| 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 | I | 42.9 | Very low | 47.1 | Very low | 222 Ų | 222 | 150.6 Ų | 150.6 | 100% | 1.138 | 82% | 0.818 | S | S | * | * | 0 | 108.1 | 0 | -56.3 | 166.9 | 0 | 0 | 0 | 104.5 | |||||
| 2 | M | 40.8 | Very low | 47.2 | Very low | 151 Ų | 151 | 148.1 Ų | 148.1 | 74% | 0.744 | 82% | 0.815 | S | S | * | * | cis | -143.3 | 144.1 | 37.6 | -63.2 | -179.1 | 65.1 | 0 | 0 | 111.1 | ||||
| 3 | A | 42.8 | Very low | 47.3 | Very low | 95 Ų | 95 | 144.8 Ų | 144.8 | 79% | 0.785 | 82% | 0.819 | S | S | * | * | trans | -87.1 | 130 | 166.5 | 0 | 0 | 0 | 0 | 0 | 108.9 | ||||
| 4 | F | 46.1 | Very low | 47.1 | Very low | 184 Ų | 184 | 143.1 Ų | 143.1 | 81% | 0.807 | 82% | 0.821 | S | S | * | * | trans | -95.2 | 112 | 172.1 | -84.4 | -85.8 | 0 | 0 | 0 | 109.2 | ||||
| 5 | L | 49.2 | Very low | 47.1 | Very low | 165 Ų | 165 | 139.9 Ų | 139.9 | 86% | 0.864 | 82% | 0.818 | S | S | * | * | trans | -87.8 | 118.7 | 172.3 | -71.6 | 167.5 | 0 | 0 | 0 | 108.9 | S7 | L5-S7 PolarHBondContact O-N 3.31Š| ||
| 6 | I | 57.8 | Low | 46.9 | Very low | 158 Ų | 158 | 137.6 Ų | 137.6 | 81% | 0.81 | 82% | 0.82 | S | S | * | * | trans | -79.1 | 115.7 | 173.5 | -62.1 | 169.5 | 0 | 0 | 0 | 107.6 | ||||
| 7 | S | 46.4 | Very low | 46.7 | Very low | 109 Ų | 109 | 135.4 Ų | 135.4 | 76% | 0.762 | 81% | 0.814 | S | S | * | * | trans | -85.9 | 117.8 | 173 | -69.7 | 0 | 0 | 0 | 0 | 110.1 | L5 | L5-S7 PolarHBondContact O-N 3.31Š| ||
| 8 | L | 47.4 | Very low | 46.4 | Very low | 151 Ų | 151 | 133.1 Ų | 133.1 | 79% | 0.791 | 81% | 0.812 | S | S | * | * | trans | -89.6 | 113.9 | 172.6 | -123.3 | 122.5 | 0 | 0 | 0 | 108.9 | I10 | L8-I10 HydrophobicContact CD2-CG1 4.38Š| ||
| 9 | V | 48.4 | Very low | 46 | Very low | 124 Ų | 124 | 135.7 Ų | 135.7 | 75% | 0.752 | 81% | 0.811 | S | S | * | * | trans | -91.1 | 113.1 | 173.9 | 178.3 | 0 | 0 | 0 | 0 | 108.3 | ||||
| 10 | I | 49.4 | Very low | 45.6 | Very low | 144 Ų | 144 | 136.9 Ų | 136.9 | 74% | 0.738 | 81% | 0.811 | S | S | * | * | trans | -99.5 | 111.3 | 173.8 | -57.5 | 175.3 | 0 | 0 | 0 | 107.8 | L8 | L8-I10 HydrophobicContact CD2-CG1 4.38Š| ||
| 11 | L | 46.9 | Very low | 45.1 | Very low | 154 Ų | 154 | 139 Ų | 139 | 81% | 0.806 | 81% | 0.811 | S | S | * | * | P | Polyproline II helix | trans | -83.3 | 125.9 | 171 | -82.7 | 138.2 | 0 | 0 | 0 | 109.7 | ||
| 12 | P | 48 | Very low | 45 | Very low | 120 Ų | 120 | 133.7 Ų | 133.7 | 78% | 0.779 | 79% | 0.79 | S | S | * | * | P | Polyproline II helix | trans | -82.3 | 119 | 172.7 | 30.3 | -29.5 | 0 | 0 | 0 | 110.7 | S14 | P12-S14 PolarHBondContact O-N 3.43Š|
| 13 | A | 48.3 | Very low | 44.9 | Very low | 106 Ų | 106 | 137 Ų | 137 | 88% | 0.876 | 80% | 0.796 | S | S | * | * | P | Polyproline II helix | trans | -74.1 | 117.2 | 167.7 | 0 | 0 | 0 | 0 | 0 | 109.5 | ||
| 14 | S | 45.2 | Very low | 44.6 | Very low | 121 Ų | 121 | 140 Ų | 140 | 85% | 0.846 | 80% | 0.799 | S | S | * | * | P | Polyproline II helix | trans | -88.5 | 116.9 | 170.6 | 48.1 | 0 | 0 | 0 | 0 | 109.4 | P12 | P12-S14 PolarHBondContact O-N 3.43Š|
| 15 | A | 47 | Very low | 44.1 | Very low | 94 Ų | 94 | 136.5 Ų | 136.5 | 78% | 0.777 | 80% | 0.797 | S | S | * | * | trans | -80.3 | 115.4 | 171.3 | 0 | 0 | 0 | 0 | 0 | 109 | S17 | A15-S17 PolarHBondContact O-N 3.41Š| ||
| 16 | A | 43.6 | Very low | 43.6 | Very low | 103 Ų | 103 | 136.5 Ų | 136.5 | 85% | 0.851 | 80% | 0.798 | S | S | * | * | trans | -76.6 | 110.7 | 171.7 | 0 | 0 | 0 | 0 | 0 | 109.6 | ||||
| 17 | S | 44.4 | Very low | 42.5 | Very low | 101 Ų | 101 | 136.3 Ų | 136.3 | 71% | 0.706 | 80% | 0.797 | S | S | * | * | trans | -86.2 | 106.9 | 170 | -50.6 | 0 | 0 | 0 | 0 | 109.5 | A15 F19 | A15-S17 PolarHBondContact O-N 3.41Å; S17-F19 PolarHBondContact O-N 3.22Å | ||
| 18 | A | 40.3 | Very low | 41.9 | Very low | 94 Ų | 94 | 142.3 Ų | 142.3 | 78% | 0.777 | 80% | 0.803 | S | S | * | * | trans | -78.2 | 114.1 | 171.4 | 0 | 0 | 0 | 0 | 0 | 109.8 | ||||
| 19 | F | 39 | Very low | 40.9 | Very low | 183 Ų | 183 | 142.2 Ų | 142.2 | 80% | 0.803 | 80% | 0.799 | S | S | * | * | trans | -85.3 | 114.1 | 167.5 | -80.4 | -84.4 | 0 | 0 | 0 | 109.5 | S17 | S17-F19 PolarHBondContact O-N 3.22Š| ||
| 20 | I | 38.3 | Very low | 40.3 | Very low | 158 Ų | 158 | 140.5 Ų | 140.5 | 81% | 0.81 | 79% | 0.792 | S | S | * | * | trans | -83.7 | 115.7 | 172 | -61.2 | 171.2 | 0 | 0 | 0 | 107.7 | ||||
| 21 | F | 34.3 | Very low | 39.4 | Very low | 183 Ų | 183 | 145.8 Ų | 145.8 | 80% | 0.803 | 80% | 0.803 | S | S | * | * | P | Polyproline II helix | trans | -86.5 | 135.1 | 168.9 | -83.7 | -87 | 0 | 0 | 0 | 110.2 | ||
| 22 | P | 41.4 | Very low | 38.7 | Very low | 109 Ų | 109 | 142 Ų | 142 | 71% | 0.708 | 80% | 0.802 | S | S | * | * | P | Polyproline II helix | trans | -80.8 | 127.3 | -178.8 | 31.1 | -31 | 0 | 0 | 0 | 111.6 | ||
| 23 | Y | 37.7 | Very low | 38 | Very low | 220 Ų | 220 | 145.2 Ų | 145.2 | 86% | 0.863 | 81% | 0.806 | S | S | * | * | P | Polyproline II helix | trans | -71.4 | 124.3 | 165.3 | -117 | -100.7 | 0 | 0 | 0 | 109.1 | ||
| 24 | N | 38 | Very low | 37.4 | Very low | 158 Ų | 158 | 145 Ų | 145 | 85% | 0.845 | 80% | 0.804 | S | S | * | * | trans | -112.6 | 102.9 | 160.9 | -85.1 | -37.1 | 0 | 0 | 0 | 108.5 | ||||
| 25 | S | 35.6 | Very low | 36.9 | Very low | 111 Ų | 111 | 147.9 Ų | 147.9 | 78% | 0.776 | 81% | 0.805 | S | S | * | * | trans | -77.4 | 119 | 164.7 | 42.9 | 0 | 0 | 0 | 0 | 108.8 | ||||
| 26 | L | 38.1 | Very low | 36.3 | Very low | 166 Ų | 166 | 149.3 Ų | 149.3 | 87% | 0.869 | 81% | 0.809 | S | S | * | * | trans | -123.9 | 95 | 165.6 | -134.8 | 161.7 | 0 | 0 | 0 | 108.7 | ||||
| 27 | L | 35.3 | Very low | 36.2 | Very low | 154 Ų | 154 | 150.4 Ų | 150.4 | 81% | 0.806 | 81% | 0.81 | S | S | * | * | trans | -70.6 | 119.4 | 173 | -154.6 | 155.1 | 0 | 0 | 0 | 107.1 | ||||
| 28 | R | 32.8 | Very low | 35.5 | Very low | 235 Ų | 235 | 149.2 Ų | 149.2 | 89% | 0.887 | 81% | 0.814 | S | S | * | * | trans | -140.3 | 124.3 | 162.3 | -158.5 | 170.7 | -173.8 | 171.5 | 1.7 | 111.7 | ||||
| 29 | E | 27.6 | Very low | 35.3 | Very low | 149 Ų | 149 | 148.7 Ų | 148.7 | 70% | 0.696 | 82% | 0.818 | S | S | * | * | trans | -55.3 | 154 | -172.2 | -166.1 | 58.8 | -123.8 | 0 | 0 | 116 | ||||
| 30 | S | 36.1 | Very low | 34.9 | Very low | 88 Ų | 88 | 143.8 Ų | 143.8 | 62% | 0.615 | 82% | 0.818 | S | S | * | * | trans | -55.1 | 152.8 | 176.1 | 63.4 | 0 | 0 | 0 | 0 | 116.5 | ||||
| 31 | R | 30.6 | Very low | 34.9 | Very low | 254 Ų | 254 | 141.3 Ų | 141.3 | 96% | 0.958 | 82% | 0.822 | S | S | * | * | 178 | 134.5 | 122.8 | -123.4 | 176.5 | 169.3 | 180 | -3.4 | 112.5 | |||||
| 32 | G | 31 | Very low | 35.6 | Very low | 76 Ų | 76 | 136.2 Ų | 136.2 | 78% | 0.784 | 82% | 0.821 | S | S | * | * | trans | 139 | 75.1 | 155.5 | 0 | 0 | 0 | 0 | 0 | 114.8 | ||||
| 33 | E | 32.7 | Very low | 35.5 | Very low | 186 Ų | 186 | 140.4 Ų | 140.4 | 87% | 0.869 | 83% | 0.831 | S | S | * | * | trans | -58.3 | 138.7 | 162.1 | -72.9 | 154.1 | 127.7 | 0 | 0 | 111.3 | ||||
| 34 | A | 36.5 | Very low | 35.7 | Very low | 102 Ų | 102 | 134.6 Ų | 134.6 | 84% | 0.843 | 83% | 0.829 | S | S | * | * | trans | -143.2 | 95.4 | 148.6 | 0 | 0 | 0 | 0 | 0 | 106.9 | ||||
| 35 | E | 35.5 | Very low | 35.8 | Very low | 182 Ų | 182 | 136.6 Ų | 136.6 | 85% | 0.85 | 83% | 0.833 | S | S | * | * | trans | -63 | 140.5 | 165.1 | -69.8 | 175.1 | 102.3 | 0 | 0 | 110 | ||||
| 36 | S | 32.5 | Very low | 36.3 | Very low | 124 Ų | 124 | 139.9 Ų | 139.9 | 87% | 0.867 | 84% | 0.836 | S | S | * | * | trans | -149.1 | 113.6 | 142.8 | -171.1 | 0 | 0 | 0 | 0 | 108.7 | ||||
| 37 | S | 42.5 | Very low | 36.6 | Very low | 125 Ų | 125 | 134.9 Ų | 134.9 | 87% | 0.874 | 83% | 0.825 | S | S | * | * | trans | -79 | 150 | 176.7 | -159.9 | 0 | 0 | 0 | 0 | 110.7 | ||||
| 38 | G | 29.5 | Very low | 37.1 | Very low | 77 Ų | 77 | 133.6 Ų | 133.6 | 79% | 0.794 | 82% | 0.824 | S | S | * | * | trans | 177.2 | 84.7 | 173.8 | 0 | 0 | 0 | 0 | 0 | 111.5 | ||||
| 39 | G | 35.7 | Very low | 37.7 | Very low | 83 Ų | 83 | 128.3 Ų | 128.3 | 86% | 0.856 | 82% | 0.817 | S | S | * | * | trans | -80.9 | 159.6 | 171.8 | 0 | 0 | 0 | 0 | 0 | 112.9 | ||||
| 40 | G | 31.6 | Very low | 38.8 | Very low | 79 Ų | 79 | 129.8 Ų | 129.8 | 81% | 0.814 | 82% | 0.821 | S | S | * | * | trans | 139.5 | 104 | 159.4 | 0 | 0 | 0 | 0 | 0 | 116.3 | ||||
| 41 | A | 37.1 | Very low | 39.7 | Very low | 107 Ų | 107 | 131.7 Ų | 131.7 | 88% | 0.884 | 83% | 0.829 | S | S | * | * | trans | 51.8 | 101.8 | 149.8 | 0 | 0 | 0 | 0 | 0 | 120.2 | ||||
| 42 | G | 49.9 | Very low | 41 | Very low | 76 Ų | 76 | 124.9 Ų | 124.9 | 78% | 0.784 | 82% | 0.815 | S | S | * | * | trans | 64.2 | 86.8 | 131.9 | 0 | 0 | 0 | 0 | 0 | 118 | ||||
| 43 | Q | 39.5 | Very low | 41.7 | Very low | 196 Ų | 196 | 130.2 Ų | 130.2 | 92% | 0.916 | 82% | 0.82 | S | S | * | * | trans | -161.2 | 147.7 | 147.4 | -116.1 | 164.8 | 29 | 0 | 0 | 111.1 | E45 | Q43-E45 PolarHBondContact O-N 3.35Š| ||
| 44 | A | 42.7 | Very low | 42.4 | Very low | 99 Ų | 99 | 126.4 Ų | 126.4 | 82% | 0.818 | 81% | 0.805 | S | S | * | * | trans | -45.6 | 122.4 | -171.8 | 0 | 0 | 0 | 0 | 0 | 113.1 | Q46 | A44-Q46 PolarHBondContact O-N 3.39Š| ||
| 45 | E | 39.8 | Very low | 43.4 | Very low | 199 Ų | 199 | 125.1 Ų | 125.1 | 93% | 0.93 | 78% | 0.784 | S | S | * | * | trans | -70.2 | 95.4 | 177 | -68.1 | -135.5 | 154.9 | 0 | 0 | 110.6 | Q43 G47 | Q43-E45 PolarHBondContact O-N 3.35Å; E45-G47 PolarHBondContact O-N 2.93Å | ||
| 46 | Q | 44.8 | Very low | 44.5 | Very low | 180 Ų | 180 | 121.4 Ų | 121.4 | 84% | 0.841 | 78% | 0.776 | S | S | * | * | trans | -74.9 | 100.9 | 163.2 | -170.6 | 169.3 | 3.5 | 0 | 0 | 107.9 | A44 T48 | A44-Q46 PolarHBondContact O-N 3.39Å; Q46-T48 PolarHBondContact O-N 2.79Å | ||
| 47 | G | 44.2 | Very low | 45.7 | Very low | 62 Ų | 62 | 125.6 Ų | 125.6 | 64% | 0.639 | 77% | 0.772 | S | S | * | * | trans | -51 | 126.7 | 177.8 | 0 | 0 | 0 | 0 | 0 | 111.6 | E45 V49 | E45-G47 PolarHBondContact O-N 2.93Å; G47-V49 PolarHBondContact O-N 3.25Å; G47-V49 VanDerWaalsContact O-N 3.12Å | ||
| 48 | T | 46.1 | Very low | 46.2 | Very low | 127 Ų | 127 | 125.3 Ų | 125.3 | 78% | 0.779 | 76% | 0.761 | S | S | * | * | trans | -74.6 | 103.6 | 178.6 | -60.5 | 0 | 0 | 0 | 0 | 109.6 | Q46 K50 | Q46-T48 PolarHBondContact O-N 2.79Å; T48-K50 HydrophobicContact CG2-CG 4.42Å; T48-K50 PolarHBondContact O-N 3.12Å | ||
| 49 | V | 45.8 | Very low | 47.3 | Very low | 123 Ų | 123 | 127 Ų | 127 | 75% | 0.745 | 75% | 0.752 | S | S | * | * | trans | -79.8 | 100.3 | 168.9 | -178.3 | 0 | 0 | 0 | 0 | 108.3 | G47 V51 | G47-V49 PolarHBondContact O-N 3.25Å; G47-V49 VanDerWaalsContact O-N 3.12Å; V49-V51 HydrophobicContact CG1-CG2 4.17Å; V49-V51 PolarHBondContact O-N 3.23Å; V49-V51 VanDerWaalsContact O-N 3.12Å | ||
| 50 | K | 51.2 | Low | 48 | Very low | 181 Ų | 181 | 128.5 Ų | 128.5 | 79% | 0.787 | 74% | 0.743 | S | S | * | * | trans | -73.9 | 99.8 | 166.8 | -86.2 | -173.7 | 176.4 | 177.3 | 0 | 109 | T48 V52 | T48-K50 HydrophobicContact CG2-CG 4.42Å; T48-K50 PolarHBondContact O-N 3.12Å; K50-V52 PolarHBondContact O-N 2.02Å; K50-V52 VanDerWaalsContact O-N 3.08Å | ||
| 51 | V | 54.4 | Low | 48.8 | Very low | 127 Ų | 127 | 129.9 Ų | 129.9 | 77% | 0.77 | 74% | 0.741 | S | S | * | * | trans | -71 | 100.8 | 168.6 | -178.2 | 0 | 0 | 0 | 0 | 107.7 | V49 Q53 | V49-V51 HydrophobicContact CG1-CG2 4.17Å; V49-V51 PolarHBondContact O-N 3.23Å; V49-V51 VanDerWaalsContact O-N 3.12Å; V51-Q53 PolarHBondContact O-N 3.07Å | ||
| 52 | V | 57 | Low | 49.1 | Very low | 112 Ų | 112 | 128.9 Ų | 128.9 | 68% | 0.679 | 73% | 0.727 | S | S | * | * | trans | -78.3 | 109.1 | 170.5 | -178.3 | 0 | 0 | 0 | 0 | 107.3 | K50 L54 | K50-V52 PolarHBondContact O-N 2.02Å; K50-V52 VanDerWaalsContact O-N 3.08Å; V52-L54 HydrophobicContact CG1-CD2 4.04Å; V52-L54 PolarHBondContact O-N 3.12Å; V52-L54 VanDerWaalsContact O-N 3.07Å | ||
