HydrophobicContact CB-CE2 4.25Å; Q479-F483 WeakPolarHBondContact O-CD2 3.34Å; Q479-F483 WeakPolarHBondContact O-CG 3.35Å; Q479-F483 PolarHBondContact O-N 2.76Å |
| 480 | A | 93.1 | Very high | 95.1 | Very high | 47 Ų | 47 | 109.5 Ų | 109.5 | 39% | 0.388 | 50% | 0.502 | S | S | . | . | H | α-helix | trans | -59.1 | -43.2 | 175.8 | 0 | 0 | 0 | 0 | 0 | 112.2 | G476 Q477 F483 E484 | G476-A480 WeakPolarHBondContact O-CB 3.2Å; G476-A480 PolarHBondContact O-N 3.16Å; Q477-A480 PolarHBondContact O-N 3.25Å; A480-F483 PolarHBondContact O-N 3.2Å; A480-E484 PolarHBondContact O-N 3.41Å |
| 481 | L | 96.5 | Very high | 95.2 | Very high | 94 Ų | 94 | 108.8 Ų | 108.8 | 49% | 0.492 | 50% | 0.496 | S | S | . | . | H | α-helix | trans | -65.6 | -37.7 | 175.7 | -71.4 | 171.5 | 0 | 0 | 0 | 112.7 | Q477 E478 Q479 E484 Q485 | Q477-L481 WeakPolarHBondContact O-CG 3.28Å; Q477-L481 PolarHBondContact O-N 3.08Å; E478-L481 PolarHBondContact O-N 2.73Å; Q479-L481 VanDerWaalsContact C-N 3.34Å; Q479-L481 PolarHBondContact O-N 2.94Å; L481-E484 PolarHBondContact O-N 2.79Å; L481-Q485 VanDerWaalsContact O-CG 3.31Å; L481-Q485 WeakPolarHBondContact O-CG 3.46Å; L481-Q485 PolarHBondContact O-N 3.41Å |
| 482 | R | 95.6 | Very high | 95.5 | Very high | 134 Ų | 134 | 107.4 Ų | 107.4 | 51% | 0.506 | 49% | 0.489 | S | S | . | . | H | α-helix | trans | -63.8 | -46.2 | 172.8 | -67.7 | 166.8 | -158 | -158.2 | 7.1 | 110.9 | E478 Q479 E484 Q485 E486 | E478-R482 VanDerWaalsContact O-CG 3.24Å; E478-R482 WeakPolarHBondContact O-CG 3.46Å; E478-R482 PolarHBondContact O-N 2.88Å; E478-R482 IonicContact OE2-CZ 3.79Å; E478-R482 IonicContact OE2-NH2 3.39Å; E478-R482 PolarHBondContact OE2-NH2 3.44Å; Q479-R482 PolarHBondContact O-N 2.94Å; R482-E484 VanDerWaalsContact C-N 3.28Å; R482-E484 PolarHBondContact O-N 2.99Å; R482-Q485 WeakPolarHBondContact O-CB 3.49Å; R482-Q485 PolarHBondContact O-N 2.93Å; R482-Q485 VanDerWaalsContact O-N 3.11Å; R482-E486 WeakPolarHBondContact O-CG 3.19Å; R482-E486 PolarHBondContact O-N 3.33Å |
| 483 | F | 95.3 | Very high | 95.7 | Very high | 105 Ų | 105 | 107.4 Ų | 107.4 | 46% | 0.461 | 49% | 0.489 | S | S | . | . | H | α-helix | trans | -64 | -29.4 | 174.5 | -66.3 | -51.8 | 0 | 0 | 0 | 113.2 | Q479 A480 R487 | Q479-F483 HydrophobicContact CB-CE2 4.25Å; Q479-F483 WeakPolarHBondContact O-CD2 3.34Å; Q479-F483 WeakPolarHBondContact O-CG 3.35Å; Q479-F483 PolarHBondContact O-N 2.76Å; A480-F483 PolarHBondContact O-N 3.2Å; F483-R487 WeakPolarHBondContact O-CB 3.36Å; F483-R487 VanDerWaalsContact O-CG 3.31Å; F483-R487 WeakPolarHBondContact O-CG 3.46Å; F483-R487 PolarHBondContact O-N 3.3Å |
| 484 | E | 97.3 | Very high | 95.9 | Very high | 74 Ų | 74 | 105.4 Ų | 105.4 | 35% | 0.346 | 49% | 0.485 | S | S | . | . | H | α-helix | trans | -68.2 | -41.8 | 169.7 | -82.4 | -166.9 | -153.6 | 0 | 0 | 113 | A480 L481 R482 E486 R487 R488 | A480-E484 PolarHBondContact O-N 3.41Å; L481-E484 PolarHBondContact O-N 2.79Å; R482-E484 VanDerWaalsContact C-N 3.28Å; R482-E484 PolarHBondContact O-N 2.99Å; E484-E486 VanDerWaalsContact C-N 3.35Å; E484-R487 VanDerWaalsContact CG-NH2 3.27Å; E484-R487 PolarHBondContact O-N 2.81Å; E484-R488 VanDerWaalsContact O-CG 3.28Å; E484-R488 WeakPolarHBondContact O-CG 3.29Å; E484-R488 PolarHBondContact O-N 3.18Å; E484-R488 IonicContact OE2-CZ 3.91Å; E484-R488 IonicContact OE2-NH2 3.81Å; E484-R488 PolarHBondContact OE2-NH2 2.79Å |
| 485 | Q | 96.8 | Very high | 96.1 | Very high | 121 Ų | 121 | 103.3 Ų | 103.3 | 57% | 0.565 | 47% | 0.472 | S | S | * | . | H | α-helix | trans | -62.7 | -43.9 | 175.8 | -68.6 | 164.9 | 23.8 | 0 | 0 | 110.5 | L481 R482 R488 T489 | L481-Q485 VanDerWaalsContact O-CG 3.31Å; L481-Q485 WeakPolarHBondContact O-CG 3.46Å; L481-Q485 PolarHBondContact O-N 3.41Å; R482-Q485 WeakPolarHBondContact O-CB 3.49Å; R482-Q485 PolarHBondContact O-N 2.93Å; R482-Q485 VanDerWaalsContact O-N 3.11Å; Q485-R488 PolarHBondContact O-N 3.25Å; Q485-T489 PolarHBondContact O-N 3.21Å; Q485-T489 PolarHBondContact O-OG1 2.92Å |
| 486 | E | 97.4 | Very high | 96.4 | Very high | 100 Ų | 100 | 102 Ų | 102 | 47% | 0.467 | 47% | 0.467 | S | S | . | . | H | α-helix | trans | -60.3 | -44.3 | 172.4 | -70.6 | 174 | -170 | 0 | 0 | 112.4 | R482 E484 R488 T489 W490 | R482-E486 WeakPolarHBondContact O-CG 3.19Å; R482-E486 PolarHBondContact O-N 3.33Å; E484-E486 VanDerWaalsContact C-N 3.35Å; E486-R488 VanDerWaalsContact C-N 3.28Å; E486-R488 PolarHBondContact O-N 3.26Å; E486-T489 PolarHBondContact O-N 3.48Å; E486-T489 PolarHBondContact O-OG1 3.01Å; E486-W490 WeakPolarHBondContact O-CB 3.38Å; E486-W490 VanDerWaalsContact O-CD1 3.24Å; E486-W490 PolarHBondContact O-N 3.43Å |