| 53 | Q | 46 | Very low | 48.9 | Very low | 187 Ų | 187 | 129.8 Ų | 129.8 | 87% | 0.874 | 73% | 0.727 | S | S | * | * | trans | -74 | 99.1 | 176 | -156.8 | 169.5 | 25.1 | 0 | 0 | 108.4 | V51 D55 | V51-Q53 PolarHBondContact O-N 3.07Å; Q53-D55 PolarHBondContact O-N 3.26Å | ||
| 54 | L | 48.3 | Very low | 49.4 | Very low | 107 Ų | 107 | 129.2 Ų | 129.2 | 56% | 0.56 | 72% | 0.722 | S | S | * | * | trans | -74.4 | 110.9 | 176.6 | -63.8 | 176.1 | 0 | 0 | 0 | 108.8 | V52 P56 | V52-L54 HydrophobicContact CG1-CD2 4.04Å; V52-L54 PolarHBondContact O-N 3.12Å; V52-L54 VanDerWaalsContact O-N 3.07Å; L54-P56 VanDerWaalsContact O-CD 3.31Å; L54-P56 WeakPolarHBondContact O-CD 3.36Å | ||
| 55 | D | 57.6 | Low | 49.5 | Very low | 74 Ų | 74 | 133.6 Ų | 133.6 | 40% | 0.396 | 72% | 0.723 | S | S | . | * | trans | -70.7 | 116.5 | 173 | -176.8 | -7.1 | 0 | 0 | 0 | 109.5 | Q53 R57 N58 | Q53-D55 PolarHBondContact O-N 3.26Å; D55-R57 PolarHBondContact O-N 3.03Å; D55-R57 WeakPolarHBondContact OD1-CB 3.4Å; D55-R57 PolarHBondContact OD1-N 2.84Å; D55-N58 PolarHBondContact O-N 3.31Å; D55-N58 VanDerWaalsContact O-N 3.16Å; D55-N58 PolarHBondContact OD2-ND2 3.28Å | ||
| 56 | P | 59 | Low | 49.9 | Very low | 105 Ų | 105 | 136 Ų | 136 | 68% | 0.682 | 72% | 0.723 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -57.9 | -20.3 | 179.7 | -21.3 | 31.7 | 0 | 0 | 0 | 113.7 | L54 | L54-P56 VanDerWaalsContact O-CD 3.31Å; L54-P56 WeakPolarHBondContact O-CD 3.36Å |
| 57 | R | 57.1 | Low | 49.6 | Very low | 211 Ų | 211 | 139.7 Ų | 139.7 | 80% | 0.796 | 73% | 0.73 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -79 | -23.3 | -177.4 | -60.9 | -176.6 | 179.3 | -145.8 | 0.5 | 113.2 | D55 | D55-R57 PolarHBondContact O-N 3.03Å; D55-R57 WeakPolarHBondContact OD1-CB 3.4Å; D55-R57 PolarHBondContact OD1-N 2.84Å |
| 58 | N | 51.8 | Low | 49.3 | Very low | 120 Ų | 120 | 140.1 Ų | 140.1 | 64% | 0.642 | 73% | 0.734 | S | S | * | * | G | 310 helix | trans | -89.2 | -6.6 | -176.7 | -69.1 | -42.9 | 0 | 0 | 0 | 114.1 | D55 | D55-N58 PolarHBondContact O-N 3.31Å; D55-N58 VanDerWaalsContact O-N 3.16Å; D55-N58 PolarHBondContact OD2-ND2 3.28Å |
| 59 | L | 54.3 | Low | 48.9 | Very low | 113 Ų | 113 | 142.4 Ų | 142.4 | 59% | 0.592 | 74% | 0.741 | S | S | * | * | G | 310 helix | trans | -90.4 | 2.6 | 177 | -64.8 | 174.9 | 0 | 0 | 0 | 113.8 | S61 | L59-S61 VanDerWaalsContact C-N 3.26Å; L59-S61 PolarHBondContact O-N 2.77Å |
| 60 | V | 50.4 | Low | 48.6 | Very low | 113 Ų | 113 | 143.6 Ų | 143.6 | 69% | 0.685 | 75% | 0.748 | S | S | * | * | G | 310 helix | trans | -81.5 | -0.1 | -178 | -176.2 | 0 | 0 | 0 | 0 | 112.6 | S62 | V60-S62 PolarHBondContact O-N 2.85Š|
| 61 | S | 47.8 | Very low | 48.3 | Very low | 109 Ų | 109 | 142.9 Ų | 142.9 | 76% | 0.762 | 75% | 0.748 | S | S | * | * | G | 310 helix | trans | -85.2 | 2.6 | -176.4 | 81.9 | 0 | 0 | 0 | 0 | 115.6 | L59 A63 | L59-S61 VanDerWaalsContact C-N 3.26Å; L59-S61 PolarHBondContact O-N 2.77Å; S61-A63 PolarHBondContact O-N 3.43Å |
| 62 | S | 42.8 | Very low | 47.5 | Very low | 86 Ų | 86 | 148.2 Ų | 148.2 | 60% | 0.601 | 75% | 0.754 | S | S | * | * | S | Bend | trans | -74.7 | 107.7 | 167.4 | 64.1 | 0 | 0 | 0 | 0 | 109.3 | V60 F64 | V60-S62 PolarHBondContact O-N 2.85Å; S62-F64 VanDerWaalsContact C-N 3.33Å; S62-F64 PolarHBondContact O-N 2.73Å |
| 63 | A | 46.7 | Very low | 46.1 | Very low | 94 Ų | 94 | 146.7 Ų | 146.7 | 78% | 0.777 | 76% | 0.761 | S | S | * | * | S | Bend | trans | -63.9 | 70.4 | -168.1 | 0 | 0 | 0 | 0 | 0 | 115.6 | S61 | S61-A63 PolarHBondContact O-N 3.43Š|
| 64 | F | 49.8 | Very low | 45.7 | Very low | 184 Ų | 184 | 142.3 Ų | 142.3 | 81% | 0.807 | 76% | 0.757 | S | S | * | * | trans | -128.2 | 5 | 171.4 | -86.3 | -81.1 | 0 | 0 | 0 | 115.5 | S62 | S62-F64 VanDerWaalsContact C-N 3.33Å; S62-F64 PolarHBondContact O-N 2.73Å | ||
| 65 | F | 44.1 | Very low | 45.6 | Very low | 192 Ų | 192 | 142.7 Ų | 142.7 | 84% | 0.842 | 77% | 0.766 | S | S | * | * | trans | -127.6 | 68.6 | 177 | -63.9 | -77.3 | 0 | 0 | 0 | 112.3 | ||||
| 66 | R | 48.4 | Very low | 44.7 | Very low | 248 Ų | 248 | 144 Ų | 144 | 94% | 0.936 | 78% | 0.781 | S | S | * | * | trans | -135.2 | 83.8 | 160.5 | -73 | -162.4 | -169.2 | -139.1 | 5.3 | 111.2 | ||||
| 67 | R | 39.6 | Very low | 44 | Very low | 258 Ų | 258 | 148.1 Ų | 148.1 | 97% | 0.974 | 79% | 0.791 | S | S | * | * | S | Bend | trans | -174 | 116.5 | 154.2 | -105.1 | 176.6 | -172.9 | -177.7 | 2.3 | 106.3 | ||
| 68 | G | 36.4 | Very low | 43 | Very low | 71 Ų | 71 | 142.5 Ų | 142.5 | 73% | 0.732 | 79% | 0.789 | S | S | * | * | cis | -160.2 | 132.6 | -8.6 | 0 | 0 | 0 | 0 | 0 | 106.8 | ||||
| 69 | L | 37.8 | Very low | 42.6 | Very low | 176 Ų | 176 | 142 Ų | 142 | 92% | 0.921 | 80% | 0.795 | S | S | * | * | trans | -128.9 | 103.3 | 162.1 | -82.2 | 169.2 | 0 | 0 | 0 | 105.4 | ||||
| 70 | T | 39.9 | Very low | 42.4 | Very low | 147 Ų | 147 | 148.2 Ų | 148.2 | 90% | 0.902 | 81% | 0.811 | S | S | * | * | trans | -71.5 | 125 | 169.3 | 40.2 | 0 | 0 | 0 | 0 | 108.3 | ||||
| 71 | Q | 44.1 | Very low | 42.4 | Very low | 167 Ų | 167 | 151 Ų | 151 | 78% | 0.78 | 82% | 0.821 | S | S | * | * | trans | -78.5 | 151.8 | 170.6 | -78.4 | -169 | 3.6 | 0 | 0 | 111.3 | ||||
| 72 | R | 37.6 | Very low | 42.7 | Very low | 238 Ų | 238 | 151.2 Ų | 151.2 | 90% | 0.898 | 82% | 0.823 | S | S | * | * | trans | 87 | 110 | 140.9 | -107.9 | 176.4 | -169 | 177.1 | 3.9 | 119.7 | ||||
| 73 | G | 28.9 | Very low | 43 | Very low | 80 Ų | 80 | 155.4 Ų | 155.4 | 83% | 0.825 | 83% | 0.83 | S | S | * | * | trans | -163.4 | 111.2 | 141.4 | 0 | 0 | 0 | 0 | 0 | 109.2 | ||||
| 74 | A | 37 | Very low | 43.8 | Very low | 95 Ų | 95 | 154.5 Ų | 154.5 | 79% | 0.785 | 82% | 0.816 | S | S | * | * | trans | -90.1 | 149.8 | 157.1 | 0 | 0 | 0 | 0 | 0 | 106.6 | ||||
| 75 | P | 47 | Very low | 44.1 | Very low | 115 Ų | 115 | 149.5 Ų | 149.5 | 75% | 0.747 | 81% | 0.809 | S | S | * | * | -150.9 | 175.5 | 71.1 | 36.6 | -15.1 | 0 | 0 | 0 | 117.2 | |||||
| 76 | S | 37.5 | Very low | 44.9 | Very low | 101 Ų | 101 | 147.8 Ų | 147.8 | 71% | 0.706 | 80% | 0.801 | S | S | * | * | trans | 75.6 | 120.8 | 147.6 | 58.4 | 0 | 0 | 0 | 0 | 121.9 | ||||
| 77 | H | 45.2 | Very low | 45.3 | Very low | 193 Ų | 193 | 141 Ų | 141 | 89% | 0.894 | 78% | 0.783 | S | S | * | * | trans | 29.8 | 109.1 | 138 | -76.2 | -102.4 | 0 | 0 | 0 | 118.4 | ||||
| 78 | A | 35.9 | Very low | 46.1 | Very low | 93 Ų | 93 | 133.3 Ų | 133.3 | 77% | 0.769 | 77% | 0.769 | S | S | * | * | trans | -173.5 | 135.8 | 130.1 | 0 | 0 | 0 | 0 | 0 | 112 | ||||
| 79 | S | 44.2 | Very low | 47.1 | Very low | 110 Ų | 110 | 140.6 Ų | 140.6 | 77% | 0.769 | 78% | 0.775 | S | S | * | * | trans | 58.2 | 100.6 | 151.6 | 37.9 | 0 | 0 | 0 | 0 | 119.3 | L81 | S79-L81 PolarHBondContact O-N 3.07Š| ||
| 80 | R | 49.9 | Very low | 47.7 | Very low | 243 Ų | 243 | 135.2 Ų | 135.2 | 92% | 0.917 | 76% | 0.762 | S | S | * | * | trans | -43.1 | 128.2 | 152.4 | -63.6 | 174.6 | -172.8 | -109.6 | 0.3 | 109.8 | S82 | R80-S82 PolarHBondContact O-N 2.87Š| ||
| 81 | L | 50.4 | Low | 48.4 | Very low | 171 Ų | 171 | 139.9 Ų | 139.9 | 90% | 0.895 | 76% | 0.763 | S | S | * | * | P | Polyproline II helix | trans | -57.5 | 121.7 | 170.3 | -68.5 | 165.1 | 0 | 0 | 0 | 109.2 | S79 F83 | S79-L81 PolarHBondContact O-N 3.07Å; L81-F83 PolarHBondContact O-N 3.08Å |
| 82 | S | 54.4 | Low | 48.6 | Very low | 114 Ų | 114 | 138 Ų | 138 | 80% | 0.797 | 77% | 0.765 | S | S | * | * | P | Polyproline II helix | trans | -62.9 | 129.4 | 177.9 | -38.7 | 0 | 0 | 0 | 0 | 109.9 | R80 | R80-S82 PolarHBondContact O-N 2.87Š|
| 83 | F | 48.9 | Very low | 49 | Very low | 174 Ų | 174 | 129.4 Ų | 129.4 | 76% | 0.763 | 75% | 0.75 | S | S | * | * | P | Polyproline II helix | trans | -55.1 | 146.1 | 167.9 | -86.6 | -97.8 | 0 | 0 | 0 | 110.6 | L81 A85 L87 | L81-F83 PolarHBondContact O-N 3.08Å; F83-A85 PolarHBondContact O-N 2.82Å; F83-L87 HydrophobicContact CD1-CD1 4.44Å |
| 84 | P | 61.8 | Low | 50 | Low | 74 Ų | 74 | 132.3 Ų | 132.3 | 48% | 0.481 | 76% | 0.755 | S | S | . | * | P | Polyproline II helix | trans | -61.5 | 136.1 | 178.6 | 24.3 | -32.6 | 0 | 0 | 0 | 111.4 | F86 L87 | P84-F86 HydrophobicContact CB-CD1 4.03Å; P84-F86 HydrophobicContact CB-CE1 4.38Å; P84-F86 HydrophobicContact CG-CD1 4.07Å; P84-F86 HydrophobicContact CG-CE1 3.96Å; P84-F86 PolarHBondContact O-N 2.8Å; P84-L87 PolarHBondContact O-N 3.25Å; P84-L87 VanDerWaalsContact O-N 3.15Å |
| 85 | A | 57.8 | Low | 50 | Low | 79 Ų | 79 | 132.5 Ų | 132.5 | 65% | 0.653 | 76% | 0.756 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -59.9 | -9 | -170.4 | 0 | 0 | 0 | 0 | 0 | 115.8 | F83 L87 S88 | F83-A85 PolarHBondContact O-N 2.82Å; A85-L87 VanDerWaalsContact C-N 3.29Å; A85-L87 PolarHBondContact O-N 2.79Å; A85-S88 WeakPolarHBondContact CA-OG 3.11Å; A85-S88 PolarHBondContact O-OG 2.97Å |
| 86 | F | 60.9 | Low | 50 | Low | 156 Ų | 156 | 136.1 Ų | 136.1 | 68% | 0.684 | 76% | 0.763 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -75 | -18.7 | 177.1 | 92.9 | -91.7 | 0 | 0 | 0 | 113 | P84 | P84-F86 HydrophobicContact CB-CD1 4.03Å; P84-F86 HydrophobicContact CB-CE1 4.38Å; P84-F86 HydrophobicContact CG-CD1 4.07Å; P84-F86 HydrophobicContact CG-CE1 3.96Å; P84-F86 PolarHBondContact O-N 2.8Å |
| 87 | L | 56 | Low | 50 | Low | 106 Ų | 106 | 135.8 Ų | 135.8 | 56% | 0.555 | 77% | 0.766 | S | S | * | * | S | Bend | trans | -94.9 | -10.9 | 179 | -64.1 | 175.5 | 0 | 0 | 0 | 113.6 | F83 P84 A85 R89 | F83-L87 HydrophobicContact CD1-CD1 4.44Å; P84-L87 PolarHBondContact O-N 3.25Å; P84-L87 VanDerWaalsContact O-N 3.15Å; A85-L87 VanDerWaalsContact C-N 3.29Å; A85-L87 PolarHBondContact O-N 2.79Å; L87-R89 VanDerWaalsContact C-N 3.3Å |
| 88 | S | 57.2 | Low | 49.8 | Very low | 97 Ų | 97 | 132.5 Ų | 132.5 | 68% | 0.678 | 76% | 0.762 | S | S | * | * | S | Bend | trans | -81.9 | -4.2 | 177.1 | 37.1 | 0 | 0 | 0 | 0 | 114.3 | A85 G90 | A85-S88 WeakPolarHBondContact CA-OG 3.11Å; A85-S88 PolarHBondContact O-OG 2.97Å; S88-G90 PolarHBondContact O-N 3.02Å |
| 89 | R | 57.3 | Low | 50.4 | Low | 224 Ų | 224 | 137.6 Ų | 137.6 | 85% | 0.845 | 77% | 0.767 | S | S | * | * | S | Bend | trans | -87.4 | 87.7 | 171 | -72.7 | -91.6 | 166.6 | 85.9 | -3.5 | 108.1 | L87 | L87-R89 VanDerWaalsContact C-N 3.3Š|
| 90 | G | 48.9 | Very low | 50.3 | Low | 63 Ų | 63 | 139.4 Ų | 139.4 | 65% | 0.649 | 77% | 0.768 | S | S | * | * | trans | -53.3 | 150.2 | 167.3 | 0 | 0 | 0 | 0 | 0 | 111.6 | S88 | S88-G90 PolarHBondContact O-N 3.02Š| ||
| 91 | R | 56 | Low | 50.4 | Low | 245 Ų | 245 | 133.8 Ų | 133.8 | 93% | 0.925 | 76% | 0.763 | S | S | * | * | trans | -42.1 | 123.9 | 174.4 | -117.9 | -177.2 | -167.9 | -164.8 | 3.7 | 111.1 | G93 | R91-G93 PolarHBondContact O-N 3.16Š| ||
| 92 | P | 48.4 | Very low | 50.1 | Low | 128 Ų | 128 | 131.9 Ų | 131.9 | 83% | 0.831 | 76% | 0.758 | S | S | * | * | trans | -61.6 | 118.5 | 163.7 | -18.8 | 31.2 | 0 | 0 | 0 | 109.1 | ||||
| 93 | G | 46 | Very low | 49.6 | Very low | 57 Ų | 57 | 130.4 Ų | 130.4 | 59% | 0.588 | 75% | 0.748 | S | S | * | * | trans | -67.5 | 166 | 166 | 0 | 0 | 0 | 0 | 0 | 111.3 | R91 A95 | R91-G93 PolarHBondContact O-N 3.16Å; G93-A95 PolarHBondContact O-N 3.18Å | ||
| 94 | P | 48.2 | Very low | 49.5 | Very low | 141 Ų | 141 | 128.1 Ų | 128.1 | 92% | 0.916 | 75% | 0.75 | S | S | * | * | trans | -71.4 | 115 | -167.8 | 29.3 | -32.1 | 0 | 0 | 0 | 110.8 | ||||
| 95 | A | 38.9 | Very low | 48.8 | Very low | 98 Ų | 98 | 131.1 Ų | 131.1 | 81% | 0.81 | 76% | 0.762 | S | S | * | * | P | Polyproline II helix | trans | -85.4 | 137 | 168.5 | 0 | 0 | 0 | 0 | 0 | 109.9 | G93 | G93-A95 PolarHBondContact O-N 3.18Š|
| 96 | Q | 45.5 | Very low | 48.1 | Very low | 192 Ų | 192 | 138.4 Ų | 138.4 | 90% | 0.897 | 77% | 0.772 | S | S | * | * | P | Polyproline II helix | trans | -60.8 | 139.5 | 178.7 | -71.1 | 174.7 | -18.9 | 0 | 0 | 111.8 | ||
| 97 | A | 38.4 | Very low | 47.6 | Very low | 94 Ų | 94 | 139.9 Ų | 139.9 | 78% | 0.777 | 78% | 0.781 | S | S | * | * | P | Polyproline II helix | trans | -74.7 | 134.4 | -177.5 | 0 | 0 | 0 | 0 | 0 | 112.7 | ||
| 98 | P | 41.5 | Very low | 47.1 | Very low | 124 Ų | 124 | 142.6 Ų | 142.6 | 81% | 0.805 | 80% | 0.795 | S | S | * | * | P | Polyproline II helix | trans | -78.3 | 132.5 | 151.5 | -9.6 | 27.5 | 0 | 0 | 0 | 109.5 | D100 | P98-D100 PolarHBondContact O-N 2.86Š|
| 99 | K | 47.6 | Very low | 46.7 | Very low | 199 Ų | 199 | 149 Ų | 149 | 87% | 0.865 | 80% | 0.804 | S | S | * | * | P | Polyproline II helix | trans | -62.1 | 121 | 172.1 | -70 | 172.1 | 176.5 | 175.2 | 0 | 109.5 | ||
| 100 | D | 41.9 | Very low | 46.2 | Very low | 148 Ų | 148 | 143.9 Ų | 143.9 | 79% | 0.791 | 80% | 0.8 | S | S | * | * | trans | -171.4 | 138 | 135 | -87.3 | -27.9 | 0 | 0 | 0 | 110 | P98 V102 | P98-D100 PolarHBondContact O-N 2.86Å; D100-V102 PolarHBondContact O-N 2.79Å | ||
| 101 | P | 51.5 | Low | 46.3 | Very low | 125 Ų | 125 | 145.5 Ų | 145.5 | 81% | 0.812 | 79% | 0.791 | S | S | * | * | trans | -92.5 | 88.4 | -173.9 | 35.4 | -29.2 | 0 | 0 | 0 | 110.2 | ||||
| 102 | V | 45.7 | Very low | 46.2 | Very low | 132 Ų | 132 | 143.2 Ų | 143.2 | 80% | 0.8 | 78% | 0.782 | S | S | * | * | trans | -125.5 | 88 | 162.8 | -174.7 | 0 | 0 | 0 | 0 | 108.4 | D100 P104 | D100-V102 PolarHBondContact O-N 2.79Å; V102-P104 WeakPolarHBondContact O-CD 3.06Å | ||
| 103 | S | 42.6 | Very low | 46.6 | Very low | 82 Ų | 82 | 141.9 Ų | 141.9 | 57% | 0.573 | 77% | 0.774 | S | S | * | * | trans | -60.6 | 120 | 172.3 | -177.6 | 0 | 0 | 0 | 0 | 110.1 | L105 | S103-L105 PolarHBondContact O-N 2.86Š| ||
| 104 | P | 48.4 | Very low | 47.5 | Very low | 127 Ų | 127 | 142.1 Ų | 142.1 | 83% | 0.825 | 77% | 0.77 | S | S | * | * | S | Bend | trans | -81.8 | 42.5 | 172.5 | 34.3 | -31.8 | 0 | 0 | 0 | 111 | V102 | V102-P104 WeakPolarHBondContact O-CD 3.06Š|
| 105 | L | 45.6 | Very low | 48.2 | Very low | 136 Ų | 136 | 139.1 Ų | 139.1 | 71% | 0.712 | 74% | 0.744 | S | S | * | * | trans | -112.7 | 63.1 | 173.6 | -73.2 | 178.8 | 0 | 0 | 0 | 110.6 | S103 | S103-L105 PolarHBondContact O-N 2.86Š| ||
| 106 | R | 44.5 | Very low | 49.6 | Very low | 232 Ų | 232 | 136.9 Ų | 136.9 | 88% | 0.875 | 73% | 0.725 | S | S | * | * | trans | -138.8 | 19.1 | 167.3 | -81 | -147.1 | 174.4 | -168.7 | 1.8 | 116.7 | ||||
| 107 | H | 50.3 | Low | 50.9 | Low | 188 Ų | 188 | 131.6 Ų | 131.6 | 87% | 0.87 | 70% | 0.703 | S | S | * | * | trans | -121.7 | 14.2 | 173.9 | -68.1 | -8.2 | 0 | 0 | 0 | 115.8 | R109 | H107-R109 VanDerWaalsContact C-N 3.32Å; H107-R109 PolarHBondContact O-N 2.82Å | ||
| 108 | L | 45.6 | Very low | 52.7 | Low | 163 Ų | 163 | 132.7 Ų | 132.7 | 85% | 0.853 | 70% | 0.695 | S | S | * | * | trans | -90.1 | 80.1 | 156.9 | -66.5 | 176.9 | 0 | 0 | 0 | 108.3 | P110 | L108-P110 VanDerWaalsContact O-CD 3.32Å; L108-P110 WeakPolarHBondContact O-CD 3.44Å | ||
| 109 | R | 48.8 | Very low | 54.3 | Low | 230 Ų | 230 | 131.4 Ų | 131.4 | 87% | 0.868 | 68% | 0.677 | S | S | * | * | trans | -58.2 | 120.7 | 159.5 | -168.5 | 175.3 | -171.8 | 148.8 | 1.4 | 105.8 | H107 Q111 | H107-R109 VanDerWaalsContact C-N 3.32Å; H107-R109 PolarHBondContact O-N 2.82Å; R109-Q111 PolarHBondContact O-N 2.81Å | ||
| 110 | P | 46.4 | Very low | 55.7 | Low | 117 Ų | 117 | 128.9 Ų | 128.9 | 76% | 0.76 | 67% | 0.666 | S | S | * | * | trans | -59.6 | 107 | 172.1 | -17.9 | 30.2 | 0 | 0 | 0 | 106.6 | L108 R112 | L108-P110 VanDerWaalsContact O-CD 3.32Å; L108-P110 WeakPolarHBondContact O-CD 3.44Å; P110-R112 PolarHBondContact O-N 2.86Å | ||
| 111 | Q | 51.3 | Low | 57.7 | Low | 98 Ų | 98 | 128.2 Ų | 128.2 | 46% | 0.458 | 66% | 0.656 | S | S | . | * | trans | -56.3 | 130.4 | 162.8 | -80.2 | -144.4 | -30.2 | 0 | 0 | 105.8 | R109 E115 K119 | R109-Q111 PolarHBondContact O-N 2.81Å; Q111-E115 PolarHBondContact NE2-OE1 3.21Å; Q111-E115 PolarHBondContact OE1-OE1 2.93Å; Q111-K119 VanDerWaalsContact NE2-NZ 3.16Å | ||
| 112 | R | 54.2 | Low | 59.2 | Low | 196 Ų | 196 | 127.8 Ų | 127.8 | 74% | 0.74 | 64% | 0.643 | S | S | * | * | trans | -49.9 | 138.3 | -176.7 | -69.2 | 178.5 | 179 | 135.6 | -4.7 | 108.4 | P110 A114 E115 A116 | P110-R112 PolarHBondContact O-N 2.86Å; R112-A114 PolarHBondContact O-N 3.17Å; R112-E115 PolarHBondContact O-N 3.38Å; R112-A116 PolarHBondContact O-N 3.48Å | ||
| 113 | P | 56.4 | Low | 61 | Low | 101 Ų | 101 | 122.9 Ų | 122.9 | 66% | 0.656 | 62% | 0.619 | S | S | * | * | H | α-helix | trans | -47.4 | -39.5 | -177.6 | -28.3 | 34.1 | 0 | 0 | 0 | 112.2 | E115 A116 D117 | P113-E115 PolarHBondContact O-N 3.43Å; P113-A116 PolarHBondContact O-N 3.47Å; P113-D117 WeakPolarHBondContact O-CB 3.48Å; P113-D117 PolarHBondContact O-N 2.8Å; P113-D117 VanDerWaalsContact O-OD2 3.09Å |
| 114 | A | 63.7 | Low | 62.8 | Low | 61 Ų | 61 | 123.8 Ų | 123.8 | 50% | 0.504 | 62% | 0.617 | S | S | . | * | H | α-helix | trans | -60.1 | -35.3 | 176.4 | 0 | 0 | 0 | 0 | 0 | 115.1 | R112 L118 | R112-A114 PolarHBondContact O-N 3.17Å; A114-L118 VanDerWaalsContact O-CB 3.26Å; A114-L118 WeakPolarHBondContact O-CB 3.32Å; A114-L118 WeakPolarHBondContact O-CD1 3.43Å; A114-L118 WeakPolarHBondContact O-CG 3.38Å; A114-L118 PolarHBondContact O-N 2.88Å |
| 115 | E | 64.4 | Low | 64.5 | Low | 79 Ų | 79 | 123.5 Ų | 123.5 | 37% | 0.369 | 61% | 0.605 | S | S | . | * | H | α-helix | trans | -76.5 | -37.9 | 179.8 | -161.8 | -170.7 | 149.6 | 0 | 0 | 111.3 | Q111 R112 P113 L118 K119 | Q111-E115 PolarHBondContact NE2-OE1 3.21Å; Q111-E115 PolarHBondContact OE1-OE1 2.93Å; R112-E115 PolarHBondContact O-N 3.38Å; P113-E115 PolarHBondContact O-N 3.43Å; E115-L118 PolarHBondContact O-N 2.91Å; E115-K119 WeakPolarHBondContact O-CB 3.39Å; E115-K119 VanDerWaalsContact O-CG 3.3Å; E115-K119 WeakPolarHBondContact O-CG 3.44Å; E115-K119 PolarHBondContact O-N 2.76Å; E115-K119 IonicContact OE1-NZ 2.68Å; E115-K119 PolarHBondContact OE1-NZ 3.28Å |
| 116 | A | 66.9 | Low | 66.2 | Low | 50 Ų | 50 | 122.5 Ų | 122.5 | 41% | 0.413 | 60% | 0.598 | S | S | . | * | H | α-helix | trans | -67.1 | -40.3 | 172.6 | 0 | 0 | 0 | 0 | 0 | 111.3 | R112 P113 K119 K120 | R112-A116 PolarHBondContact O-N 3.48Å; P113-A116 PolarHBondContact O-N 3.47Å; A116-K119 PolarHBondContact O-N 2.97Å; A116-K120 WeakPolarHBondContact O-CB 3.41Å; A116-K120 PolarHBondContact O-N 2.83Å |
| 117 | D | 72.7 | Confident | 67.6 | Low | 82 Ų | 82 | 118.9 Ų | 118.9 | 44% | 0.439 | 58% | 0.584 | S | S | . | * | H | α-helix | trans | -67.6 | -37.9 | 175.6 | -72.7 | -34.5 | 0 | 0 | 0 | 112.2 | P113 K120 K121 | P113-D117 WeakPolarHBondContact O-CB 3.48Å; P113-D117 PolarHBondContact O-N 2.8Å; P113-D117 VanDerWaalsContact O-OD2 3.09Å; D117-K120 PolarHBondContact O-N 3.48Å; D117-K121 WeakPolarHBondContact O-CB 3.49Å; D117-K121 VanDerWaalsContact O-CG 3.22Å; D117-K121 WeakPolarHBondContact O-CG 3.31Å; D117-K121 PolarHBondContact O-N 2.8Å |
| 118 | L | 76.6 | Confident | 68.9 | Low | 117 Ų | 117 | 114.3 Ų | 114.3 | 61% | 0.613 | 56% | 0.563 | S | S | * | * | H | α-helix | trans | -63.7 | -44.6 | 172.5 | -81.7 | 164.1 | 0 | 0 | 0 | 111.2 | A114 E115 K120 K121 Q122 | A114-L118 VanDerWaalsContact O-CB 3.26Å; A114-L118 WeakPolarHBondContact O-CB 3.32Å; A114-L118 WeakPolarHBondContact O-CD1 3.43Å; A114-L118 WeakPolarHBondContact O-CG 3.38Å; A114-L118 PolarHBondContact O-N 2.88Å; E115-L118 PolarHBondContact O-N 2.91Å; L118-K120 PolarHBondContact O-N 2.95Å; L118-K121 PolarHBondContact O-N 3.47Å; L118-Q122 WeakPolarHBondContact O-CB 3.36Å; L118-Q122 PolarHBondContact O-N 2.92Å |
| 119 | K | 75.5 | Confident | 70.5 | Confident | 97 Ų | 97 | 113.4 Ų | 113.4 | 42% | 0.422 | 55% | 0.552 | S | S | . | * | H | α-helix | trans | -64.6 | -38.1 | 175.7 | -73.7 | 172.9 | -174.9 | 167.9 | 0 | 112.2 | Q111 E115 A116 Q122 G123 | Q111-K119 VanDerWaalsContact NE2-NZ 3.16Å; E115-K119 WeakPolarHBondContact O-CB 3.39Å; E115-K119 VanDerWaalsContact O-CG 3.3Å; E115-K119 WeakPolarHBondContact O-CG 3.44Å; E115-K119 PolarHBondContact O-N 2.76Å; E115-K119 IonicContact OE1-NZ 2.68Å; E115-K119 PolarHBondContact OE1-NZ 3.28Å; A116-K119 PolarHBondContact O-N 2.97Å; K119-Q122 PolarHBondContact O-N 2.87Å; K119-G123 PolarHBondContact O-N 3.43Å |
| 120 | K | 77.8 | Confident | 71.5 | Confident | 145 Ų | 145 | 107.2 Ų | 107.2 | 63% | 0.63 | 54% | 0.54 | S | S | * | . | H | α-helix | trans | -65.8 | -45.9 | 174.8 | -174.3 | 178.6 | 177.4 | -178.2 | 0 | 111.7 | A116 D117 L118 Q122 G123 L124 | A116-K120 WeakPolarHBondContact O-CB 3.41Å; A116-K120 PolarHBondContact O-N 2.83Å; D117-K120 PolarHBondContact O-N 3.48Å; L118-K120 PolarHBondContact O-N 2.95Å; K120-Q122 VanDerWaalsContact C-N 3.34Å; K120-G123 PolarHBondContact O-N 3.42Å; K120-L124 HydrophobicContact CG-CD1 4.39Å; K120-L124 WeakPolarHBondContact O-CG 3.05Å; K120-L124 PolarHBondContact O-N 2.73Å |
| 121 | K | 82.2 | Confident | 72.6 | Confident | 134 Ų | 134 | 105.3 Ų | 105.3 | 58% | 0.583 | 52% | 0.522 | S | S | * | . | H | α-helix | trans | -62.7 | -41 | 174.6 | -74 | 174.9 | -178.2 | -175.5 | 0 | 111.5 | D117 L118 L124 Q125 | D117-K121 WeakPolarHBondContact O-CB 3.49Å; D117-K121 VanDerWaalsContact O-CG 3.22Å; D117-K121 WeakPolarHBondContact O-CG 3.31Å; D117-K121 PolarHBondContact O-N 2.8Å; L118-K121 PolarHBondContact O-N 3.47Å; K121-L124 PolarHBondContact O-N 2.92Å; K121-Q125 WeakPolarHBondContact O-CB 3.18Å; K121-Q125 VanDerWaalsContact O-CG 3.31Å; K121-Q125 WeakPolarHBondContact O-CG 3.27Å; K121-Q125 PolarHBondContact O-N 3Å |
| 122 | Q | 84.7 | Confident | 73.2 | Confident | 116 Ų | 116 | 106 Ų | 106 | 54% | 0.542 | 53% | 0.529 | S | S | . | . | H | α-helix | trans | -64.7 | -42.7 | 175.3 | -169.4 | 175.7 | 20.4 | 0 | 0 | 111.4 | L118 K119 K120 Q125 M126 | L118-Q122 WeakPolarHBondContact O-CB 3.36Å; L118-Q122 PolarHBondContact O-N 2.92Å; K119-Q122 PolarHBondContact O-N 2.87Å; K120-Q122 VanDerWaalsContact C-N 3.34Å; Q122-Q125 PolarHBondContact O-N 3.18Å; Q122-M126 VanDerWaalsContact O-CG 3.31Å; Q122-M126 WeakPolarHBondContact O-CG 3.47Å; Q122-M126 PolarHBondContact O-N 3.48Å |
| 123 | G | 81.4 | Confident | 73.5 | Confident | 29 Ų | 29 | 105.5 Ų | 105.5 | 30% | 0.299 | 53% | 0.532 | S | S | . | . | H | α-helix | trans | -60 | -45 | 173.7 | 0 | 0 | 0 | 0 | 0 | 113 | K119 K120 M126 W127 | K119-G123 PolarHBondContact O-N 3.43Å; K120-G123 PolarHBondContact O-N 3.42Å; G123-M126 PolarHBondContact O-N 3.36Å; G123-W127 WeakPolarHBondContact O-CB 3.31Å; G123-W127 PolarHBondContact O-N 2.83Å |
| 124 | L | 82.4 | Confident | 73.3 | Confident | 101 Ų | 101 | 103.6 Ų | 103.6 | 53% | 0.529 | 53% | 0.531 | S | S | . | . | H | α-helix | trans | -63.1 | -43 | 175.2 | -75.7 | 165 | 0 | 0 | 0 | 112 | K120 K121 M126 W127 Q128 | K120-L124 HydrophobicContact CG-CD1 4.39Å; K120-L124 WeakPolarHBondContact O-CG 3.05Å; K120-L124 PolarHBondContact O-N 2.73Å; K121-L124 PolarHBondContact O-N 2.92Å; L124-M126 VanDerWaalsContact C-N 3.32Å; L124-M126 PolarHBondContact O-N 2.04Å; L124-W127 PolarHBondContact O-N 3.38Å; L124-Q128 VanDerWaalsContact O-CB 3.32Å; L124-Q128 WeakPolarHBondContact O-CB 3.47Å; L124-Q128 PolarHBondContact O-N 2.96Å |
| 125 | Q | 82.4 | Confident | 72.7 | Confident | 121 Ų | 121 | 103 Ų | 103 | 57% | 0.565 | 53% | 0.53 | S | S | * | . | H | α-helix | trans | -65.7 | -35 | 175.9 | -74.3 | -180 | 5.9 | 0 | 0 | 112.5 | K121 Q122 K129 | K121-Q125 WeakPolarHBondContact O-CB 3.18Å; K121-Q125 VanDerWaalsContact O-CG 3.31Å; K121-Q125 WeakPolarHBondContact O-CG 3.27Å; K121-Q125 PolarHBondContact O-N 3Å; Q122-Q125 PolarHBondContact O-N 3.18Å; Q125-K129 WeakPolarHBondContact O-CB 3.45Å; Q125-K129 VanDerWaalsContact O-CG 3.22Å; Q125-K129 WeakPolarHBondContact O-CG 3.33Å; Q125-K129 PolarHBondContact O-N 3.04Å |