| 487 | R | 97.8 | Very high | 96.6 | Very high | 149 Ų | 149 | 103.4 Ų | 103.4 | 56% | 0.562 | 47% | 0.468 | S | S | * | . | H | α-helix | trans | -60.3 | -37 | 174.8 | -79.6 | -174.1 | -67.5 | -90.9 | 4.9 | 112.4 | F483 E484 Q491 | F483-R487 WeakPolarHBondContact O-CB 3.36Å; F483-R487 VanDerWaalsContact O-CG 3.31Å; F483-R487 WeakPolarHBondContact O-CG 3.46Å; F483-R487 PolarHBondContact O-N 3.3Å; E484-R487 VanDerWaalsContact CG-NH2 3.27Å; E484-R487 PolarHBondContact O-N 2.81Å; R487-Q491 WeakPolarHBondContact O-CB 3.37Å; R487-Q491 PolarHBondContact O-N 2.95Å |
| 488 | R | 97.7 | Very high | 96.8 | Very high | 155 Ų | 155 | 100.6 Ų | 100.6 | 59% | 0.585 | 46% | 0.457 | S | S | * | . | H | α-helix | trans | -67.7 | -47.4 | 176.3 | -67.7 | 169.1 | -157.2 | -159.2 | 7.6 | 111.3 | E484 Q485 E486 W490 Q491 E492 | E484-R488 VanDerWaalsContact O-CG 3.28Å; E484-R488 WeakPolarHBondContact O-CG 3.29Å; E484-R488 PolarHBondContact O-N 3.18Å; E484-R488 IonicContact OE2-CZ 3.91Å; E484-R488 IonicContact OE2-NH2 3.81Å; E484-R488 PolarHBondContact OE2-NH2 2.79Å; Q485-R488 PolarHBondContact O-N 3.25Å; E486-R488 VanDerWaalsContact C-N 3.28Å; E486-R488 PolarHBondContact O-N 3.26Å; R488-W490 PolarHBondContact O-N 2.89Å; R488-Q491 PolarHBondContact O-N 3.4Å; R488-E492 PolarHBondContact O-N 3.36Å |
| 489 | T | 97.2 | Very high | 97.1 | Very high | 80 Ų | 80 | 101.4 Ų | 101.4 | 49% | 0.491 | 46% | 0.456 | S | S | . | . | H | α-helix | trans | -65.3 | -38.2 | 178.5 | 57.6 | 0 | 0 | 0 | 0 | 112.4 | Q485 E486 E492 E493 | Q485-T489 PolarHBondContact O-N 3.21Å; Q485-T489 PolarHBondContact O-OG1 2.92Å; E486-T489 PolarHBondContact O-N 3.48Å; E486-T489 PolarHBondContact O-OG1 3.01Å; T489-E492 PolarHBondContact O-N 3.46Å; T489-E493 WeakPolarHBondContact O-CB 3.5Å; T489-E493 PolarHBondContact O-N 2.71Å |
| 490 | W | 98.3 | Very high | 97.4 | Very high | 192 Ų | 192 | 104.2 Ų | 104.2 | 73% | 0.727 | 46% | 0.464 | S | S | * | . | H | α-helix | trans | -62.9 | -41.5 | 172.2 | -87.1 | 109.8 | 0 | 0 | 0 | 113.1 | E486 R488 E493 K494 | E486-W490 WeakPolarHBondContact O-CB 3.38Å; E486-W490 VanDerWaalsContact O-CD1 3.24Å; E486-W490 PolarHBondContact O-N 3.43Å; R488-W490 PolarHBondContact O-N 2.89Å; W490-E493 PolarHBondContact O-N 2.7Å; W490-K494 VanDerWaalsContact O-CB 3.24Å; W490-K494 WeakPolarHBondContact O-CB 3.35Å; W490-K494 PolarHBondContact O-N 3.3Å |
| 491 | Q | 97.8 | Very high | 97.7 | Very high | 86 Ų | 86 | 106.3 Ų | 106.3 | 40% | 0.402 | 47% | 0.466 | S | S | . | . | H | α-helix | trans | -70.4 | -35.4 | 177 | 178.5 | 56 | 35 | 0 | 0 | 111.9 | R487 R488 E495 | R487-Q491 WeakPolarHBondContact O-CB 3.37Å; R487-Q491 PolarHBondContact O-N 2.95Å; R488-Q491 PolarHBondContact O-N 3.4Å; Q491-E495 PolarHBondContact NE2-OE1 2.87Å; Q491-E495 WeakPolarHBondContact O-CG 3.34Å; Q491-E495 PolarHBondContact O-N 3.36Å; Q491-E495 VanDerWaalsContact O-N 3.07Å |
| 492 | E | 98.3 | Very high | 97.8 | Very high | 101 Ų | 101 | 108 Ų | 108 | 47% | 0.472 | 47% | 0.465 | S | S | . | . | H | α-helix | trans | -62.5 | -48.2 | 170.6 | -78.7 | -174.7 | -136.1 | 0 | 0 | 112.5 | R488 T489 K494 E495 R496 | R488-E492 PolarHBondContact O-N 3.36Å; T489-E492 PolarHBondContact O-N 3.46Å; E492-K494 VanDerWaalsContact C-N 3.35Å; E492-E495 PolarHBondContact O-N 3.38Å; E492-E495 VanDerWaalsContact O-N 3.15Å; E492-R496 WeakPolarHBondContact O-CG 3.42Å; E492-R496 PolarHBondContact O-N 3.14Å; E492-R496 IonicContact OE2-CZ 2.69Å; E492-R496 IonicContact OE2-NH2 3.61Å; E492-R496 PolarHBondContact OE2-NH2 3.46Å |
| 493 | E | 98 | Very high | 97.9 | Very high | 89 Ų | 89 | 107.6 Ų | 107.6 | 42% | 0.416 | 47% | 0.469 | S | S | . | . | H | α-helix | trans | -65.1 | -40.2 | -179.1 | -168.6 | 60.2 | -152.1 | 0 | 0 | 111.2 | T489 W490 E495 R496 V497 | T489-E493 WeakPolarHBondContact O-CB 3.5Å; T489-E493 PolarHBondContact O-N 2.71Å; W490-E493 PolarHBondContact O-N 2.7Å; E493-E495 VanDerWaalsContact C-N 3.33Å; E493-E495 PolarHBondContact O-N 3.29Å; E493-R496 WeakPolarHBondContact O-CB 3.42Å; E493-R496 PolarHBondContact O-N 3.31Å; E493-R496 VanDerWaalsContact O-N 3.12Å; E493-R496 VanDerWaalsContact OE2-CD 3.3Å; E493-R496 WeakPolarHBondContact OE2-CD 3.44Å; E493-R496 IonicContact OE2-CZ 3.99Å; E493-R496 IonicContact OE2-NE 2.73Å; E493-R496 IonicContact OE2-NH1 3.64Å; E493-R496 PolarHBondContact OE2-NH1 3.12Å; E493-V497 WeakPolarHBondContact O-CG2 3.34Å; E493-V497 PolarHBondContact O-N 2.96Å |
| 494 | K | 98.4 | Very high | 98 | Very high | 112 Ų | 112 | 107 Ų | 107 | 49% | 0.487 | 47% | 0.47 | S | S | . | . | H | α-helix | trans | -55.6 | -45.2 | 169.7 | 174.8 | 179.9 | 158.8 | -157.1 | 0 | 111.9 | W490 E492 V497 L498 | W490-K494 VanDerWaalsContact O-CB 3.24Å; W490-K494 WeakPolarHBondContact O-CB 3.35Å; W490-K494 PolarHBondContact O-N 3.3Å; E492-K494 VanDerWaalsContact C-N 3.35Å; K494-V497 PolarHBondContact O-N 3.1Å; K494-L498 HydrophobicContact CG-CD1 4.04Å; K494-L498 WeakPolarHBondContact O-CB 3.36Å; K494-L498 VanDerWaalsContact O-CG 3.27Å; K494-L498 WeakPolarHBondContact O-CG 3.34Å; K494-L498 PolarHBondContact O-N 3.18Å |
| 495 | E | 98.4 | Very high | 98.1 | Very high | 60 Ų | 60 | 109.2 Ų | 109.2 | 28% | 0.28 | 48% | 0.48 | S | S | . | . | H | α-helix | trans | -69.6 | -29.3 | 176.1 | -72 | -52.7 | 141.7 | 0 | 0 | 113.7 | Q491 E492 E493 R499 R502 | Q491-E495 PolarHBondContact NE2-OE1 2.87Å; Q491-E495 WeakPolarHBondContact O-CG 3.34Å; Q491-E495 PolarHBondContact O-N 3.36Å; Q491-E495 VanDerWaalsContact O-N 3.07Å; E492-E495 PolarHBondContact O-N 3.38Å; E492-E495 VanDerWaalsContact O-N 3.15Å; E493-E495 VanDerWaalsContact C-N 3.33Å; E493-E495 PolarHBondContact O-N 3.29Å; E495-R499 WeakPolarHBondContact O-CB 3.47Å; E495-R499 WeakPolarHBondContact O-CG 3.33Å; E495-R499 PolarHBondContact O-N 2.94Å; E495-R502 IonicContact OE2-NH2 2.66Å |
| 496 | R | 98.6 | Very high | 98.1 | Very high | 112 Ų | 112 | 105 Ų | 105 | 42% | 0.423 | 47% | 0.47 | S | S | . | . | H | α-helix | trans | -65.6 | -48.2 | 170.6 | -64.8 | 166.2 | -156.2 | 168.5 | -1.7 | 110.5 | E492 E493 L498 R499 Y500 | E492-R496 WeakPolarHBondContact O-CG 3.42Å; E492-R496 PolarHBondContact O-N 3.14Å; E492-R496 IonicContact OE2-CZ 2.69Å; E492-R496 IonicContact OE2-NH2 3.61Å; E492-R496 PolarHBondContact OE2-NH2 3.46Å; E493-R496 WeakPolarHBondContact O-CB 3.42Å; E493-R496 PolarHBondContact O-N 3.31Å; E493-R496 VanDerWaalsContact O-N 3.12Å; E493-R496 VanDerWaalsContact OE2-CD 3.3Å; E493-R496 WeakPolarHBondContact OE2-CD 3.44Å; E493-R496 IonicContact OE2-CZ 3.99Å; E493-R496 IonicContact OE2-NE 2.73Å; E493-R496 IonicContact OE2-NH1 3.64Å; E493-R496 PolarHBondContact OE2-NH1 3.12Å; R496-L498 PolarHBondContact O-N 3.22Å; R496-R499 PolarHBondContact O-N 2.92Å; R496-Y500 WeakPolarHBondContact O-CB 3.34Å; R496-Y500 PolarHBondContact O-N 2.9Å |
| 497 | V | 98.6 | Very high | 98.2 | Very high | 62 Ų | 62 | 102.4 Ų | 102.4 | 38% | 0.376 | 47% | 0.469 | S | S | . | . | H | α-helix | trans | -60.5 | -44.3 | 175.9 | 172.4 | 0 | 0 | 0 | 0 | 111.4 | E493 K494 Y500 Q501 | E493-V497 WeakPolarHBondContact O-CG2 3.34Å; E493-V497 PolarHBondContact O-N 2.96Å; K494-V497 PolarHBondContact O-N 3.1Å; V497-Y500 PolarHBondContact O-N 3.39Å; V497-Q501 HydrophobicContact CG1-CG 4.39Å; V497-Q501 WeakPolarHBondContact O-CB 3.41Å; V497-Q501 VanDerWaalsContact O-CG 3.31Å; V497-Q501 WeakPolarHBondContact O-CG 3.48Å; V497-Q501 PolarHBondContact O-N 3.25Å |
| 498 | L | 98.5 | Very high | 98.2 | Very high | 56 Ų | 56 | 101.5 Ų | 101.5 | 29% | 0.293 | 47% | 0.466 | S | S | . | . | H | α-helix | trans | -66.5 | -35.5 | 177.8 | -72 | 173.5 | 0 | 0 | 0 | 112.8 | K494 R496 R502 | K494-L498 HydrophobicContact CG-CD1 4.04Å; K494-L498 WeakPolarHBondContact O-CB 3.36Å; K494-L498 VanDerWaalsContact O-CG 3.27Å; K494-L498 WeakPolarHBondContact O-CG 3.34Å; K494-L498 PolarHBondContact O-N 3.18Å; R496-L498 PolarHBondContact O-N 3.22Å; L498-R502 WeakPolarHBondContact O-CG 3.32Å; L498-R502 PolarHBondContact O-N 2.83Å; L498-R502 PolarHBondContact O-NE 3.16Å |
| 499 | R | 98.3 | Very high | 98.2 | Very high | 118 Ų | 118 | 98.7 Ų | 98.7 | 45% | 0.445 | 46% | 0.461 | S | S | . | . | H | α-helix | trans | -63.6 | -51.2 | 170.2 | -78.9 | -173.4 | -66.4 | -89.6 | 1 | 111.3 | E495 R496 Q501 R502 E503 | E495-R499 WeakPolarHBondContact O-CB 3.47Å; E495-R499 WeakPolarHBondContact O-CG 3.33Å; E495-R499 PolarHBondContact O-N 2.94Å; R496-R499 PolarHBondContact O-N 2.92Å; R499-Q501 VanDerWaalsContact C-N 3.32Å; R499-Q501 PolarHBondContact O-N 2.93Å; R499-R502 WeakPolarHBondContact O-CB 3.35Å; R499-R502 PolarHBondContact O-N 3.48Å; R499-E503 WeakPolarHBondContact O-CG 3.47Å; R499-E503 PolarHBondContact O-N 3.14Å |