| 126 | M | 81.6 | Confident | 72.5 | Confident | 115 Ų | 115 | 108.4 Ų | 108.4 | 57% | 0.567 | 55% | 0.553 | S | S | * | * | H | α-helix | trans | -67.2 | -43.3 | 173 | -72.9 | -170.8 | -58 | 0 | 0 | 111.4 | Q122 G123 L124 K129 V130 | Q122-M126 VanDerWaalsContact O-CG 3.31Å; Q122-M126 WeakPolarHBondContact O-CG 3.47Å; Q122-M126 PolarHBondContact O-N 3.48Å; G123-M126 PolarHBondContact O-N 3.36Å; L124-M126 VanDerWaalsContact C-N 3.32Å; L124-M126 PolarHBondContact O-N 2.04Å; M126-K129 PolarHBondContact O-N 2.83Å; M126-V130 WeakPolarHBondContact O-CG2 3.25Å; M126-V130 PolarHBondContact O-N 2.83Å |
| 127 | W | 74.8 | Confident | 72 | Confident | 157 Ų | 157 | 111 Ų | 111 | 60% | 0.595 | 56% | 0.563 | S | S | * | * | H | α-helix | trans | -64.6 | -45.8 | 177.4 | -171.4 | 80 | 0 | 0 | 0 | 111.8 | G123 L124 K129 V130 M131 | G123-W127 WeakPolarHBondContact O-CB 3.31Å; G123-W127 PolarHBondContact O-N 2.83Å; L124-W127 PolarHBondContact O-N 3.38Å; W127-K129 VanDerWaalsContact C-N 3.31Å; W127-K129 PolarHBondContact O-N 2.68Å; W127-V130 WeakPolarHBondContact O-CA 3.47Å; W127-V130 WeakPolarHBondContact O-CB 3.33Å; W127-V130 PolarHBondContact O-N 3.17Å; W127-M131 HydrophobicContact CD2-CG 4.07Å; W127-M131 HydrophobicContact CE3-CG 4.12Å; W127-M131 HydrophobicContact CH2-CE 4.38Å; W127-M131 HydrophobicContact CH2-CG 4.06Å; W127-M131 HydrophobicContact CZ2-CE 4.31Å; W127-M131 HydrophobicContact CZ2-CG 3.99Å; W127-M131 HydrophobicContact CZ2-SD 4.08Å; W127-M131 HydrophobicContact CZ3-CG 4.12Å; W127-M131 WeakPolarHBondContact O-CG 3.29Å; W127-M131 PolarHBondContact O-N 3.25Å |
| 128 | Q | 77.9 | Confident | 71.4 | Confident | 91 Ų | 91 | 111.9 Ų | 111.9 | 43% | 0.425 | 58% | 0.575 | S | S | . | * | H | α-helix | trans | -59.3 | -42.6 | 175 | -166.6 | 66.1 | 43.4 | 0 | 0 | 111.2 | L124 V130 M131 D132 | L124-Q128 VanDerWaalsContact O-CB 3.32Å; L124-Q128 WeakPolarHBondContact O-CB 3.47Å; L124-Q128 PolarHBondContact O-N 2.96Å; Q128-V130 VanDerWaalsContact C-N 3.25Å; Q128-V130 PolarHBondContact O-N 2.72Å; Q128-M131 PolarHBondContact O-N 3.33Å; Q128-D132 WeakPolarHBondContact CG-OD2 3.45Å; Q128-D132 PolarHBondContact NE2-OD1 2.04Å; Q128-D132 PolarHBondContact NE2-OD2 3.46Å; Q128-D132 VanDerWaalsContact O-CB 3.29Å; Q128-D132 WeakPolarHBondContact O-CB 3.31Å; Q128-D132 PolarHBondContact O-N 3.18Å |
| 129 | K | 77.6 | Confident | 70.8 | Confident | 144 Ų | 144 | 110.2 Ų | 110.2 | 63% | 0.626 | 57% | 0.567 | S | S | * | * | H | α-helix | trans | -62.6 | -27.9 | 173.2 | -79.3 | 174.8 | -178.7 | 177.3 | 0 | 113.4 | Q125 M126 W127 K133 | Q125-K129 WeakPolarHBondContact O-CB 3.45Å; Q125-K129 VanDerWaalsContact O-CG 3.22Å; Q125-K129 WeakPolarHBondContact O-CG 3.33Å; Q125-K129 PolarHBondContact O-N 3.04Å; M126-K129 PolarHBondContact O-N 2.83Å; W127-K129 VanDerWaalsContact C-N 3.31Å; W127-K129 PolarHBondContact O-N 2.68Å; K129-K133 WeakPolarHBondContact O-CB 3.39Å; K129-K133 PolarHBondContact O-N 3.39Å |
| 130 | V | 71.4 | Confident | 70.4 | Confident | 100 Ų | 100 | 112.2 Ų | 112.2 | 61% | 0.606 | 59% | 0.589 | S | S | * | * | H | α-helix | trans | -76.7 | -39.7 | 175.8 | 171.4 | 0 | 0 | 0 | 0 | 110.8 | M126 W127 Q128 | M126-V130 WeakPolarHBondContact O-CG2 3.25Å; M126-V130 PolarHBondContact O-N 2.83Å; W127-V130 WeakPolarHBondContact O-CA 3.47Å; W127-V130 WeakPolarHBondContact O-CB 3.33Å; W127-V130 PolarHBondContact O-N 3.17Å; Q128-V130 VanDerWaalsContact C-N 3.25Å; Q128-V130 PolarHBondContact O-N 2.72Å |
| 131 | M | 68.4 | Low | 69.9 | Low | 78 Ų | 78 | 109.9 Ų | 109.9 | 38% | 0.384 | 59% | 0.587 | S | S | . | * | H | α-helix | trans | -69.7 | -44.4 | 177.1 | -61.8 | -61 | -74 | 0 | 0 | 111.9 | W127 Q128 K133 V137 | W127-M131 HydrophobicContact CD2-CG 4.07Å; W127-M131 HydrophobicContact CE3-CG 4.12Å; W127-M131 HydrophobicContact CH2-CE 4.38Å; W127-M131 HydrophobicContact CH2-CG 4.06Å; W127-M131 HydrophobicContact CZ2-CE 4.31Å; W127-M131 HydrophobicContact CZ2-CG 3.99Å; W127-M131 HydrophobicContact CZ2-SD 4.08Å; W127-M131 HydrophobicContact CZ3-CG 4.12Å; W127-M131 WeakPolarHBondContact O-CG 3.29Å; W127-M131 PolarHBondContact O-N 3.25Å; Q128-M131 PolarHBondContact O-N 3.33Å; M131-K133 PolarHBondContact O-N 3.37Å; M131-V137 HydrophobicContact CE-CG2 3.97Å; M131-V137 HydrophobicContact SD-CG2 4.15Å |
| 132 | D | 64.2 | Low | 69.2 | Low | 113 Ų | 113 | 107.5 Ų | 107.5 | 60% | 0.604 | 58% | 0.581 | S | S | * | * | H | α-helix | trans | -73.6 | -25 | -178.1 | -67.8 | -11.1 | 0 | 0 | 0 | 113 | Q128 G134 | Q128-D132 WeakPolarHBondContact CG-OD2 3.45Å; Q128-D132 PolarHBondContact NE2-OD1 2.04Å; Q128-D132 PolarHBondContact NE2-OD2 3.46Å; Q128-D132 VanDerWaalsContact O-CB 3.29Å; Q128-D132 WeakPolarHBondContact O-CB 3.31Å; Q128-D132 PolarHBondContact O-N 3.18Å; D132-G134 PolarHBondContact O-N 3.24Å |
| 133 | K | 61.5 | Low | 68.4 | Low | 185 Ų | 185 | 104.3 Ų | 104.3 | 80% | 0.804 | 57% | 0.567 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -75.4 | 19.4 | 179.3 | -159.5 | 175.3 | -170.3 | -170.4 | 0 | 113 | K129 M131 G135 | K129-K133 WeakPolarHBondContact O-CB 3.39Å; K129-K133 PolarHBondContact O-N 3.39Å; M131-K133 PolarHBondContact O-N 3.37Å; K133-G135 PolarHBondContact O-N 3.03Å; K133-G135 VanDerWaalsContact O-N 3.17Å |
| 134 | G | 51.3 | Low | 67.7 | Low | 61 Ų | 61 | 111.9 Ų | 111.9 | 63% | 0.629 | 59% | 0.592 | S | S | * | * | T | Hydrogen-bonded Turn | trans | 65.8 | 23.3 | 167.6 | 0 | 0 | 0 | 0 | 0 | 113.5 | D132 K136 | D132-G134 PolarHBondContact O-N 3.24Å; G134-K136 VanDerWaalsContact C-N 3.25Å; G134-K136 PolarHBondContact O-N 2.84Å |
| 135 | G | 51.9 | Low | 66.8 | Low | 47 Ų | 47 | 113.3 Ų | 113.3 | 49% | 0.485 | 60% | 0.6 | S | S | . | * | trans | -68.5 | 93.4 | 163 | 0 | 0 | 0 | 0 | 0 | 106.7 | K133 V137 | K133-G135 PolarHBondContact O-N 3.03Å; K133-G135 VanDerWaalsContact O-N 3.17Å; G135-V137 PolarHBondContact O-N 3.04Å | ||
| 136 | K | 59 | Low | 66.4 | Low | 194 Ų | 194 | 110.4 Ų | 110.4 | 84% | 0.843 | 59% | 0.591 | S | S | * | * | trans | -43 | 113.7 | 165.1 | -67.9 | 178 | -177.8 | -179.4 | 0 | 105.5 | G134 S138 | G134-K136 VanDerWaalsContact C-N 3.25Å; G134-K136 PolarHBondContact O-N 2.84Å; K136-S138 PolarHBondContact O-N 3.38Å | ||
| 137 | V | 55.8 | Low | 66.4 | Low | 105 Ų | 105 | 114 Ų | 114 | 64% | 0.636 | 60% | 0.603 | S | S | * | * | trans | -61.7 | 92.2 | 168.2 | 174.3 | 0 | 0 | 0 | 0 | 104.1 | M131 G135 L139 | M131-V137 HydrophobicContact CE-CG2 3.97Å; M131-V137 HydrophobicContact SD-CG2 4.15Å; G135-V137 PolarHBondContact O-N 3.04Å; V137-L139 PolarHBondContact O-N 3.26Å; V137-L139 VanDerWaalsContact O-N 3.1Å | ||
| 138 | S | 60.3 | Low | 67 | Low | 99 Ų | 99 | 110.2 Ų | 110.2 | 69% | 0.692 | 59% | 0.592 | S | S | * | * | trans | -71.8 | 109.7 | 179.3 | 53.8 | 0 | 0 | 0 | 0 | 104.6 | K136 | K136-S138 PolarHBondContact O-N 3.38Š| ||
| 139 | L | 64.6 | Low | 67.8 | Low | 83 Ų | 83 | 108.7 Ų | 108.7 | 44% | 0.435 | 59% | 0.589 | S | S | . | * | trans | -52.6 | 139.2 | 168.3 | -64.2 | 167.1 | 0 | 0 | 0 | 107.3 | V137 V141 L181 V183 | V137-L139 PolarHBondContact O-N 3.26Å; V137-L139 VanDerWaalsContact O-N 3.1Å; L139-V141 PolarHBondContact O-N 2.91Å; L139-L181 HydrophobicContact CD1-CD1 4.34Å; L139-V183 HydrophobicContact CD1-CG2 3.51Å; L139-V183 HydrophobicContact CD2-CG2 4.38Å | ||
| 140 | P | 67.8 | Low | 68.7 | Low | 138 Ų | 138 | 103.2 Ų | 103.2 | 90% | 0.896 | 57% | 0.569 | S | S | * | * | S | Bend | trans | -62.9 | -3.7 | 176.5 | 25.9 | -33.6 | 0 | 0 | 0 | 112.7 | ||
| 141 | V | 67.3 | Low | 70 | Confident | 96 Ų | 96 | 102.1 Ų | 102.1 | 58% | 0.582 | 56% | 0.562 | S | S | * | * | trans | -99.4 | 113.5 | 176.3 | -176.5 | 0 | 0 | 0 | 0 | 109.5 | L139 L143 | L139-V141 PolarHBondContact O-N 2.91Å; V141-L143 HydrophobicContact CG1-CD1 4.2Å | ||
| 142 | N | 66.8 | Low | 71.4 | Confident | 84 Ų | 84 | 99.9 Ų | 99.9 | 45% | 0.449 | 56% | 0.556 | S | S | . | * | trans | -99 | 116.8 | 169.2 | -176.6 | -18.8 | 0 | 0 | 0 | 109.4 | K144 D145 | N142-K144 PolarHBondContact O-N 2.84Å; N142-K144 WeakPolarHBondContact OD1-CA 3.27Å; N142-K144 WeakPolarHBondContact OD1-CB 3.06Å; N142-K144 PolarHBondContact OD1-N 3.4Å; N142-D145 WeakPolarHBondContact CB-OD2 3.1Å; N142-D145 WeakPolarHBondContact O-CB 3.49Å; N142-D145 PolarHBondContact O-N 3.26Å | ||
| 143 | L | 67.9 | Low | 73 | Confident | 50 Ų | 50 | 97.1 Ų | 97.1 | 26% | 0.262 | 54% | 0.544 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -66.3 | -18 | -179.5 | -90.6 | 68.7 | 0 | 0 | 0 | 113.1 | V141 D145 T146 L181 | V141-L143 HydrophobicContact CG1-CD1 4.2Å; L143-D145 PolarHBondContact O-N 2.95Å; L143-T146 PolarHBondContact O-OG1 2.04Å; L143-L181 HydrophobicContact CD1-CB 4.21Å; L143-L181 HydrophobicContact CD1-CD2 3.25Å; L143-L181 HydrophobicContact CD1-CG 4.32Å; L143-L181 HydrophobicContact CD2-CD2 3.73Å; L143-L181 HydrophobicContact CG-CD2 4.12Å |
| 144 | K | 66.2 | Low | 74.7 | Confident | 187 Ų | 187 | 93.2 Ų | 93.2 | 81% | 0.813 | 54% | 0.537 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -70.9 | -24.2 | 174.6 | -160.2 | 174.2 | -179.4 | -178.4 | 0 | 112.3 | N142 | N142-K144 PolarHBondContact O-N 2.84Å; N142-K144 WeakPolarHBondContact OD1-CA 3.27Å; N142-K144 WeakPolarHBondContact OD1-CB 3.06Å; N142-K144 PolarHBondContact OD1-N 3.4Å |
| 145 | D | 64.8 | Low | 77 | Confident | 131 Ų | 131 | 93.8 Ų | 93.8 | 70% | 0.701 | 52% | 0.522 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -84.2 | -19.6 | -178.9 | -59.6 | -17.6 | 0 | 0 | 0 | 111.8 | N142 L143 K147 | N142-D145 WeakPolarHBondContact CB-OD2 3.1Å; N142-D145 WeakPolarHBondContact O-CB 3.49Å; N142-D145 PolarHBondContact O-N 3.26Å; L143-D145 PolarHBondContact O-N 2.95Å; D145-K147 PolarHBondContact O-N 3.47Å |
| 146 | T | 73.2 | Confident | 79.2 | Confident | 61 Ų | 61 | 95.3 Ų | 95.3 | 37% | 0.374 | 52% | 0.522 | S | S | . | . | S | Bend | trans | -72.9 | 123.1 | 168.3 | 45 | 0 | 0 | 0 | 0 | 110.2 | L143 Q148 S179 | L143-T146 PolarHBondContact O-OG1 2.04Å; T146-Q148 VanDerWaalsContact C-N 3.35Å; T146-Q148 PolarHBondContact O-N 3.22Å; T146-S179 VanDerWaalsContact CB-OG 3.25Å; T146-S179 WeakPolarHBondContact CB-OG 3.42Å; T146-S179 WeakPolarHBondContact OG1-CB 3.5Å; T146-S179 PolarHBondContact OG1-OG 3.19Å |
| 147 | K | 80.9 | Confident | 81 | Confident | 189 Ų | 189 | 88.7 Ų | 88.7 | 82% | 0.822 | 49% | 0.494 | S | S | * | . | trans | -64.2 | 91.1 | 176.9 | -174.3 | -179 | 179.4 | -177.7 | 0 | 110.4 | D145 | D145-K147 PolarHBondContact O-N 3.47Š| ||
| 148 | Q | 89.1 | Confident | 83 | Confident | 79 Ų | 79 | 89.4 Ų | 89.4 | 37% | 0.369 | 49% | 0.491 | S | S | . | . | trans | -79.7 | 142.4 | 172.2 | -63.5 | -170.7 | -13 | 0 | 0 | 110.2 | T146 Q177 S179 | T146-Q148 VanDerWaalsContact C-N 3.35Å; T146-Q148 PolarHBondContact O-N 3.22Å; Q148-Q177 WeakPolarHBondContact CA-O 3.49Å; Q148-S179 VanDerWaalsContact CG-OG 3.31Å; Q148-S179 WeakPolarHBondContact CG-OG 3.43Å; Q148-S179 PolarHBondContact NE2-OG 2.89Å | ||
| 149 | T | 93.9 | Very high | 84.7 | Confident | 59 Ų | 59 | 84.9 Ų | 84.9 | 36% | 0.362 | 46% | 0.459 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -128.8 | 132.4 | 172.4 | 56.6 | 0 | 0 | 0 | 0 | 107.9 | G176 Q177 | T149-G176 CarbonylContact O-C 3.47Å; T149-G176 VanDerWaalsContact O-C 3.28Å; T149-G176 WeakPolarHBondContact O-CA 3.46Å; T149-Q177 PolarHBondContact N-O 3.01Å; T149-Q177 CarbonylContact O-C 3.28Å; T149-Q177 PolarHBondContact O-N 3.37Å; T149-Q177 VanDerWaalsContact O-O 3.06Å; T149-Q177 PolarHBondContact OG1-N 2.97Å |