| 500 | Y | 98.3 | Very high | 98.3 | Very high | 142 Ų | 142 | 97.9 Ų | 97.9 | 56% | 0.557 | 45% | 0.454 | S | S | * | . | H | α-helix | trans | -59.7 | -39.3 | -179.9 | -178 | -116.6 | 0 | 0 | 0 | 113.2 | R496 V497 E503 I504 | R496-Y500 WeakPolarHBondContact O-CB 3.34Å; R496-Y500 PolarHBondContact O-N 2.9Å; V497-Y500 PolarHBondContact O-N 3.39Å; Y500-E503 PolarHBondContact O-N 3.13Å; Y500-I504 HydrophobicContact CD1-CD1 4.11Å; Y500-I504 HydrophobicContact CE1-CD1 3.56Å; Y500-I504 HydrophobicContact CE2-CD1 4.1Å; Y500-I504 HydrophobicContact CE2-CG1 4.37Å; Y500-I504 PolarHBondContact O-N 3.26Å |
| 501 | Q | 98.2 | Very high | 98.3 | Very high | 91 Ų | 91 | 92.4 Ų | 92.4 | 43% | 0.425 | 44% | 0.437 | S | S | . | . | H | α-helix | trans | -63.2 | -43.4 | 173.3 | -75.2 | 175.6 | -4.9 | 0 | 0 | 112.1 | V497 R499 I504 Q505 | V497-Q501 HydrophobicContact CG1-CG 4.39Å; V497-Q501 WeakPolarHBondContact O-CB 3.41Å; V497-Q501 VanDerWaalsContact O-CG 3.31Å; V497-Q501 WeakPolarHBondContact O-CG 3.48Å; V497-Q501 PolarHBondContact O-N 3.25Å; R499-Q501 VanDerWaalsContact C-N 3.32Å; R499-Q501 PolarHBondContact O-N 2.93Å; Q501-I504 PolarHBondContact O-N 3.25Å; Q501-Q505 WeakPolarHBondContact O-CB 3.11Å; Q501-Q505 WeakPolarHBondContact O-CG 3.49Å; Q501-Q505 PolarHBondContact O-N 2.86Å |
| 502 | R | 98.4 | Very high | 98.3 | Very high | 129 Ų | 129 | 93.5 Ų | 93.5 | 49% | 0.487 | 44% | 0.439 | S | S | . | . | H | α-helix | trans | -64.1 | -38.4 | 174.7 | -72.8 | -179.5 | -68.9 | -110 | 2.9 | 112.2 | E495 L498 R499 Q505 G506 | E495-R502 IonicContact OE2-NH2 2.66Å; L498-R502 WeakPolarHBondContact O-CG 3.32Å; L498-R502 PolarHBondContact O-N 2.83Å; L498-R502 PolarHBondContact O-NE 3.16Å; R499-R502 WeakPolarHBondContact O-CB 3.35Å; R499-R502 PolarHBondContact O-N 3.48Å; R502-Q505 PolarHBondContact O-N 3.18Å; R502-G506 PolarHBondContact O-N 2.83Å |
| 503 | E | 98.3 | Very high | 98.3 | Very high | 126 Ų | 126 | 96 Ų | 96 | 59% | 0.589 | 44% | 0.444 | S | S | * | . | H | α-helix | trans | -64.2 | -45.4 | 176.1 | -72.5 | 160.9 | -152.9 | 0 | 0 | 111.9 | R499 Y500 G507 | R499-E503 WeakPolarHBondContact O-CG 3.47Å; R499-E503 PolarHBondContact O-N 3.14Å; Y500-E503 PolarHBondContact O-N 3.13Å; E503-G507 PolarHBondContact O-N 2.84Å |
| 504 | I | 98.3 | Very high | 98.3 | Very high | 92 Ų | 92 | 99.6 Ų | 99.6 | 47% | 0.472 | 45% | 0.453 | S | S | . | . | H | α-helix | trans | -61.9 | -46.4 | 173.6 | -73.5 | 177.1 | 0 | 0 | 0 | 111.3 | Y500 Q501 G507 Y508 | Y500-I504 HydrophobicContact CD1-CD1 4.11Å; Y500-I504 HydrophobicContact CE1-CD1 3.56Å; Y500-I504 HydrophobicContact CE2-CD1 4.1Å; Y500-I504 HydrophobicContact CE2-CG1 4.37Å; Y500-I504 PolarHBondContact O-N 3.26Å; Q501-I504 PolarHBondContact O-N 3.25Å; I504-G507 PolarHBondContact O-N 2.89Å; I504-Y508 WeakPolarHBondContact O-CB 3.32Å; I504-Y508 PolarHBondContact O-N 3.48Å |
| 505 | Q | 98.2 | Very high | 98.3 | Very high | 121 Ų | 121 | 97.8 Ų | 97.8 | 57% | 0.565 | 45% | 0.449 | S | S | * | . | H | α-helix | trans | -63 | -44.2 | -180 | -73.4 | 168.6 | 0.2 | 0 | 0 | 111.5 | Q501 R502 Y508 M509 | Q501-Q505 WeakPolarHBondContact O-CB 3.11Å; Q501-Q505 WeakPolarHBondContact O-CG 3.49Å; Q501-Q505 PolarHBondContact O-N 2.86Å; R502-Q505 PolarHBondContact O-N 3.18Å; Q505-Y508 PolarHBondContact O-N 3.48Å; Q505-M509 VanDerWaalsContact O-CG 3.27Å; Q505-M509 WeakPolarHBondContact O-CG 3.31Å; Q505-M509 PolarHBondContact O-N 3.06Å |
| 506 | G | 98.3 | Very high | 98.3 | Very high | 33 Ų | 33 | 98.5 Ų | 98.5 | 34% | 0.34 | 45% | 0.452 | S | S | . | . | H | α-helix | trans | -61.1 | -49.1 | 174.1 | 0 | 0 | 0 | 0 | 0 | 112.3 | R502 Y508 M509 D510 | R502-G506 PolarHBondContact O-N 2.83Å; G506-Y508 VanDerWaalsContact C-N 3.33Å; G506-Y508 PolarHBondContact O-N 2.89Å; G506-M509 PolarHBondContact O-N 3.33Å; G506-M509 VanDerWaalsContact O-N 3.17Å; G506-D510 PolarHBondContact O-N 3.37Å |
| 507 | G | 98.2 | Very high | 98.2 | Very high | 44 Ų | 44 | 95.1 Ų | 95.1 | 45% | 0.454 | 45% | 0.448 | S | S | . | . | H | α-helix | trans | -60.7 | -38.2 | 177.9 | 0 | 0 | 0 | 0 | 0 | 113.5 | E503 I504 M511 | E503-G507 PolarHBondContact O-N 2.84Å; I504-G507 PolarHBondContact O-N 2.89Å; G507-M511 VanDerWaalsContact O-CB 3.24Å; G507-M511 WeakPolarHBondContact O-CB 3.37Å; G507-M511 PolarHBondContact O-N 3.48Å |
| 508 | Y | 98.5 | Very high | 98.1 | Very high | 130 Ų | 130 | 96.3 Ų | 96.3 | 51% | 0.51 | 45% | 0.452 | S | S | . | . | H | α-helix | trans | -64.4 | -46.8 | 172.6 | 177.7 | -93.7 | 0 | 0 | 0 | 111.8 | I504 Q505 G506 D510 M511 Y512 | I504-Y508 WeakPolarHBondContact O-CB 3.32Å; I504-Y508 PolarHBondContact O-N 3.48Å; Q505-Y508 PolarHBondContact O-N 3.48Å; G506-Y508 VanDerWaalsContact C-N 3.33Å; G506-Y508 PolarHBondContact O-N 2.89Å; Y508-D510 PolarHBondContact O-N 3.22Å; Y508-M511 HydrophobicContact CD2-CE 3.66Å; Y508-M511 HydrophobicContact CE2-CE 3.77Å; Y508-M511 HydrophobicContact CG-CE 4.43Å; Y508-M511 PolarHBondContact O-N 3.27Å; Y508-Y512 VanDerWaalsContact O-CB 3.32Å; Y508-Y512 WeakPolarHBondContact O-CB 3.44Å; Y508-Y512 PolarHBondContact O-N 3.29Å |
| 509 | M | 98.3 | Very high | 98 | Very high | 96 Ų | 96 | 98.6 Ų | 98.6 | 47% | 0.473 | 46% | 0.461 | S | S | . | . | H | α-helix | trans | -65.3 | -38.5 | -180 | -68.7 | -64.3 | 172.6 | 0 | 0 | 112.3 | Q505 G506 Y512 R513 | Q505-M509 VanDerWaalsContact O-CG 3.27Å; Q505-M509 WeakPolarHBondContact O-CG 3.31Å; Q505-M509 PolarHBondContact O-N 3.06Å; G506-M509 PolarHBondContact O-N 3.33Å; G506-M509 VanDerWaalsContact O-N 3.17Å; M509-Y512 PolarHBondContact O-N 3.01Å; M509-R513 WeakPolarHBondContact O-CB 3.22Å; M509-R513 WeakPolarHBondContact O-CD 3.46Å; M509-R513 WeakPolarHBondContact O-CG 3.49Å; M509-R513 PolarHBondContact O-N 3.24Å |
| 510 | D | 98 | Very high | 97.9 | Very high | 63 Ų | 63 | 98.1 Ų | 98.1 | 34% | 0.337 | 46% | 0.464 | S | S | . | . | H | α-helix | trans | -70.2 | -38.2 | 175.5 | -80 | -10.3 | 0 | 0 | 0 | 112.8 | G506 Y508 R513 R514 | G506-D510 PolarHBondContact O-N 3.37Å; Y508-D510 PolarHBondContact O-N 3.22Å; D510-R513 IonicContact OD1-CZ 3.76Å; D510-R513 IonicContact OD1-NH1 3.38Å; D510-R513 PolarHBondContact OD1-NH1 2.95Å; D510-R514 WeakPolarHBondContact O-CB 3.4Å; D510-R514 WeakPolarHBondContact O-CD 3.43Å; D510-R514 WeakPolarHBondContact O-CG 3.47Å; D510-R514 PolarHBondContact O-N 2.91Å |
| 511 | M | 98.3 | Very high | 97.8 | Very high | 77 Ų | 77 | 96.9 Ų | 96.9 | 38% | 0.379 | 46% | 0.463 | S | S | . | . | H | α-helix | trans | -62 | -44.3 | 170.9 | 178.2 | -78.4 | -58.2 | 0 | 0 | 110.9 | G507 Y508 R514 N515 | G507-M511 VanDerWaalsContact O-CB 3.24Å; G507-M511 WeakPolarHBondContact O-CB 3.37Å; G507-M511 PolarHBondContact O-N 3.48Å; Y508-M511 HydrophobicContact CD2-CE 3.66Å; Y508-M511 HydrophobicContact CE2-CE 3.77Å; Y508-M511 HydrophobicContact CG-CE 4.43Å; Y508-M511 PolarHBondContact O-N 3.27Å; M511-R514 PolarHBondContact O-N 3.26Å; M511-N515 PolarHBondContact O-N 3.5Å; M511-N515 PolarHBondContact SD-ND2 2.92Å |
| 512 | Y | 98.3 | Very high | 97.6 | Very high | 110 Ų | 110 | 97.1 Ų | 97.1 | 43% | 0.431 | 47% | 0.467 | S | S | . | . | H | α-helix | trans | -63.2 | -45.7 | 177.9 | -176.6 | -105.7 | 0 | 0 | 0 | 112.3 | Y508 M509 R514 N515 Q516 | Y508-Y512 VanDerWaalsContact O-CB 3.32Å; Y508-Y512 WeakPolarHBondContact O-CB 3.44Å; Y508-Y512 PolarHBondContact O-N 3.29Å; M509-Y512 PolarHBondContact O-N 3.01Å; Y512-R514 VanDerWaalsContact C-N 3.34Å; Y512-R514 PolarHBondContact O-N 2.89Å; Y512-N515 PolarHBondContact O-N 2.88Å; Y512-Q516 HydrophobicContact CD1-CG 4.43Å; Y512-Q516 HydrophobicContact CE1-CG 4.07Å; Y512-Q516 VanDerWaalsContact CZ-NE2 3.34Å; Y512-Q516 WeakPolarHBondContact O-CG 3.41Å; Y512-Q516 PolarHBondContact O-N 3.42Å; Y512-Q516 PolarHBondContact OH-NE2 2.83Å; Y512-Q516 VanDerWaalsContact OH-NE2 3.07Å |
| 513 | R | 98.3 | Very high | 97.4 | Very high | 154 Ų | 154 | 97.4 Ų | 97.4 | 58% | 0.581 | 47% | 0.468 | S | S | * | . | H | α-helix | trans | -57.5 | -44.1 | 173.2 | -72.2 | 162.1 | -177.7 | 158.7 | -2.7 | 112.1 | M509 D510 Q516 A517 | M509-R513 WeakPolarHBondContact O-CB 3.22Å; M509-R513 WeakPolarHBondContact O-CD 3.46Å; M509-R513 WeakPolarHBondContact O-CG 3.49Å; M509-R513 PolarHBondContact O-N 3.24Å; D510-R513 IonicContact OD1-CZ 3.76Å; D510-R513 IonicContact OD1-NH1 3.38Å; D510-R513 PolarHBondContact OD1-NH1 2.95Å; R513-Q516 PolarHBondContact O-N 3.3Å; R513-A517 PolarHBondContact O-N 3.13Å |