| 150 | C | 96.7 | Very high | 86.2 | Confident | 29 Ų | 29 | 84.4 Ų | 84.4 | 20% | 0.196 | 46% | 0.459 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -154.8 | 118 | 170.4 | -179.8 | 0 | 0 | 0 | 0 | 107.9 | C208 K238 | C150-C208 WeakPolarHBondContact CA-SG 3Å; C150-C208 HydrophobicContact CB-CB 3.89Å; C150-C208 WeakPolarHBondContact CB-SG 3.11Å; C150-C208 WeakPolarHBondContact SG-CA 3.35Å; C150-C208 WeakPolarHBondContact SG-CB 3.4Å; C150-C208 CovalentContact SG-SG 2.04Å; C150-C208 PolarHBondContact SG-SG 3.5Å; C150-K238 VanDerWaalsContact SG-CA 3.53Å; C150-K238 PolarHBondContact SG-N 2.81Å; C150-K238 PolarHBondContact SG-O 3.32Å |
| 151 | T | 97.4 | Very high | 87.4 | Confident | 76 Ų | 76 | 79.6 Ų | 79.6 | 47% | 0.466 | 43% | 0.431 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -133 | 150.3 | -171.9 | 58.2 | 0 | 0 | 0 | 0 | 110.9 | C174 F175 | T151-C174 WeakPolarHBondContact O-CA 3.31Å; T151-F175 PolarHBondContact N-O 2.85Å; T151-F175 PolarHBondContact O-N 3.15Å; T151-F175 PolarHBondContact OG1-O 3.45Å |
| 152 | A | 98.1 | Very high | 88.6 | Confident | 32 Ų | 32 | 83 Ų | 83 | 26% | 0.264 | 45% | 0.446 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -92.4 | 110 | 170.9 | 0 | 0 | 0 | 0 | 0 | 108.5 | K172 L173 C237 | A152-K172 HydrophobicContact CB-CB 4.04Å; A152-K172 HydrophobicContact CB-CD 3.64Å; A152-K172 HydrophobicContact CB-CG 4.47Å; A152-L173 CarbonylContact C-O 3.55Å; A152-L173 WeakPolarHBondContact CA-O 3.25Å; A152-C237 HydrophobicContact CB-CB 4.37Å |
| 153 | V | 98.2 | Very high | 89.9 | Confident | 55 Ų | 55 | 82.5 Ų | 82.5 | 33% | 0.333 | 46% | 0.461 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -96.7 | 121 | -177.2 | -178.5 | 0 | 0 | 0 | 0 | 108.9 | K172 L173 F175 | V153-K172 CarbonylContact O-C 3.53Å; V153-K172 WeakPolarHBondContact O-CA 3.48Å; V153-L173 HydrophobicContact CB-CD1 3.93Å; V153-L173 HydrophobicContact CB-CG 4.11Å; V153-L173 HydrophobicContact CG2-CD1 4.31Å; V153-L173 PolarHBondContact N-O 3.26Å; V153-L173 PolarHBondContact O-N 2.99Å; V153-F175 HydrophobicContact CG2-CB 3.98Å |
| 154 | P | 98.2 | Very high | 91.2 | Very high | 103 Ų | 103 | 81.3 Ų | 81.3 | 67% | 0.669 | 46% | 0.457 | S | S | * | . | E | Extended strand (participates in β ladder) | trans | -68.8 | 142.4 | -178.6 | 29.2 | -34.5 | 0 | 0 | 0 | 111.6 | N171 | P154-N171 CarbonylContact C-O 3.59Å; P154-N171 WeakPolarHBondContact CA-O 3.04Å |
| 155 | F | 98.1 | Very high | 92.6 | Very high | 73 Ų | 73 | 78.3 Ų | 78.3 | 32% | 0.32 | 45% | 0.446 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -146.4 | 159.1 | 171.7 | 77 | -83.1 | 0 | 0 | 0 | 111.2 | Q157 N171 K172 L173 | F155-Q157 HydrophobicContact CD2-CB 4.29Å; F155-Q157 HydrophobicContact CE2-CB 3.61Å; F155-Q157 HydrophobicContact CE2-CG 4.11Å; F155-Q157 HydrophobicContact CZ-CB 4.24Å; F155-N171 HydrophobicContact CD1-CB 4.29Å; F155-N171 HydrophobicContact CE1-CB 3.68Å; F155-N171 HydrophobicContact CE2-CB 4.36Å; F155-N171 HydrophobicContact CZ-CB 3.71Å; F155-N171 PolarHBondContact N-O 2.64Å; F155-N171 PolarHBondContact O-N 3.19Å; F155-N171 VanDerWaalsContact O-O 3.07Å; F155-K172 VanDerWaalsContact CE1-C 3.45Å; F155-L173 HydrophobicContact CD1-CB 4.18Å; F155-L173 HydrophobicContact CD1-CD2 4.26Å; F155-L173 HydrophobicContact CD1-CG 4.4Å; F155-L173 HydrophobicContact CE1-CB 4.18Å |
| 156 | T | 98 | Very high | 94.1 | Very high | 79 Ų | 79 | 75.9 Ų | 75.9 | 49% | 0.485 | 44% | 0.436 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -92.8 | 116.2 | 176 | -53.6 | 0 | 0 | 0 | 0 | 109.1 | T168 | T156-T168 HydrophobicContact CG2-CG2 3.28Å |
| 157 | Q | 97.6 | Very high | 95.2 | Very high | 54 Ų | 54 | 75.1 Ų | 75.1 | 25% | 0.252 | 43% | 0.431 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -99.8 | 128.8 | 177.4 | -172.9 | 176 | -3.1 | 0 | 0 | 109.9 | F155 V169 N171 | F155-Q157 HydrophobicContact CD2-CB 4.29Å; F155-Q157 HydrophobicContact CE2-CB 3.61Å; F155-Q157 HydrophobicContact CE2-CG 4.11Å; F155-Q157 HydrophobicContact CZ-CB 4.24Å; Q157-V169 WeakPolarHBondContact CA-O 2.98Å; Q157-V169 HydrophobicContact CB-CB 4.46Å; Q157-V169 WeakPolarHBondContact CB-O 3.13Å; Q157-V169 PolarHBondContact N-O 3.07Å; Q157-V169 PolarHBondContact O-N 2.83Å; Q157-N171 HydrophobicContact CB-CB 4.38Å; Q157-N171 PolarHBondContact OE1-ND2 2.88Å |
| 158 | H | 97.7 | Very high | 96 | Very high | 121 Ų | 121 | 69.6 Ų | 69.6 | 56% | 0.56 | 41% | 0.413 | S | S | * | . | E | Extended strand (participates in β ladder) | trans | -96.5 | 118.4 | 172.6 | -68.1 | -167.9 | 0 | 0 | 0 | 108.6 | T166 | H158-T166 HydrophobicContact CB-CG2 3.8Å |
| 159 | V | 96.8 | Very high | 96.4 | Very high | 3 Ų | 3 | 66.8 Ų | 66.8 | 2% | 0.018 | 40% | 0.401 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -96 | 112.8 | 179.6 | -174.8 | 0 | 0 | 0 | 0 | 108.1 | T166 V167 V169 V218 L220 K229 V231 | V159-T166 WeakPolarHBondContact O-CA 3.15Å; V159-V167 PolarHBondContact N-O 2.67Å; V159-V167 PolarHBondContact O-N 3.43Å; V159-V169 HydrophobicContact CG2-CB 4.18Å; V159-V169 HydrophobicContact CG2-CG2 3.6Å; V159-V218 HydrophobicContact CB-CG1 4.38Å; V159-V218 HydrophobicContact CG1-CG1 4.33Å; V159-V218 HydrophobicContact CG2-CG1 4.49Å; V159-L220 HydrophobicContact CB-CD2 4.42Å; V159-L220 HydrophobicContact CG1-CD1 4.3Å; V159-L220 HydrophobicContact CG1-CD2 4.07Å; V159-K229 HydrophobicContact CG1-CB 4.24Å; V159-K229 HydrophobicContact CG1-CD 3.66Å; V159-K229 HydrophobicContact CG1-CG 4.05Å; V159-V231 HydrophobicContact CG1-CG2 4.06Å; V159-V231 HydrophobicContact CG2-CG2 3.92Å |
| 160 | T | 94.8 | Very high | 96.6 | Very high | 74 Ų | 74 | 72.6 Ų | 72.6 | 45% | 0.454 | 42% | 0.418 | S | S | . | . | trans | -117.1 | 154.9 | -177.7 | 60 | 0 | 0 | 0 | 0 | 111.5 | T166 K229 | T160-T166 HydrophobicContact CG2-CG2 3.77Å; T160-T166 WeakPolarHBondContact CG2-OG1 3.38Å; T160-K229 PolarHBondContact O-NZ 3.39Å | ||
| 161 | A | 93.9 | Very high | 96.7 | Very high | 37 Ų | 37 | 71.8 Ų | 71.8 | 31% | 0.306 | 41% | 0.411 | S | S | . | . | trans | -153.2 | 152.9 | 168.1 | 0 | 0 | 0 | 0 | 0 | 108.7 | G163 C164 L220 | A161-G163 PolarHBondContact O-N 3.01Å; A161-C164 HydrophobicContact CB-CB 4.04Å; A161-C164 WeakPolarHBondContact O-CB 3.38Å; A161-C164 PolarHBondContact O-N 3.48Å; A161-C164 VanDerWaalsContact O-N 3.07Å; A161-L220 HydrophobicContact CB-CD1 3.63Å | ||
| 162 | D | 92.9 | Very high | 96.7 | Very high | 166 Ų | 166 | 72 Ų | 72 | 89% | 0.888 | 41% | 0.406 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -61.7 | 133.3 | -177.2 | -62.1 | -32.9 | 0 | 0 | 0 | 111.4 | C164 | D162-C164 PolarHBondContact O-N 3.46Å; D162-C164 PolarHBondContact O-SG 2.96Å; D162-C164 VanDerWaalsContact O-SG 3.41Å |
| 163 | G | 93.2 | Very high | 96.6 | Very high | 75 Ų | 75 | 74.2 Ų | 74.2 | 77% | 0.773 | 41% | 0.413 | S | S | * | . | T | Hydrogen-bonded Turn | trans | 69.8 | 7.8 | -177.1 | 0 | 0 | 0 | 0 | 0 | 114.8 | A161 C222 | A161-G163 PolarHBondContact O-N 3.01Å; G163-C222 WeakPolarHBondContact O-CA 3.01Å |
| 164 | C | 96.1 | Very high | 96.6 | Very high | 25 Ų | 25 | 73.3 Ų | 73.3 | 17% | 0.169 | 41% | 0.408 | C | S | . | . | S | Bend | trans | -116.1 | 149.1 | -177.4 | -52.6 | 0 | 0 | 0 | 0 | 113 | A161 D162 L220 R221 C222 | A161-C164 HydrophobicContact CB-CB 4.04Å; A161-C164 WeakPolarHBondContact O-CB 3.38Å; A161-C164 PolarHBondContact O-N 3.48Å; A161-C164 VanDerWaalsContact O-N 3.07Å; D162-C164 PolarHBondContact O-N 3.46Å; D162-C164 PolarHBondContact O-SG 2.96Å; D162-C164 VanDerWaalsContact O-SG 3.41Å; C164-L220 HydrophobicContact CB-CB 4.06Å; C164-R221 CarbonylContact C-O 3.58Å; C164-R221 WeakPolarHBondContact CA-O 3.43Å; C164-C222 HydrophobicContact CB-CB 3.99Å; C164-C222 WeakPolarHBondContact CB-SG 3.42Å; C164-C222 WeakPolarHBondContact SG-CB 3.43Å; C164-C222 CovalentContact SG-SG 2.02Å; C164-C222 PolarHBondContact SG-SG 3Å |
| 165 | Q | 95.4 | Very high | 96.6 | Very high | 124 Ų | 124 | 73.8 Ų | 73.8 | 58% | 0.579 | 40% | 0.4 | S | S | * | . | trans | -67.1 | 137.2 | 172.1 | -65.7 | 178.2 | 3.7 | 0 | 0 | 110.5 | R221 | Q165-R221 HydrophobicContact CB-CB 4.49Å; Q165-R221 HydrophobicContact CG-CB 4.49Å; Q165-R221 PolarHBondContact N-O 3.18Å | ||
| 166 | T | 96.1 | Very high | 96.4 | Very high | 80 Ų | 80 | 71.8 Ų | 71.8 | 49% | 0.491 | 40% | 0.4 | S | S | . | . | trans | -70.4 | 133.6 | 177.4 | -59.2 | 0 | 0 | 0 | 0 | 110.5 | H158 V159 T160 | H158-T166 HydrophobicContact CB-CG2 3.8Å; V159-T166 WeakPolarHBondContact O-CA 3.15Å; T160-T166 HydrophobicContact CG2-CG2 3.77Å; T160-T166 WeakPolarHBondContact CG2-OG1 3.38Å | ||
| 167 | V | 97 | Very high | 96.2 | Very high | 45 Ų | 45 | 74.9 Ų | 74.9 | 27% | 0.273 | 41% | 0.409 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -114.4 | 136.3 | 175.5 | 176 | 0 | 0 | 0 | 0 | 110.2 | V159 V218 L220 | V159-V167 PolarHBondContact N-O 2.67Å; V159-V167 PolarHBondContact O-N 3.43Å; V167-V218 HydrophobicContact CB-CG1 3.98Å; V167-V218 HydrophobicContact CG1-CG1 3.71Å; V167-L220 HydrophobicContact CB-CD2 3.82Å; V167-L220 HydrophobicContact CG2-CD2 3.6Å |
| 168 | T | 97.4 | Very high | 96 | Very high | 72 Ų | 72 | 73.6 Ų | 73.6 | 44% | 0.442 | 41% | 0.406 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -89 | 127.7 | 178.1 | -59.5 | 0 | 0 | 0 | 0 | 111.1 | T156 | T156-T168 HydrophobicContact CG2-CG2 3.28Å |
| 169 | V | 97.4 | Very high | 95.6 | Very high | 20 Ų | 20 | 69 Ų | 69 | 12% | 0.121 | 39% | 0.387 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -121.4 | 129.6 | 175.7 | 176.3 | 0 | 0 | 0 | 0 | 109.2 | Q157 V159 V218 V233 | Q157-V169 WeakPolarHBondContact CA-O 2.98Å; Q157-V169 HydrophobicContact CB-CB 4.46Å; Q157-V169 WeakPolarHBondContact CB-O 3.13Å; Q157-V169 PolarHBondContact N-O 3.07Å; Q157-V169 PolarHBondContact O-N 2.83Å; V159-V169 HydrophobicContact CG2-CB 4.18Å; V159-V169 HydrophobicContact CG2-CG2 3.6Å; V169-V218 HydrophobicContact CG2-CG1 4.16Å; V169-V218 HydrophobicContact CG2-CG2 3.86Å; V169-V233 HydrophobicContact CG1-CG2 4.07Å |
| 170 | Y | 97.7 | Very high | 95.1 | Very high | 182 Ų | 182 | 72.1 Ų | 72.1 | 71% | 0.714 | 41% | 0.409 | S | S | * | . | E | Extended strand (participates in β ladder) | trans | -83.3 | 117.6 | 171.8 | -61.6 | -72.5 | 0 | 0 | 0 | 109.6 | ||
| 171 | N | 97.9 | Very high | 94.5 | Very high | 11 Ų | 11 | 71.9 Ų | 71.9 | 6% | 0.059 | 40% | 0.404 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -129.4 | 178 | -175.8 | -159.3 | -7.9 | 0 | 0 | 0 | 110.3 | P154 F155 Q157 M232 V233 V234 | P154-N171 CarbonylContact C-O 3.59Å; P154-N171 WeakPolarHBondContact CA-O 3.04Å; F155-N171 HydrophobicContact CD1-CB 4.29Å; F155-N171 HydrophobicContact CE1-CB 3.68Å; F155-N171 HydrophobicContact CE2-CB 4.36Å; F155-N171 HydrophobicContact CZ-CB 3.71Å; F155-N171 PolarHBondContact N-O 2.64Å; F155-N171 PolarHBondContact O-N 3.19Å; F155-N171 VanDerWaalsContact O-O 3.07Å; Q157-N171 HydrophobicContact CB-CB 4.38Å; Q157-N171 PolarHBondContact OE1-ND2 2.88Å; N171-M232 PolarHBondContact ND2-O 3.47Å; N171-V233 VanDerWaalsContact OD1-CA 3.31Å; N171-V233 WeakPolarHBondContact OD1-CA 3.03Å; N171-V234 PolarHBondContact OD1-N 3.27Å |
| 172 | K | 98.2 | Very high | 93.9 | Very high | 80 Ų | 80 | 75.7 Ų | 75.7 | 35% | 0.348 | 42% | 0.415 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -131.3 | 146.2 | 176.1 | -49 | -177.5 | -164.8 | 176.4 | 0 | 110.7 | A152 V153 F155 V234 E235 | A152-K172 HydrophobicContact CB-CB 4.04Å; A152-K172 HydrophobicContact CB-CD 3.64Å; A152-K172 HydrophobicContact CB-CG 4.47Å; V153-K172 CarbonylContact O-C 3.53Å; V153-K172 WeakPolarHBondContact O-CA 3.48Å; F155-K172 VanDerWaalsContact CE1-C 3.45Å; K172-V234 HydrophobicContact CB-CB 4.16Å; K172-V234 HydrophobicContact CB-CG1 4.37Å; K172-V234 WeakPolarHBondContact CD-O 3.33Å; K172-V234 WeakPolarHBondContact CG-O 3.22Å; K172-V234 WeakPolarHBondContact O-CB 3.33Å; K172-V234 WeakPolarHBondContact O-CG2 3.36Å; K172-E235 PolarHBondContact NZ-O 2.99Å |