| 514 | R | 98.1 | Very high | 97 | Very high | 164 Ų | 164 | 94.7 Ų | 94.7 | 62% | 0.619 | 47% | 0.467 | S | S | * | . | H | α-helix | trans | -65.2 | -42.8 | 177.8 | -70.4 | 167.3 | -161.6 | 179.9 | 8.4 | 111.6 | D510 M511 Y512 A517 L518 | D510-R514 WeakPolarHBondContact O-CB 3.4Å; D510-R514 WeakPolarHBondContact O-CD 3.43Å; D510-R514 WeakPolarHBondContact O-CG 3.47Å; D510-R514 PolarHBondContact O-N 2.91Å; M511-R514 PolarHBondContact O-N 3.26Å; Y512-R514 VanDerWaalsContact C-N 3.34Å; Y512-R514 PolarHBondContact O-N 2.89Å; R514-A517 PolarHBondContact O-N 3.15Å; R514-L518 WeakPolarHBondContact O-CG 3.44Å; R514-L518 PolarHBondContact O-N 2.89Å |
| 515 | N | 97.9 | Very high | 96.6 | Very high | 73 Ų | 73 | 97.2 Ų | 97.2 | 39% | 0.39 | 48% | 0.481 | S | S | . | . | H | α-helix | trans | -63.1 | -43.5 | 174.3 | -76.7 | -0.3 | 0 | 0 | 0 | 111.6 | M511 Y512 A517 L518 E519 | M511-N515 PolarHBondContact O-N 3.5Å; M511-N515 PolarHBondContact SD-ND2 2.92Å; Y512-N515 PolarHBondContact O-N 2.88Å; N515-A517 VanDerWaalsContact C-N 3.29Å; N515-A517 PolarHBondContact O-N 3.2Å; N515-L518 PolarHBondContact O-N 3.46Å; N515-E519 WeakPolarHBondContact O-CB 3.34Å; N515-E519 VanDerWaalsContact O-CG 3.31Å; N515-E519 WeakPolarHBondContact O-CG 3.44Å; N515-E519 PolarHBondContact O-N 2.85Å |
| 516 | Q | 97.8 | Very high | 96.1 | Very high | 76 Ų | 76 | 101.2 Ų | 101.2 | 36% | 0.355 | 49% | 0.491 | S | S | . | . | H | α-helix | trans | -59.7 | -37.1 | 174.5 | -77.3 | -169.3 | -26.8 | 0 | 0 | 112.9 | Y512 R513 Q520 | Y512-Q516 HydrophobicContact CD1-CG 4.43Å; Y512-Q516 HydrophobicContact CE1-CG 4.07Å; Y512-Q516 VanDerWaalsContact CZ-NE2 3.34Å; Y512-Q516 WeakPolarHBondContact O-CG 3.41Å; Y512-Q516 PolarHBondContact O-N 3.42Å; Y512-Q516 PolarHBondContact OH-NE2 2.83Å; Y512-Q516 VanDerWaalsContact OH-NE2 3.07Å; R513-Q516 PolarHBondContact O-N 3.3Å; Q516-Q520 VanDerWaalsContact O-CG 3.31Å; Q516-Q520 WeakPolarHBondContact O-CG 3.39Å; Q516-Q520 PolarHBondContact O-N 2.93Å; Q516-Q520 VanDerWaalsContact O-N 3.15Å; Q516-Q520 PolarHBondContact O-NE2 3.15Å |
| 517 | A | 97.4 | Very high | 95.3 | Very high | 40 Ų | 40 | 106.8 Ų | 106.8 | 33% | 0.331 | 51% | 0.508 | S | S | . | . | H | α-helix | trans | -67.5 | -49.1 | 174.7 | 0 | 0 | 0 | 0 | 0 | 111.6 | R513 R514 N515 E519 Q520 E521 | R513-A517 PolarHBondContact O-N 3.13Å; R514-A517 PolarHBondContact O-N 3.15Å; N515-A517 VanDerWaalsContact C-N 3.29Å; N515-A517 PolarHBondContact O-N 3.2Å; A517-E519 VanDerWaalsContact C-N 3.27Å; A517-E519 PolarHBondContact O-N 3Å; A517-Q520 WeakPolarHBondContact O-CA 3.4Å; A517-Q520 WeakPolarHBondContact O-CB 3.23Å; A517-Q520 PolarHBondContact O-N 3.27Å; A517-E521 PolarHBondContact O-N 3.48Å |
| 518 | L | 97.4 | Very high | 93.9 | Very high | 88 Ų | 88 | 109.9 Ų | 109.9 | 46% | 0.461 | 52% | 0.52 | S | S | . | . | H | α-helix | trans | -60.5 | -35.6 | 175.9 | -68.3 | 169 | 0 | 0 | 0 | 112.3 | R514 N515 Q520 E521 L522 | R514-L518 WeakPolarHBondContact O-CG 3.44Å; R514-L518 PolarHBondContact O-N 2.89Å; N515-L518 PolarHBondContact O-N 3.46Å; L518-Q520 VanDerWaalsContact C-N 3.32Å; L518-E521 PolarHBondContact O-N 3.21Å; L518-L522 VanDerWaalsContact O-CB 3.25Å; L518-L522 WeakPolarHBondContact O-CB 3.34Å; L518-L522 WeakPolarHBondContact O-CG 3.03Å; L518-L522 PolarHBondContact O-N 2.92Å |
| 519 | E | 96.1 | Very high | 92.4 | Very high | 103 Ų | 103 | 109.6 Ų | 109.6 | 48% | 0.481 | 53% | 0.534 | S | S | . | . | H | α-helix | trans | -68.4 | -28.1 | 173 | -77.5 | 176.4 | -170.3 | 0 | 0 | 113.2 | N515 A517 R523 | N515-E519 WeakPolarHBondContact O-CB 3.34Å; N515-E519 VanDerWaalsContact O-CG 3.31Å; N515-E519 WeakPolarHBondContact O-CG 3.44Å; N515-E519 PolarHBondContact O-N 2.85Å; A517-E519 VanDerWaalsContact C-N 3.27Å; A517-E519 PolarHBondContact O-N 3Å; E519-R523 WeakPolarHBondContact O-CB 3.37Å; E519-R523 WeakPolarHBondContact O-CG 3.2Å; E519-R523 PolarHBondContact O-N 3.11Å; E519-R523 VanDerWaalsContact O-N 3.13Å; E519-R523 PolarHBondContact O-NE 3.34Å; E519-R523 IonicContact OE2-NH2 3.07Å |