| 173 | L | 96.9 | Very high | 93.2 | Very high | 80 Ų | 80 | 71.4 Ų | 71.4 | 42% | 0.419 | 39% | 0.394 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -108.3 | 150.8 | 169.9 | 65.5 | 84.8 | 0 | 0 | 0 | 109.7 | A152 V153 F155 F175 | A152-L173 CarbonylContact C-O 3.55Å; A152-L173 WeakPolarHBondContact CA-O 3.25Å; V153-L173 HydrophobicContact CB-CD1 3.93Å; V153-L173 HydrophobicContact CB-CG 4.11Å; V153-L173 HydrophobicContact CG2-CD1 4.31Å; V153-L173 PolarHBondContact N-O 3.26Å; V153-L173 PolarHBondContact O-N 2.99Å; F155-L173 HydrophobicContact CD1-CB 4.18Å; F155-L173 HydrophobicContact CD1-CD2 4.26Å; F155-L173 HydrophobicContact CD1-CG 4.4Å; F155-L173 HydrophobicContact CE1-CB 4.18Å; L173-F175 HydrophobicContact CD1-CB 3.96Å |
| 174 | C | 97.9 | Very high | 92.5 | Very high | 35 Ų | 35 | 71.6 Ų | 71.6 | 24% | 0.236 | 38% | 0.382 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -89.8 | 126.4 | 175.9 | -61.7 | 0 | 0 | 0 | 0 | 110.6 | T151 P210 C237 | T151-C174 WeakPolarHBondContact O-CA 3.31Å; C174-P210 VanDerWaalsContact SG-N 3.36Å; C174-C237 WeakPolarHBondContact CA-SG 3.26Å; C174-C237 HydrophobicContact CB-CB 3.71Å; C174-C237 WeakPolarHBondContact CB-SG 3.28Å; C174-C237 WeakPolarHBondContact SG-CB 3.48Å; C174-C237 CovalentContact SG-SG 2.04Å; C174-C237 PolarHBondContact SG-SG 3.49Å |
| 175 | F | 96.6 | Very high | 91.1 | Very high | 114 Ų | 114 | 73.6 Ų | 73.6 | 50% | 0.5 | 40% | 0.396 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -134.3 | 130.3 | 179 | -177.9 | -101.2 | 0 | 0 | 0 | 110.6 | T151 V153 L173 C208 | T151-F175 PolarHBondContact N-O 2.85Å; T151-F175 PolarHBondContact O-N 3.15Å; T151-F175 PolarHBondContact OG1-O 3.45Å; V153-F175 HydrophobicContact CG2-CB 3.98Å; L173-F175 HydrophobicContact CD1-CB 3.96Å; F175-C208 VanDerWaalsContact C-SG 3.6Å |
| 176 | G | 95.4 | Very high | 89.5 | Confident | 30 Ų | 30 | 76.6 Ų | 76.6 | 31% | 0.309 | 41% | 0.41 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | 173.8 | 173.1 | -175.2 | 0 | 0 | 0 | 0 | 0 | 116.2 | T149 | T149-G176 CarbonylContact O-C 3.47Å; T149-G176 VanDerWaalsContact O-C 3.28Å; T149-G176 WeakPolarHBondContact O-CA 3.46Å |
| 177 | Q | 93.8 | Very high | 87.5 | Confident | 145 Ų | 145 | 75.5 Ų | 75.5 | 68% | 0.678 | 42% | 0.415 | S | S | * | . | E | Extended strand (participates in β ladder) | trans | -120.1 | 120.5 | 171.8 | -65.7 | 179.7 | -19.9 | 0 | 0 | 109.4 | Q148 T149 | Q148-Q177 WeakPolarHBondContact CA-O 3.49Å; T149-Q177 PolarHBondContact N-O 3.01Å; T149-Q177 CarbonylContact O-C 3.28Å; T149-Q177 PolarHBondContact O-N 3.37Å; T149-Q177 VanDerWaalsContact O-O 3.06Å; T149-Q177 PolarHBondContact OG1-N 2.97Å |
| 178 | C | 92.9 | Very high | 85.5 | Confident | 27 Ų | 27 | 77.8 Ų | 77.8 | 18% | 0.182 | 42% | 0.422 | C | S | . | . | trans | -114.5 | 141 | 178.1 | -59.3 | 0 | 0 | 0 | 0 | 109.9 | C208 C239 | C178-C208 PolarHBondContact SG-N 2.94Å; C178-C208 VanDerWaalsContact SG-N 3.38Å; C178-C239 VanDerWaalsContact CA-SG 3.52Å; C178-C239 HydrophobicContact CB-CB 3.74Å; C178-C239 WeakPolarHBondContact CB-SG 3.41Å; C178-C239 WeakPolarHBondContact SG-CA 3.31Å; C178-C239 WeakPolarHBondContact SG-CB 3.48Å; C178-C239 CovalentContact SG-SG 2.04Å; C178-C239 PolarHBondContact SG-SG 3.37Å | ||
| 179 | S | 89.2 | Confident | 83.4 | Confident | 24 Ų | 24 | 82.6 Ų | 82.6 | 17% | 0.168 | 44% | 0.437 | C | S | . | . | trans | -84 | 136.3 | 179.2 | -39.2 | 0 | 0 | 0 | 0 | 109.8 | T146 Q148 S206 | T146-S179 VanDerWaalsContact CB-OG 3.25Å; T146-S179 WeakPolarHBondContact CB-OG 3.42Å; T146-S179 WeakPolarHBondContact OG1-CB 3.5Å; T146-S179 PolarHBondContact OG1-OG 3.19Å; Q148-S179 VanDerWaalsContact CG-OG 3.31Å; Q148-S179 WeakPolarHBondContact CG-OG 3.43Å; Q148-S179 PolarHBondContact NE2-OG 2.89Å; S179-S206 WeakPolarHBondContact O-CB 3.5Å; S179-S206 PolarHBondContact O-OG 3Å | ||
| 180 | S | 85.8 | Confident | 80.9 | Confident | 69 Ų | 69 | 85.2 Ų | 85.2 | 48% | 0.483 | 46% | 0.461 | S | S | . | . | trans | -125.3 | 157.4 | 168.8 | 53.5 | 0 | 0 | 0 | 0 | 109.1 | ||||
| 181 | L | 82 | Confident | 78.2 | Confident | 68 Ų | 68 | 83.5 Ų | 83.5 | 36% | 0.356 | 46% | 0.464 | S | S | . | . | trans | -133.5 | 139.9 | 178.5 | 73.3 | 97.4 | 0 | 0 | 0 | 108.9 | L139 L143 V183 | L139-L181 HydrophobicContact CD1-CD1 4.34Å; L143-L181 HydrophobicContact CD1-CB 4.21Å; L143-L181 HydrophobicContact CD1-CD2 3.25Å; L143-L181 HydrophobicContact CD1-CG 4.32Å; L143-L181 HydrophobicContact CD2-CD2 3.73Å; L143-L181 HydrophobicContact CG-CD2 4.12Å; L181-V183 HydrophobicContact CD1-CB 4.46Å; L181-V183 HydrophobicContact CD1-CG2 3.41Å; L181-V183 VanDerWaalsContact CD1-CG2 3.41Å | ||
| 182 | F | 81.5 | Confident | 75.9 | Confident | 118 Ų | 118 | 88.4 Ų | 88.4 | 52% | 0.518 | 50% | 0.497 | S | S | . | . | trans | -115 | 124.2 | 169.3 | 177.2 | -106.6 | 0 | 0 | 0 | 108 | P184 E188 | F182-P184 HydrophobicContact CD1-CG 4.21Å; F182-P184 HydrophobicContact CE1-CB 4.24Å; F182-P184 HydrophobicContact CE1-CG 3.79Å; F182-E188 WeakPolarHBondContact CE2-OE1 3.08Å; F182-E188 WeakPolarHBondContact CZ-OE1 3.5Å; F182-E188 WeakPolarHBondContact CZ-OE2 3.43Å | ||
| 183 | V | 79.6 | Confident | 73.3 | Confident | 75 Ų | 75 | 89.7 Ų | 89.7 | 46% | 0.455 | 52% | 0.516 | S | S | . | . | trans | -114.8 | 110.9 | 174.5 | 174.5 | 0 | 0 | 0 | 0 | 105.8 | L139 L181 S185 | L139-V183 HydrophobicContact CD1-CG2 3.51Å; L139-V183 HydrophobicContact CD2-CG2 4.38Å; L181-V183 HydrophobicContact CD1-CB 4.46Å; L181-V183 HydrophobicContact CD1-CG2 3.41Å; L181-V183 VanDerWaalsContact CD1-CG2 3.41Å; V183-S185 PolarHBondContact O-N 2.91Å | ||
| 184 | P | 76.8 | Confident | 71.1 | Confident | 80 Ų | 80 | 92.2 Ų | 92.2 | 52% | 0.519 | 54% | 0.537 | S | S | . | . | trans | -55.6 | 133.1 | 173.7 | -21.1 | 30.1 | 0 | 0 | 0 | 109.8 | F182 E188 | F182-P184 HydrophobicContact CD1-CG 4.21Å; F182-P184 HydrophobicContact CE1-CB 4.24Å; F182-P184 HydrophobicContact CE1-CG 3.79Å; P184-E188 VanDerWaalsContact CA-OE2 3.28Å; P184-E188 WeakPolarHBondContact CA-OE2 3.45Å | ||
| 185 | S | 67.7 | Low | 68.6 | Low | 66 Ų | 66 | 94 Ų | 94 | 46% | 0.462 | 56% | 0.561 | S | S | . | * | trans | -108.6 | 148.8 | 176.3 | 71.8 | 0 | 0 | 0 | 0 | 110.6 | V183 G187 E188 | V183-S185 PolarHBondContact O-N 2.91Å; S185-G187 PolarHBondContact O-N 3.1Å; S185-E188 PolarHBondContact N-OE2 3.49Å; S185-E188 WeakPolarHBondContact O-CB 3.36Å; S185-E188 PolarHBondContact O-N 2.68Å | ||
| 186 | E | 61.2 | Low | 65.9 | Low | 188 Ų | 188 | 94.4 Ų | 94.4 | 88% | 0.879 | 57% | 0.573 | S | S | * | * | G | 310 helix | trans | -62.9 | -15.7 | -173.4 | -150.5 | 156.3 | -165.3 | 0 | 0 | 113 | ||
| 187 | G | 55.4 | Low | 63.6 | Low | 57 Ų | 57 | 97 Ų | 97 | 59% | 0.588 | 60% | 0.6 | S | S | * | * | G | 310 helix | trans | -81.1 | -6.5 | 173.2 | 0 | 0 | 0 | 0 | 0 | 115.7 | S185 | S185-G187 PolarHBondContact O-N 3.1Š|
| 188 | E | 54.2 | Low | 61.5 | Low | 92 Ų | 92 | 92.5 Ų | 92.5 | 43% | 0.43 | 59% | 0.588 | S | S | . | * | G | 310 helix | trans | -84.1 | -11.9 | 178.7 | -70.8 | 174.8 | 144.2 | 0 | 0 | 113.4 | F182 P184 S185 | F182-E188 WeakPolarHBondContact CE2-OE1 3.08Å; F182-E188 WeakPolarHBondContact CZ-OE1 3.5Å; F182-E188 WeakPolarHBondContact CZ-OE2 3.43Å; P184-E188 VanDerWaalsContact CA-OE2 3.28Å; P184-E188 WeakPolarHBondContact CA-OE2 3.45Å; S185-E188 PolarHBondContact N-OE2 3.49Å; S185-E188 WeakPolarHBondContact O-CB 3.36Å; S185-E188 PolarHBondContact O-N 2.68Å |
| 189 | F | 52.6 | Low | 59.3 | Low | 173 Ų | 173 | 100.8 Ų | 100.8 | 76% | 0.759 | 62% | 0.621 | S | S | * | * | S | Bend | trans | -101.9 | -2.4 | 176.9 | -59.5 | -79.8 | 0 | 0 | 0 | 113.1 | D191 | F189-D191 PolarHBondContact O-N 2.87Š|
| 190 | A | 45.5 | Very low | 57.4 | Low | 75 Ų | 75 | 107.9 Ų | 107.9 | 62% | 0.62 | 65% | 0.651 | S | S | * | * | S | Bend | trans | -89 | 96.3 | 175.5 | 0 | 0 | 0 | 0 | 0 | 110.4 | ||
| 191 | D | 42.2 | Very low | 55.9 | Low | 146 Ų | 146 | 115.4 Ų | 115.4 | 78% | 0.781 | 67% | 0.669 | S | S | * | * | trans | 59.7 | 121 | 166.4 | -76.2 | -37.2 | 0 | 0 | 0 | 120.3 | F189 S193 | F189-D191 PolarHBondContact O-N 2.87Å; D191-S193 VanDerWaalsContact C-N 3.31Å; D191-S193 PolarHBondContact O-N 2.92Å | ||
| 192 | P | 47.6 | Very low | 54.8 | Low | 115 Ų | 115 | 121.8 Ų | 121.8 | 75% | 0.747 | 69% | 0.689 | S | S | * | * | trans | -73.8 | 87.9 | 160.8 | 31.6 | -28 | 0 | 0 | 0 | 108.3 | P194 | P192-P194 VanDerWaalsContact O-CD 3.26Å; P192-P194 WeakPolarHBondContact O-CD 3.5Å | ||
| 193 | S | 43.7 | Very low | 54 | Low | 107 Ų | 107 | 117.2 Ų | 117.2 | 75% | 0.748 | 67% | 0.674 | S | S | * | * | trans | -63.6 | 117.2 | 167.8 | -146.5 | 0 | 0 | 0 | 0 | 108.5 | D191 G195 | D191-S193 VanDerWaalsContact C-N 3.31Å; D191-S193 PolarHBondContact O-N 2.92Å; S193-G195 PolarHBondContact O-N 3.49Å | ||
| 194 | P | 50.6 | Low | 53.8 | Low | 132 Ų | 132 | 117.4 Ų | 117.4 | 86% | 0.857 | 68% | 0.677 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -83.9 | 96.4 | -176.3 | 31.4 | -27.5 | 0 | 0 | 0 | 108.2 | P192 | P192-P194 VanDerWaalsContact O-CD 3.26Å; P192-P194 WeakPolarHBondContact O-CD 3.5Å |
| 195 | G | 45.3 | Very low | 54.2 | Low | 73 Ų | 73 | 116.7 Ų | 116.7 | 75% | 0.753 | 67% | 0.674 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -176.9 | -24.9 | 176.4 | 0 | 0 | 0 | 0 | 0 | 117 | S193 | S193-G195 PolarHBondContact O-N 3.49Š|
| 196 | T | 40.9 | Very low | 55.3 | Low | 122 Ų | 122 | 114.8 Ų | 114.8 | 75% | 0.748 | 66% | 0.66 | S | S | * | * | trans | -128.6 | 79.9 | -179.1 | 8.8 | 0 | 0 | 0 | 0 | 109.1 | A198 | T196-A198 VanDerWaalsContact C-N 3.29Å; T196-A198 PolarHBondContact O-N 2.88Å | ||
| 197 | G | 46.4 | Very low | 56.7 | Low | 85 Ų | 85 | 111.7 Ų | 111.7 | 88% | 0.876 | 64% | 0.64 | S | S | * | * | trans | -63.9 | 96 | 162.4 | 0 | 0 | 0 | 0 | 0 | 108.3 | ||||
| 198 | A | 50.3 | Low | 58.7 | Low | 51 Ų | 51 | 110.3 Ų | 110.3 | 42% | 0.421 | 62% | 0.621 | S | S | . | * | S | Bend | trans | 172.9 | 153.5 | 136.5 | 0 | 0 | 0 | 0 | 0 | 113 | T196 H200 | T196-A198 VanDerWaalsContact C-N 3.29Å; T196-A198 PolarHBondContact O-N 2.88Å; A198-H200 PolarHBondContact O-N 2.81Å |
| 199 | F | 47.1 | Very low | 60.6 | Low | 200 Ų | 200 | 106.1 Ų | 106.1 | 88% | 0.877 | 60% | 0.602 | S | S | * | * | S | Bend | trans | 73.4 | -9.7 | 154.8 | -57.2 | -64.4 | 0 | 0 | 0 | 123.2 | R201 | F199-R201 PolarHBondContact O-N 3.28Š|
| 200 | H | 48.9 | Very low | 62.7 | Low | 173 Ų | 173 | 100.7 Ų | 100.7 | 80% | 0.801 | 59% | 0.585 | S | S | * | * | trans | -78.2 | 16.3 | 179.1 | -64.4 | -58.3 | 0 | 0 | 0 | 116.4 | A198 | A198-H200 PolarHBondContact O-N 2.81Š| ||
| 201 | R | 54.3 | Low | 65.1 | Low | 228 Ų | 228 | 102.9 Ų | 102.9 | 86% | 0.86 | 58% | 0.58 | S | S | * | * | trans | -127 | 38.8 | -167.6 | -61 | -168.4 | -171.4 | -131.2 | 3.5 | 115.5 | F199 | F199-R201 PolarHBondContact O-N 3.28Š| ||
| 202 | R | 59.9 | Low | 67.7 | Low | 202 Ų | 202 | 100.8 Ų | 100.8 | 76% | 0.762 | 56% | 0.564 | S | S | * | * | trans | -135.8 | 113.2 | 167.3 | -66.8 | -170.4 | -166.4 | -115.8 | 2.9 | 109.4 | ||||
| 203 | G | 64.8 | Low | 70 | Confident | 21 Ų | 21 | 97.5 Ų | 97.5 | 22% | 0.216 | 55% | 0.547 | C | S | . | . | trans | -56.3 | 164.2 | 164.9 | 0 | 0 | 0 | 0 | 0 | 111.2 | C205 | G203-C205 PolarHBondContact O-N 3.38Š| ||
| 204 | P | 74.6 | Confident | 72.5 | Confident | 79 Ų | 79 | 97 Ų | 97 | 51% | 0.513 | 53% | 0.533 | S | S | . | . | trans | -59.7 | 113.1 | -178.4 | 23.3 | -32 | 0 | 0 | 0 | 111.2 | T241 | P204-T241 HydrophobicContact CB-CG2 3.51Š| ||
| 205 | C | 85.3 | Confident | 74.8 | Confident | 66 Ų | 66 | 94.9 Ų | 94.9 | 45% | 0.446 | 52% | 0.518 | S | S | . | . | trans | -93 | 133.7 | 173.9 | -68.4 | 0 | 0 | 0 | 0 | 110.5 | G203 G242 | G203-C205 PolarHBondContact O-N 3.38Å; C205-G242 PolarHBondContact O-N 2.89Å | ||
| 206 | S | 89.4 | Confident | 77.2 | Confident | 25 Ų | 25 | 94 Ų | 94 | 18% | 0.175 | 50% | 0.497 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -95.6 | 138.6 | 171.7 | -55.8 | 0 | 0 | 0 | 0 | 110.8 | S179 E240 T241 | S179-S206 WeakPolarHBondContact O-CB 3.5Å; S179-S206 PolarHBondContact O-OG 3Å; S206-E240 CarbonylContact C-O 3.58Å; S206-E240 WeakPolarHBondContact CA-O 3.31Å; S206-T241 PolarHBondContact OG-OG1 2.8Å |