| 520 | Q | 96.3 | Very high | 90.8 | Very high | 109 Ų | 109 | 111.2 Ų | 111.2 | 51% | 0.509 | 55% | 0.549 | S | S | . | . | H | α-helix | trans | -75.8 | -44 | 173.3 | -75 | 165.1 | 79.6 | 0 | 0 | 110.6 | Q516 A517 L518 R523 A524 | Q516-Q520 VanDerWaalsContact O-CG 3.31Å; Q516-Q520 WeakPolarHBondContact O-CG 3.39Å; Q516-Q520 PolarHBondContact O-N 2.93Å; Q516-Q520 VanDerWaalsContact O-N 3.15Å; Q516-Q520 PolarHBondContact O-NE2 3.15Å; A517-Q520 WeakPolarHBondContact O-CA 3.4Å; A517-Q520 WeakPolarHBondContact O-CB 3.23Å; A517-Q520 PolarHBondContact O-N 3.27Å; L518-Q520 VanDerWaalsContact C-N 3.32Å; Q520-R523 WeakPolarHBondContact O-CB 3.47Å; Q520-R523 PolarHBondContact O-N 2.64Å; Q520-R523 VanDerWaalsContact O-N 3.11Å; Q520-A524 PolarHBondContact O-N 3.11Å |
| 521 | E | 95.8 | Very high | 88.7 | Confident | 116 Ų | 116 | 113.3 Ų | 113.3 | 54% | 0.542 | 57% | 0.566 | S | S | . | * | H | α-helix | trans | -59 | -46.7 | 172.3 | -68.6 | 172.6 | -166.9 | 0 | 0 | 111.4 | A517 L518 R523 A524 L525 | A517-E521 PolarHBondContact O-N 3.48Å; L518-E521 PolarHBondContact O-N 3.21Å; E521-R523 PolarHBondContact O-N 2.8Å; E521-A524 PolarHBondContact O-N 3.45Å; E521-L525 WeakPolarHBondContact O-CB 3.36Å; E521-L525 VanDerWaalsContact O-CG 3.31Å; E521-L525 WeakPolarHBondContact O-CG 3.48Å; E521-L525 PolarHBondContact O-N 3.15Å |
| 522 | L | 94.3 | Very high | 86.6 | Confident | 95 Ų | 95 | 120.4 Ų | 120.4 | 50% | 0.497 | 59% | 0.589 | S | S | . | * | H | α-helix | trans | -65.6 | -23 | 175.1 | -74.5 | 171 | 0 | 0 | 0 | 113.6 | L518 R526 | L518-L522 VanDerWaalsContact O-CB 3.25Å; L518-L522 WeakPolarHBondContact O-CB 3.34Å; L518-L522 WeakPolarHBondContact O-CG 3.03Å; L518-L522 PolarHBondContact O-N 2.92Å; L522-R526 WeakPolarHBondContact O-CB 3.49Å; L522-R526 VanDerWaalsContact O-CD 3.23Å; L522-R526 WeakPolarHBondContact O-CD 3.4Å; L522-R526 WeakPolarHBondContact O-CG 3.37Å; L522-R526 PolarHBondContact O-N 3.24Å |
| 523 | R | 93.6 | Very high | 84.4 | Confident | 136 Ų | 136 | 120.2 Ų | 120.2 | 51% | 0.513 | 60% | 0.604 | S | S | . | * | H | α-helix | trans | -76.7 | -48.9 | 170.3 | -87 | 173.2 | -83.1 | 165.4 | -13.7 | 110.9 | E519 Q520 E521 L525 R526 E527 | E519-R523 WeakPolarHBondContact O-CB 3.37Å; E519-R523 WeakPolarHBondContact O-CG 3.2Å; E519-R523 PolarHBondContact O-N 3.11Å; E519-R523 VanDerWaalsContact O-N 3.13Å; E519-R523 PolarHBondContact O-NE 3.34Å; E519-R523 IonicContact OE2-NH2 3.07Å; Q520-R523 WeakPolarHBondContact O-CB 3.47Å; Q520-R523 PolarHBondContact O-N 2.64Å; Q520-R523 VanDerWaalsContact O-N 3.11Å; E521-R523 PolarHBondContact O-N 2.8Å; R523-L525 VanDerWaalsContact C-N 3.28Å; R523-L525 PolarHBondContact O-N 3.3Å; R523-R526 CarbonylContact O-C 3.59Å; R523-R526 WeakPolarHBondContact O-CA 3.39Å; R523-R526 WeakPolarHBondContact O-CB 3.46Å; R523-R526 PolarHBondContact O-N 3.28Å; R523-E527 PolarHBondContact O-N 2.92Å |
| 524 | A | 90.5 | Very high | 82.2 | Confident | 68 Ų | 68 | 117 Ų | 117 | 56% | 0.562 | 60% | 0.603 | S | S | * | * | H | α-helix | trans | -59.3 | -37.7 | 176.8 | 0 | 0 | 0 | 0 | 0 | 112.6 | Q520 E521 R526 E527 | Q520-A524 PolarHBondContact O-N 3.11Å; E521-A524 PolarHBondContact O-N 3.45Å; A524-R526 PolarHBondContact O-N 3.45Å; A524-E527 PolarHBondContact O-N 3.43Å |
| 525 | L | 89.5 | Confident | 79.9 | Confident | 146 Ų | 146 | 119.3 Ų | 119.3 | 76% | 0.764 | 61% | 0.612 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -75.3 | -6.8 | 174 | -67.3 | 172.5 | 0 | 0 | 0 | 114.3 | E521 R523 | E521-L525 WeakPolarHBondContact O-CB 3.36Å; E521-L525 VanDerWaalsContact O-CG 3.31Å; E521-L525 WeakPolarHBondContact O-CG 3.48Å; E521-L525 PolarHBondContact O-N 3.15Å; R523-L525 VanDerWaalsContact C-N 3.28Å; R523-L525 PolarHBondContact O-N 3.3Å |
| 526 | R | 87.6 | Confident | 77.8 | Confident | 205 Ų | 205 | 123.2 Ų | 123.2 | 77% | 0.774 | 63% | 0.632 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -105.1 | -16.9 | 173.9 | -77.6 | 174.6 | -177.7 | -175.8 | 1.5 | 113.3 | L522 R523 A524 | L522-R526 WeakPolarHBondContact O-CB 3.49Å; L522-R526 VanDerWaalsContact O-CD 3.23Å; L522-R526 WeakPolarHBondContact O-CD 3.4Å; L522-R526 WeakPolarHBondContact O-CG 3.37Å; L522-R526 PolarHBondContact O-N 3.24Å; R523-R526 CarbonylContact O-C 3.59Å; R523-R526 WeakPolarHBondContact O-CA 3.39Å; R523-R526 WeakPolarHBondContact O-CB 3.46Å; R523-R526 PolarHBondContact O-N 3.28Å; A524-R526 PolarHBondContact O-N 3.45Å |
| 527 | E | 80.6 | Confident | 75.7 | Confident | 150 Ų | 150 | 126.5 Ų | 126.5 | 70% | 0.701 | 65% | 0.647 | S | S | * | * | S | Bend | trans | -67.7 | 133.9 | 167.4 | -65.7 | -158.6 | 151.9 | 0 | 0 | 109.1 | R523 A524 | R523-E527 PolarHBondContact O-N 2.92Å; A524-E527 PolarHBondContact O-N 3.43Å |