| 207 | R | 92.4 | Very high | 79.9 | Confident | 123 Ų | 123 | 90.3 Ų | 90.3 | 46% | 0.464 | 48% | 0.479 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -130.2 | 151.7 | -179.5 | 62.8 | 175.9 | -168.2 | 153.8 | 1.9 | 110.7 | A209 C239 E240 | R207-A209 HydrophobicContact CG-CB 4.27Å; R207-A209 PolarHBondContact O-N 3.39Å; R207-C239 WeakPolarHBondContact O-CA 3.3Å; R207-E240 HydrophobicContact CG-CG 4.04Å; R207-E240 IonicContact CZ-OE1 3.22Å; R207-E240 VanDerWaalsContact CZ-OE1 3.22Å; R207-E240 PolarHBondContact N-O 2.86Å; R207-E240 IonicContact NE-OE1 2.92Å; R207-E240 PolarHBondContact NE-OE1 2.97Å; R207-E240 IonicContact NH2-OE1 2.73Å; R207-E240 PolarHBondContact NH2-OE1 3.17Å; R207-E240 PolarHBondContact O-N 3.38Å |
| 208 | C | 95.9 | Very high | 82.3 | Confident | 28 Ų | 28 | 86.6 Ų | 86.6 | 19% | 0.189 | 44% | 0.44 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -82.7 | 112.4 | 171.3 | -179.8 | 0 | 0 | 0 | 0 | 108.2 | C150 F175 C178 | C150-C208 WeakPolarHBondContact CA-SG 3Å; C150-C208 HydrophobicContact CB-CB 3.89Å; C150-C208 WeakPolarHBondContact CB-SG 3.11Å; C150-C208 WeakPolarHBondContact SG-CA 3.35Å; C150-C208 WeakPolarHBondContact SG-CB 3.4Å; C150-C208 CovalentContact SG-SG 2.04Å; C150-C208 PolarHBondContact SG-SG 3.5Å; F175-C208 VanDerWaalsContact C-SG 3.6Å; C178-C208 PolarHBondContact SG-N 2.94Å; C178-C208 VanDerWaalsContact SG-N 3.38Å |
| 209 | A | 95.3 | Very high | 84.5 | Confident | 4 Ų | 4 | 87.7 Ų | 87.7 | 3% | 0.033 | 44% | 0.442 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -137.4 | 165.2 | -172.3 | 0 | 0 | 0 | 0 | 0 | 111.8 | R207 F211 C237 K238 E240 | R207-A209 HydrophobicContact CG-CB 4.27Å; R207-A209 PolarHBondContact O-N 3.39Å; A209-F211 PolarHBondContact O-N 3.5Å; A209-C237 VanDerWaalsContact O-CA 3.27Å; A209-C237 WeakPolarHBondContact O-CA 3.32Å; A209-K238 PolarHBondContact N-O 2.86Å; A209-K238 PolarHBondContact O-N 2.92Å; A209-E240 HydrophobicContact CB-CG 3.8Å; A209-E240 VanDerWaalsContact CB-OE1 3.29Å; A209-E240 WeakPolarHBondContact CB-OE1 3.22Å |
| 210 | P | 96.8 | Very high | 86.8 | Confident | 60 Ų | 60 | 78.2 Ų | 78.2 | 39% | 0.39 | 40% | 0.401 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -59.4 | 119.4 | 175.9 | -23.3 | 34.6 | 0 | 0 | 0 | 110.8 | C174 A213 V234 | C174-P210 VanDerWaalsContact SG-N 3.36Å; P210-A213 HydrophobicContact CB-CB 4.3Å; P210-V234 HydrophobicContact CB-CG1 4.17Å; P210-V234 HydrophobicContact CB-CG2 4.23Å; P210-V234 HydrophobicContact CG-CG1 4.49Å; P210-V234 HydrophobicContact CG-CG2 4.03Å |
| 211 | F | 95.6 | Very high | 89.1 | Confident | 121 Ų | 121 | 77.8 Ų | 77.8 | 53% | 0.531 | 39% | 0.392 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -88.7 | -35.2 | 172.7 | 177.5 | -105.9 | 0 | 0 | 0 | 111.3 | A209 E236 K238 | A209-F211 PolarHBondContact O-N 3.5Å; F211-E236 PolarHBondContact N-O 3.41Å; F211-K238 HydrophobicContact CB-CB 3.96Å; F211-K238 HydrophobicContact CB-CD 4.08Å; F211-K238 HydrophobicContact CB-CG 3.76Å; F211-K238 HydrophobicContact CD1-CD 3.83Å; F211-K238 HydrophobicContact CD1-CG 4.36Å; F211-K238 HydrophobicContact CD2-CB 4.35Å; F211-K238 HydrophobicContact CD2-CD 3.71Å; F211-K238 HydrophobicContact CD2-CG 4.25Å; F211-K238 HydrophobicContact CE1-CD 4.22Å; F211-K238 HydrophobicContact CE2-CD 4.08Å; F211-K238 HydrophobicContact CG-CB 4.28Å; F211-K238 HydrophobicContact CG-CD 3.57Å; F211-K238 HydrophobicContact CG-CG 3.85Å; F211-K238 HydrophobicContact CZ-CD 4.32Å |
| 212 | K | 96.6 | Very high | 91.1 | Very high | 101 Ų | 101 | 68 Ų | 68 | 44% | 0.439 | 36% | 0.358 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -136 | 122.7 | 176.1 | -166.7 | 179.2 | -179.3 | -145.4 | 0 | 108.6 | E235 E236 | K212-E235 HydrophobicContact CB-CB 4.24Å; K212-E235 HydrophobicContact CD-CB 4.37Å; K212-E235 WeakPolarHBondContact CD-OE2 3.16Å; K212-E235 WeakPolarHBondContact CE-OE2 3.26Å; K212-E235 HydrophobicContact CG-CB 4.26Å; K212-E235 IonicContact NZ-OE2 2.83Å; K212-E235 PolarHBondContact NZ-OE2 3.25Å; K212-E235 PolarHBondContact O-N 3.29Å; K212-E236 HydrophobicContact CB-CB 4.03Å; K212-E236 HydrophobicContact CB-CG 4.39Å; K212-E236 PolarHBondContact N-O 2.9Å; K212-E236 PolarHBondContact O-N 3.31Å |
| 213 | A | 96.6 | Very high | 92.6 | Very high | 46 Ų | 46 | 61.9 Ų | 61.9 | 38% | 0.38 | 36% | 0.358 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -146.2 | 152.5 | 177 | 0 | 0 | 0 | 0 | 0 | 109.4 | P210 M232 V233 | P210-A213 HydrophobicContact CB-CB 4.3Å; A213-M232 HydrophobicContact CB-CG 4Å; A213-M232 HydrophobicContact CB-SD 4.24Å; A213-V233 CarbonylContact C-O 3.5Å; A213-V233 VanDerWaalsContact CA-O 3.27Å; A213-V233 WeakPolarHBondContact CA-O 3.32Å |
| 214 | Q | 96.4 | Very high | 93.9 | Very high | 98 Ų | 98 | 66.5 Ų | 66.5 | 46% | 0.458 | 39% | 0.394 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -127.9 | 146.9 | 177.7 | 57.5 | 176.1 | 1.8 | 0 | 0 | 109.9 | V216 M232 V233 | Q214-V216 HydrophobicContact CG-CG2 3.93Å; Q214-M232 CarbonylContact O-C 3.5Å; Q214-M232 WeakPolarHBondContact O-CA 3.36Å; Q214-V233 HydrophobicContact CG-CB 4.19Å; Q214-V233 PolarHBondContact N-O 3.07Å; Q214-V233 PolarHBondContact O-N 2.99Å |
| 215 | T | 97.1 | Very high | 94.8 | Very high | 87 Ų | 87 | 68 Ų | 68 | 53% | 0.534 | 39% | 0.394 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -95.3 | 118.6 | 172.3 | -60.8 | 0 | 0 | 0 | 0 | 108.7 | R230 | T215-R230 HydrophobicContact CG2-CB 3.76Å; T215-R230 HydrophobicContact CG2-CG 4.21Å |
| 216 | V | 95.9 | Very high | 95.2 | Very high | 53 Ų | 53 | 68.9 Ų | 68.9 | 32% | 0.321 | 40% | 0.398 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -108.3 | 136.2 | -176.3 | -165.8 | 0 | 0 | 0 | 0 | 109.1 | Q214 R230 V231 V233 | Q214-V216 HydrophobicContact CG-CG2 3.93Å; V216-R230 WeakPolarHBondContact O-CA 3.36Å; V216-V231 PolarHBondContact N-O 3.3Å; V216-V231 PolarHBondContact O-N 3.36Å; V216-V233 HydrophobicContact CB-CG2 4.29Å; V216-V233 HydrophobicContact CG2-CB 4.04Å; V216-V233 HydrophobicContact CG2-CG2 3.6Å |
| 217 | A | 97.3 | Very high | 95.4 | Very high | 45 Ų | 45 | 74.5 Ų | 74.5 | 37% | 0.372 | 42% | 0.415 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -81.9 | 121.1 | 171.6 | 0 | 0 | 0 | 0 | 0 | 109.5 | ||
| 218 | V | 97.1 | Very high | 95.5 | Very high | 8 Ų | 8 | 75.5 Ų | 75.5 | 5% | 0.048 | 43% | 0.425 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -106.7 | 111.7 | -179.2 | -176.5 | 0 | 0 | 0 | 0 | 108.4 | V159 V167 V169 L220 K229 V231 | V159-V218 HydrophobicContact CB-CG1 4.38Å; V159-V218 HydrophobicContact CG1-CG1 4.33Å; V159-V218 HydrophobicContact CG2-CG1 4.49Å; V167-V218 HydrophobicContact CB-CG1 3.98Å; V167-V218 HydrophobicContact CG1-CG1 3.71Å; V169-V218 HydrophobicContact CG2-CG1 4.16Å; V169-V218 HydrophobicContact CG2-CG2 3.86Å; V218-L220 HydrophobicContact CG1-CD2 4.13Å; V218-L220 PolarHBondContact O-N 2.82Å; V218-K229 WeakPolarHBondContact CB-O 3.29Å; V218-K229 PolarHBondContact N-O 3.29Å; V218-K229 PolarHBondContact O-N 2.83Å; V218-V231 HydrophobicContact CB-CG2 4.46Å; V218-V231 HydrophobicContact CG2-CB 4.04Å; V218-V231 HydrophobicContact CG2-CG2 3.74Å |
| 219 | P | 96.7 | Very high | 95.5 | Very high | 73 Ų | 73 | 78.4 Ų | 78.4 | 47% | 0.474 | 43% | 0.434 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -76.1 | 120.9 | 178.1 | 29.6 | -32.9 | 0 | 0 | 0 | 110.5 | V226 | P219-V226 HydrophobicContact CB-CG1 3.72Å |
| 220 | L | 96.8 | Very high | 95.5 | Very high | 2 Ų | 2 | 86.6 Ų | 86.6 | 1% | 0.01 | 47% | 0.465 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -105 | 131.4 | 175.7 | -56.1 | -179.5 | 0 | 0 | 0 | 109.3 | V159 A161 C164 V167 V218 V226 W227 K229 | V159-L220 HydrophobicContact CB-CD2 4.42Å; V159-L220 HydrophobicContact CG1-CD1 4.3Å; V159-L220 HydrophobicContact CG1-CD2 4.07Å; A161-L220 HydrophobicContact CB-CD1 3.63Å; C164-L220 HydrophobicContact CB-CB 4.06Å; V167-L220 HydrophobicContact CB-CD2 3.82Å; V167-L220 HydrophobicContact CG2-CD2 3.6Å; V218-L220 HydrophobicContact CG1-CD2 4.13Å; V218-L220 PolarHBondContact O-N 2.82Å; L220-V226 CarbonylContact O-C 3.58Å; L220-V226 WeakPolarHBondContact O-CA 3.32Å; L220-W227 PolarHBondContact N-O 3.47Å; L220-W227 PolarHBondContact O-N 2.92Å; L220-K229 HydrophobicContact CD1-CB 3.94Å; L220-K229 HydrophobicContact CD1-CD 4.12Å; L220-K229 HydrophobicContact CG-CB 4.4Å |
| 221 | R | 96.8 | Very high | 95.5 | Very high | 163 Ų | 163 | 84.2 Ų | 84.2 | 62% | 0.615 | 45% | 0.449 | S | S | * | . | E | Extended strand (participates in β ladder) | trans | -89.2 | 120.2 | 177 | -67.7 | -176.6 | 176.5 | -175.7 | -1.5 | 110.1 | C164 Q165 | C164-R221 CarbonylContact C-O 3.58Å; C164-R221 WeakPolarHBondContact CA-O 3.43Å; Q165-R221 HydrophobicContact CB-CB 4.49Å; Q165-R221 HydrophobicContact CG-CB 4.49Å; Q165-R221 PolarHBondContact N-O 3.18Å |
| 222 | C | 95.6 | Very high | 95.6 | Very high | 23 Ų | 23 | 83.5 Ų | 83.5 | 16% | 0.155 | 45% | 0.448 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -121.8 | 75.5 | -177.5 | -38.2 | 0 | 0 | 0 | 0 | 108.5 | G163 C164 A224 Q225 | G163-C222 WeakPolarHBondContact O-CA 3.01Å; C164-C222 HydrophobicContact CB-CB 3.99Å; C164-C222 WeakPolarHBondContact CB-SG 3.42Å; C164-C222 WeakPolarHBondContact SG-CB 3.43Å; C164-C222 CovalentContact SG-SG 2.02Å; C164-C222 PolarHBondContact SG-SG 3Å; C222-A224 PolarHBondContact O-N 2.9Å; C222-Q225 PolarHBondContact N-O 3.34Å; C222-Q225 PolarHBondContact O-N 3Å |
| 223 | G | 91.9 | Very high | 95.6 | Very high | 74 Ų | 74 | 79.7 Ų | 79.7 | 76% | 0.763 | 43% | 0.433 | S | S | * | . | T | Hydrogen-bonded Turn | trans | 69.5 | -120.1 | -168.5 | 0 | 0 | 0 | 0 | 0 | 111.9 | ||
| 224 | A | 91.4 | Very high | 95.7 | Very high | 117 Ų | 117 | 78.1 Ų | 78.1 | 97% | 0.967 | 42% | 0.419 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -84.7 | -11.6 | 177.8 | 0 | 0 | 0 | 0 | 0 | 113.7 | C222 | C222-A224 PolarHBondContact O-N 2.9Š|
| 225 | Q | 93.6 | Very high | 95.7 | Very high | 110 Ų | 110 | 75.8 Ų | 75.8 | 51% | 0.514 | 41% | 0.408 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -99.1 | 149.1 | -178.9 | -167.3 | 174.6 | -4.4 | 0 | 0 | 111.2 | C222 | C222-Q225 PolarHBondContact N-O 3.34Å; C222-Q225 PolarHBondContact O-N 3Å |
| 226 | V | 94.8 | Very high | 95.7 | Very high | 85 Ų | 85 | 75.8 Ų | 75.8 | 52% | 0.515 | 40% | 0.402 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -108.8 | 128.9 | 169.4 | -179.2 | 0 | 0 | 0 | 0 | 108.7 | P219 L220 | P219-V226 HydrophobicContact CB-CG1 3.72Å; L220-V226 CarbonylContact O-C 3.58Å; L220-V226 WeakPolarHBondContact O-CA 3.32Å |
| 227 | W | 93.2 | Very high | 95.8 | Very high | 143 Ų | 143 | 73.9 Ų | 73.9 | 54% | 0.542 | 39% | 0.391 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -114.3 | 136.2 | 176.6 | -74.6 | 74.7 | 0 | 0 | 0 | 109.7 | L220 | L220-W227 PolarHBondContact N-O 3.47Å; L220-W227 PolarHBondContact O-N 2.92Å |
| 228 | E | 95 | Very high | 95.7 | Very high | 145 Ų | 145 | 76.2 Ų | 76.2 | 68% | 0.678 | 39% | 0.393 | S | S | * | . | E | Extended strand (participates in β ladder) | trans | -98 | 125.9 | 178.8 | -66.5 | -171.9 | 164.3 | 0 | 0 | 111.3 | ||
| 229 | K | 94.4 | Very high | 95.6 | Very high | 88 Ų | 88 | 77.7 Ų | 77.7 | 38% | 0.383 | 40% | 0.403 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -109.3 | 123.9 | 173.1 | -174.9 | 157 | 173.9 | 171.7 | 0 | 110 | V159 T160 V218 L220 V231 | V159-K229 HydrophobicContact CG1-CB 4.24Å; V159-K229 HydrophobicContact CG1-CD 3.66Å; V159-K229 HydrophobicContact CG1-CG 4.05Å; T160-K229 PolarHBondContact O-NZ 3.39Å; V218-K229 WeakPolarHBondContact CB-O 3.29Å; V218-K229 PolarHBondContact N-O 3.29Å; V218-K229 PolarHBondContact O-N 2.83Å; L220-K229 HydrophobicContact CD1-CB 3.94Å; L220-K229 HydrophobicContact CD1-CD 4.12Å; L220-K229 HydrophobicContact CG-CB 4.4Å; K229-V231 HydrophobicContact CG-CG2 4.34Å |