| 528 | P | 70.5 | Confident | 73.5 | Confident | 109 Ų | 109 | 129.5 Ų | 129.5 | 71% | 0.708 | 67% | 0.666 | S | S | * | * | P | Polyproline II helix | trans | -64.7 | 144.2 | 175.1 | 28.5 | -33.9 | 0 | 0 | 0 | 109.3 | T530 | P528-T530 PolarHBondContact O-N 3.44Š|
| 529 | P | 66.9 | Low | 71.5 | Confident | 124 Ų | 124 | 130.8 Ų | 130.8 | 81% | 0.805 | 68% | 0.682 | S | S | * | * | P | Polyproline II helix | trans | -56.5 | 128.9 | 176.7 | 24.6 | -33.9 | 0 | 0 | 0 | 109.3 | ||
| 530 | T | 64.5 | Low | 69.6 | Low | 129 Ų | 129 | 134.9 Ų | 134.9 | 79% | 0.791 | 70% | 0.698 | S | S | * | * | P | Polyproline II helix | trans | -55.6 | 135 | 179.4 | 36 | 0 | 0 | 0 | 0 | 109.8 | P528 W532 | P528-T530 PolarHBondContact O-N 3.44Å; T530-W532 PolarHBondContact O-N 3.28Å; T530-W532 VanDerWaalsContact O-N 3.08Å |
| 531 | P | 53.4 | Low | 67.3 | Low | 107 Ų | 107 | 141.1 Ų | 141.1 | 70% | 0.695 | 73% | 0.733 | S | S | * | * | P | Polyproline II helix | trans | -59.8 | 121.7 | -179.2 | 24.1 | -32.8 | 0 | 0 | 0 | 108.6 | S533 | P531-S533 PolarHBondContact O-N 3.14Š|
| 532 | W | 54.6 | Low | 65.9 | Low | 226 Ų | 226 | 142.4 Ų | 142.4 | 86% | 0.856 | 74% | 0.742 | S | S | * | * | trans | -61.3 | 98.4 | 179 | 50.9 | -81 | 0 | 0 | 0 | 108.4 | T530 P534 | T530-W532 PolarHBondContact O-N 3.28Å; T530-W532 VanDerWaalsContact O-N 3.08Å; W532-P534 HydrophobicContact CZ3-CG 4.39Å; W532-P534 WeakPolarHBondContact O-CD 3.36Å | ||
| 533 | S | 52.3 | Low | 64.4 | Low | 107 Ų | 107 | 144.9 Ų | 144.9 | 75% | 0.748 | 76% | 0.755 | S | S | * | * | trans | -82.6 | 101.1 | 173.2 | -67.2 | 0 | 0 | 0 | 0 | 108.1 | P531 R535 | P531-S533 PolarHBondContact O-N 3.14Å; S533-R535 PolarHBondContact O-N 3.06Å; S533-R535 VanDerWaalsContact O-N 3.09Å | ||
| 534 | P | 51 | Low | 62.8 | Low | 87 Ų | 87 | 145.4 Ų | 145.4 | 57% | 0.565 | 77% | 0.769 | S | S | * | * | trans | -61.6 | 119 | 171.8 | 27.5 | -34.1 | 0 | 0 | 0 | 107.7 | W532 L536 | W532-P534 HydrophobicContact CZ3-CG 4.39Å; W532-P534 WeakPolarHBondContact O-CD 3.36Å; P534-L536 PolarHBondContact O-N 3.27Å | ||
| 535 | R | 50.9 | Low | 61.1 | Low | 211 Ų | 211 | 149.9 Ų | 149.9 | 80% | 0.796 | 78% | 0.781 | S | S | * | * | trans | -68.3 | 89.4 | 172.9 | -178.3 | -172.2 | -85.8 | -159.3 | -3.7 | 107.9 | S533 E537 | S533-R535 PolarHBondContact O-N 3.06Å; S533-R535 VanDerWaalsContact O-N 3.09Å; R535-E537 VanDerWaalsContact C-N 3.29Å; R535-E537 HydrophobicContact CG-CG 4Å; R535-E537 IonicContact NH1-OE1 2.71Å; R535-E537 PolarHBondContact O-N 3.41Å | ||
| 536 | L | 52.5 | Low | 59.4 | Low | 155 Ų | 155 | 150.2 Ų | 150.2 | 81% | 0.812 | 78% | 0.782 | S | S | * | * | trans | -65.1 | 92.7 | 166.6 | -83.2 | 162 | 0 | 0 | 0 | 108.2 | P534 S538 | P534-L536 PolarHBondContact O-N 3.27Å; L536-S538 PolarHBondContact O-N 2.78Å | ||
| 537 | E | 54.4 | Low | 57.5 | Low | 146 Ų | 146 | 146.5 Ų | 146.5 | 68% | 0.682 | 78% | 0.782 | S | S | * | * | trans | -67.7 | 90.2 | 166.3 | -63.5 | -164.6 | 158.4 | 0 | 0 | 107.8 | R535 S539 | R535-E537 VanDerWaalsContact C-N 3.29Å; R535-E537 HydrophobicContact CG-CG 4Å; R535-E537 IonicContact NH1-OE1 2.71Å; R535-E537 PolarHBondContact O-N 3.41Å; E537-S539 PolarHBondContact O-N 3.1Å | ||
| 538 | S | 50.2 | Low | 55.8 | Low | 103 Ų | 103 | 146.3 Ų | 146.3 | 72% | 0.72 | 79% | 0.788 | S | S | * | * | trans | -71.6 | 82.1 | 175.8 | -173.4 | 0 | 0 | 0 | 0 | 108.8 | L536 K540 | L536-S538 PolarHBondContact O-N 2.78Å; S538-K540 PolarHBondContact O-N 3.08Å | ||
| 539 | S | 55.1 | Low | 54.7 | Low | 114 Ų | 114 | 149.2 Ų | 149.2 | 80% | 0.797 | 79% | 0.794 | S | S | * | * | trans | -54.8 | 107.6 | 164.8 | -59 | 0 | 0 | 0 | 0 | 108.4 | E537 | E537-S539 PolarHBondContact O-N 3.1Š| ||
| 540 | K | 57.7 | Low | 53.7 | Low | 189 Ų | 189 | 151.3 Ų | 151.3 | 82% | 0.822 | 79% | 0.793 | S | S | * | * | trans | -78.8 | 143.8 | 167.6 | -74.2 | -173.6 | 175 | -177.6 | 0 | 109.6 | S538 | S538-K540 PolarHBondContact O-N 3.08Š| ||
| 541 | I | 47.8 | Very low | 52.7 | Low | 241 Ų | 241 | 153.3 Ų | 153.3 | 100% | 1.236 | 79% | 0.794 | S | S | * | * | trans | -65.9 | 0 | 162.5 | -57.3 | 165.5 | 0 | 0 | 0 | 108.2 |
Retrieved 541 of 541 residues in 133.2 ms
(Link to these results)