| 230 | R | 96.5 | Very high | 95.3 | Very high | 177 Ų | 177 | 77.6 Ų | 77.6 | 67% | 0.668 | 40% | 0.396 | S | S | * | . | E | Extended strand (participates in β ladder) | trans | -78.2 | 126.8 | 175.2 | -70.1 | -177 | -176.7 | -97.6 | -2.2 | 110 | T215 V216 | T215-R230 HydrophobicContact CG2-CB 3.76Å; T215-R230 HydrophobicContact CG2-CG 4.21Å; V216-R230 WeakPolarHBondContact O-CA 3.36Å |
| 231 | V | 96.3 | Very high | 94.8 | Very high | 9 Ų | 9 | 81.6 Ų | 81.6 | 6% | 0.055 | 42% | 0.421 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -128.3 | 129.6 | -179.6 | 179.9 | 0 | 0 | 0 | 0 | 109.4 | V159 V216 V218 K229 V233 | V159-V231 HydrophobicContact CG1-CG2 4.06Å; V159-V231 HydrophobicContact CG2-CG2 3.92Å; V216-V231 PolarHBondContact N-O 3.3Å; V216-V231 PolarHBondContact O-N 3.36Å; V218-V231 HydrophobicContact CB-CG2 4.46Å; V218-V231 HydrophobicContact CG2-CB 4.04Å; V218-V231 HydrophobicContact CG2-CG2 3.74Å; K229-V231 HydrophobicContact CG-CG2 4.34Å; V231-V233 PolarHBondContact O-N 3.23Å |
| 232 | M | 96.7 | Very high | 93.5 | Very high | 107 Ų | 107 | 75.1 Ų | 75.1 | 53% | 0.527 | 41% | 0.405 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -76.8 | 121 | 173 | -174.4 | -177 | -61.2 | 0 | 0 | 110 | N171 A213 Q214 | N171-M232 PolarHBondContact ND2-O 3.47Å; A213-M232 HydrophobicContact CB-CG 4Å; A213-M232 HydrophobicContact CB-SD 4.24Å; Q214-M232 CarbonylContact O-C 3.5Å; Q214-M232 WeakPolarHBondContact O-CA 3.36Å |
| 233 | V | 97.5 | Very high | 91.6 | Very high | 20 Ų | 20 | 85.7 Ų | 85.7 | 12% | 0.121 | 44% | 0.441 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -108 | 119.7 | 176.2 | 180 | 0 | 0 | 0 | 0 | 109.2 | V169 N171 A213 Q214 V216 V231 | V169-V233 HydrophobicContact CG1-CG2 4.07Å; N171-V233 VanDerWaalsContact OD1-CA 3.31Å; N171-V233 WeakPolarHBondContact OD1-CA 3.03Å; A213-V233 CarbonylContact C-O 3.5Å; A213-V233 VanDerWaalsContact CA-O 3.27Å; A213-V233 WeakPolarHBondContact CA-O 3.32Å; Q214-V233 HydrophobicContact CG-CB 4.19Å; Q214-V233 PolarHBondContact N-O 3.07Å; Q214-V233 PolarHBondContact O-N 2.99Å; V216-V233 HydrophobicContact CB-CG2 4.29Å; V216-V233 HydrophobicContact CG2-CB 4.04Å; V216-V233 HydrophobicContact CG2-CG2 3.6Å; V231-V233 PolarHBondContact O-N 3.23Å |
| 234 | V | 98.4 | Very high | 90.1 | Very high | 13 Ų | 13 | 89 Ų | 89 | 8% | 0.079 | 44% | 0.437 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -84.6 | 130.7 | -179.8 | 179.5 | 0 | 0 | 0 | 0 | 110 | N171 K172 P210 | N171-V234 PolarHBondContact OD1-N 3.27Å; K172-V234 HydrophobicContact CB-CB 4.16Å; K172-V234 HydrophobicContact CB-CG1 4.37Å; K172-V234 WeakPolarHBondContact CD-O 3.33Å; K172-V234 WeakPolarHBondContact CG-O 3.22Å; K172-V234 WeakPolarHBondContact O-CB 3.33Å; K172-V234 WeakPolarHBondContact O-CG2 3.36Å; P210-V234 HydrophobicContact CB-CG1 4.17Å; P210-V234 HydrophobicContact CB-CG2 4.23Å; P210-V234 HydrophobicContact CG-CG1 4.49Å; P210-V234 HydrophobicContact CG-CG2 4.03Å |
| 235 | E | 97 | Very high | 88.1 | Confident | 50 Ų | 50 | 91.1 Ų | 91.1 | 23% | 0.234 | 43% | 0.427 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -100.2 | -46.8 | 176.9 | -63.3 | -176.3 | -170.8 | 0 | 0 | 111.6 | K172 K212 | K172-E235 PolarHBondContact NZ-O 2.99Å; K212-E235 HydrophobicContact CB-CB 4.24Å; K212-E235 HydrophobicContact CD-CB 4.37Å; K212-E235 WeakPolarHBondContact CD-OE2 3.16Å; K212-E235 WeakPolarHBondContact CE-OE2 3.26Å; K212-E235 HydrophobicContact CG-CB 4.26Å; K212-E235 IonicContact NZ-OE2 2.83Å; K212-E235 PolarHBondContact NZ-OE2 3.25Å; K212-E235 PolarHBondContact O-N 3.29Å |
| 236 | E | 97.4 | Very high | 85.9 | Confident | 86 Ų | 86 | 96.5 Ų | 96.5 | 40% | 0.402 | 44% | 0.442 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -140.9 | 149.4 | -174.4 | -63.4 | 179.1 | -160.5 | 0 | 0 | 111.5 | F211 K212 | F211-E236 PolarHBondContact N-O 3.41Å; K212-E236 HydrophobicContact CB-CB 4.03Å; K212-E236 HydrophobicContact CB-CG 4.39Å; K212-E236 PolarHBondContact N-O 2.9Å; K212-E236 PolarHBondContact O-N 3.31Å |
| 237 | C | 97.4 | Very high | 83.5 | Confident | 13 Ų | 13 | 96 Ų | 96 | 9% | 0.088 | 44% | 0.443 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -124.3 | 143.6 | 177 | -57.9 | 0 | 0 | 0 | 0 | 110.5 | A152 C174 A209 | A152-C237 HydrophobicContact CB-CB 4.37Å; C174-C237 WeakPolarHBondContact CA-SG 3.26Å; C174-C237 HydrophobicContact CB-CB 3.71Å; C174-C237 WeakPolarHBondContact CB-SG 3.28Å; C174-C237 WeakPolarHBondContact SG-CB 3.48Å; C174-C237 CovalentContact SG-SG 2.04Å; C174-C237 PolarHBondContact SG-SG 3.49Å; A209-C237 VanDerWaalsContact O-CA 3.27Å; A209-C237 WeakPolarHBondContact O-CA 3.32Å |
| 238 | K | 95.8 | Very high | 81 | Confident | 94 Ų | 94 | 93 Ų | 93 | 41% | 0.409 | 45% | 0.449 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -142.4 | 161.1 | 173.4 | -66.4 | -174 | -174 | 163 | 0 | 111.4 | C150 A209 F211 E240 | C150-K238 VanDerWaalsContact SG-CA 3.53Å; C150-K238 PolarHBondContact SG-N 2.81Å; C150-K238 PolarHBondContact SG-O 3.32Å; A209-K238 PolarHBondContact N-O 2.86Å; A209-K238 PolarHBondContact O-N 2.92Å; F211-K238 HydrophobicContact CB-CB 3.96Å; F211-K238 HydrophobicContact CB-CD 4.08Å; F211-K238 HydrophobicContact CB-CG 3.76Å; F211-K238 HydrophobicContact CD1-CD 3.83Å; F211-K238 HydrophobicContact CD1-CG 4.36Å; F211-K238 HydrophobicContact CD2-CB 4.35Å; F211-K238 HydrophobicContact CD2-CD 3.71Å; F211-K238 HydrophobicContact CD2-CG 4.25Å; F211-K238 HydrophobicContact CE1-CD 4.22Å; F211-K238 HydrophobicContact CE2-CD 4.08Å; F211-K238 HydrophobicContact CG-CB 4.28Å; F211-K238 HydrophobicContact CG-CD 3.57Å; F211-K238 HydrophobicContact CG-CG 3.85Å; F211-K238 HydrophobicContact CZ-CD 4.32Å; K238-E240 PolarHBondContact O-N 3.35Å |
| 239 | C | 94.1 | Very high | 78.5 | Confident | 40 Ų | 40 | 92.5 Ų | 92.5 | 27% | 0.27 | 45% | 0.446 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -71.4 | 119.8 | 167.4 | -71 | 0 | 0 | 0 | 0 | 109.3 | C178 R207 | C178-C239 VanDerWaalsContact CA-SG 3.52Å; C178-C239 HydrophobicContact CB-CB 3.74Å; C178-C239 WeakPolarHBondContact CB-SG 3.41Å; C178-C239 WeakPolarHBondContact SG-CA 3.31Å; C178-C239 WeakPolarHBondContact SG-CB 3.48Å; C178-C239 CovalentContact SG-SG 2.04Å; C178-C239 PolarHBondContact SG-SG 3.37Å; R207-C239 WeakPolarHBondContact O-CA 3.3Å |
| 240 | E | 90.3 | Very high | 75.9 | Confident | 71 Ų | 71 | 91 Ų | 91 | 33% | 0.332 | 45% | 0.45 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -122 | 146 | 174.3 | 64.5 | 172.8 | -158.1 | 0 | 0 | 110.1 | S206 R207 A209 K238 | S206-E240 CarbonylContact C-O 3.58Å; S206-E240 WeakPolarHBondContact CA-O 3.31Å; R207-E240 HydrophobicContact CG-CG 4.04Å; R207-E240 IonicContact CZ-OE1 3.22Å; R207-E240 VanDerWaalsContact CZ-OE1 3.22Å; R207-E240 PolarHBondContact N-O 2.86Å; R207-E240 IonicContact NE-OE1 2.92Å; R207-E240 PolarHBondContact NE-OE1 2.97Å; R207-E240 IonicContact NH2-OE1 2.73Å; R207-E240 PolarHBondContact NH2-OE1 3.17Å; R207-E240 PolarHBondContact O-N 3.38Å; A209-E240 HydrophobicContact CB-CG 3.8Å; A209-E240 VanDerWaalsContact CB-OE1 3.29Å; A209-E240 WeakPolarHBondContact CB-OE1 3.22Å; K238-E240 PolarHBondContact O-N 3.35Å |
| 241 | T | 86.1 | Confident | 73.5 | Confident | 86 Ų | 86 | 85.1 Ų | 85.1 | 53% | 0.528 | 44% | 0.439 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -87.4 | 115.8 | 173.7 | -56.6 | 0 | 0 | 0 | 0 | 108.7 | P204 S206 R243 | P204-T241 HydrophobicContact CB-CG2 3.51Å; S206-T241 PolarHBondContact OG-OG1 2.8Å; T241-R243 PolarHBondContact O-N 3.49Å |
| 242 | G | 69.3 | Low | 71 | Confident | 26 Ų | 26 | 87.9 Ų | 87.9 | 27% | 0.268 | 46% | 0.464 | S | S | . | . | trans | -66.2 | 120.5 | 178.1 | 0 | 0 | 0 | 0 | 0 | 110.4 | C205 E244 | C205-G242 PolarHBondContact O-N 2.89Å; G242-E244 VanDerWaalsContact C-N 3.26Å; G242-E244 PolarHBondContact O-N 3.42Å | ||
| 243 | R | 56.8 | Low | 68.4 | Low | 246 Ų | 246 | 91 Ų | 91 | 93% | 0.928 | 47% | 0.471 | S | S | * | . | trans | -79.2 | 93.7 | 139.6 | -77 | -174.9 | 179.4 | 175.1 | -0.3 | 104.8 | T241 E245 | T241-R243 PolarHBondContact O-N 3.49Å; R243-E245 VanDerWaalsContact C-N 3.28Å; R243-E245 PolarHBondContact O-N 3.36Å | ||
| 244 | E | 59.7 | Low | 65.7 | Low | 143 Ų | 143 | 95.5 Ų | 95.5 | 67% | 0.668 | 50% | 0.498 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -60.9 | 90 | 177.4 | -170.7 | 168.1 | 164.5 | 0 | 0 | 108.6 | G242 | G242-E244 VanDerWaalsContact C-N 3.26Å; G242-E244 PolarHBondContact O-N 3.42Å |
| 245 | E | 50.8 | Low | 63.1 | Low | 161 Ų | 161 | 102.1 Ų | 102.1 | 75% | 0.752 | 53% | 0.528 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -174.1 | -38.4 | 154.8 | -119.2 | 174.2 | 154.5 | 0 | 0 | 114.2 | R243 | R243-E245 VanDerWaalsContact C-N 3.28Å; R243-E245 PolarHBondContact O-N 3.36Å |
| 246 | R | 45.9 | Very low | 60.3 | Low | 223 Ų | 223 | 109.6 Ų | 109.6 | 84% | 0.842 | 57% | 0.569 | S | S | * | * | H | α-helix | trans | -92.1 | -9.1 | -162.2 | -71.9 | -173.4 | 178.7 | 175.8 | -1.1 | 118 | A250 | R246-A250 VanDerWaalsContact O-CB 3.25Å; R246-A250 WeakPolarHBondContact O-CB 3.21Å |
| 247 | S | 44.1 | Very low | 58.5 | Low | 75 Ų | 75 | 110.8 Ų | 110.8 | 52% | 0.524 | 58% | 0.577 | S | S | . | * | H | α-helix | trans | -97.6 | -31.2 | -172.7 | 154.4 | 0 | 0 | 0 | 0 | 114.1 | A251 | S247-A251 WeakPolarHBondContact O-CB 3.47Å; S247-A251 PolarHBondContact O-N 2.85Å |
| 248 | A | 41.9 | Very low | 56.4 | Low | 81 Ų | 81 | 115.9 Ų | 115.9 | 67% | 0.669 | 60% | 0.603 | S | S | * | * | H | α-helix | trans | -77.5 | -37.2 | 179.2 | 0 | 0 | 0 | 0 | 0 | 111.5 | A252 | A248-A252 PolarHBondContact O-N 3.28Å |
| 249 | E | 42.4 | Very low | 54.2 | Low | 133 Ų | 133 | 117.2 Ų | 117.2 | 62% | 0.621 | 61% | 0.613 | S | S | * | * | H | α-helix | trans | -75.4 | -37.3 | 178.6 | -164 | 172 | -179.2 | 0 | 0 | 112.4 | A251 A252 Y253 | E249-A251 VanDerWaalsContact C-N 3.32Å; E249-A251 PolarHBondContact O-N 2.86Å; E249-A252 PolarHBondContact O-N 2.83Å; E249-Y253 PolarHBondContact O-N 3.29Å |
| 250 | A | 40.3 | Very low | 51.9 | Low | 57 Ų | 57 | 121.7 Ų | 121.7 | 47% | 0.471 | 63% | 0.634 | S | S | . | * | H | α-helix | trans | -65.9 | -33.4 | 174 | 0 | 0 | 0 | 0 | 0 | 112.7 | R246 T254 | R246-A250 VanDerWaalsContact O-CB 3.25Å; R246-A250 WeakPolarHBondContact O-CB 3.21Å; A250-T254 PolarHBondContact O-OG1 2.81Å |
| 251 | A | 45.6 | Very low | 49.5 | Very low | 53 Ų | 53 | 124.9 Ų | 124.9 | 44% | 0.438 | 65% | 0.652 | S | S | . | * | H | α-helix | trans | -71.6 | -33.2 | 173.9 | 0 | 0 | 0 | 0 | 0 | 112.3 | S247 E249 H255 | S247-A251 WeakPolarHBondContact O-CB 3.47Å; S247-A251 PolarHBondContact O-N 2.85Å; E249-A251 VanDerWaalsContact C-N 3.32Å; E249-A251 PolarHBondContact O-N 2.86Å; A251-H255 PolarHBondContact O-CD2 2.8Å |
| 252 | A | 42.6 | Very low | 47 | Very low | 68 Ų | 68 | 127.5 Ų | 127.5 | 56% | 0.562 | 66% | 0.661 | S | S | * | * | H | α-helix | trans | -72.5 | -33.7 | 175.5 | 0 | 0 | 0 | 0 | 0 | 112.7 | A248 E249 T254 | A248-A252 PolarHBondContact O-N 3.28Å; E249-A252 PolarHBondContact O-N 2.83Å; A252-T254 VanDerWaalsContact C-N 3.35Å; A252-T254 PolarHBondContact O-N 2.98Å |
| 253 | Y | 42.1 | Very low | 45.4 | Very low | 172 Ų | 172 | 134.7 Ų | 134.7 | 68% | 0.675 | 69% | 0.689 | S | S | * | * | H | α-helix | trans | -80.5 | -10.6 | -177.6 | -129.7 | -88.6 | 0 | 0 | 0 | 114.7 | E249 H255 | E249-Y253 PolarHBondContact O-N 3.29Å; Y253-H255 PolarHBondContact O-N 3.45Å |
| 254 | T | 42 | Very low | 44.6 | Very low | 114 Ų | 114 | 126.2 Ų | 126.2 | 70% | 0.699 | 67% | 0.67 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -85.3 | 5.6 | 175.6 | -27.1 | 0 | 0 | 0 | 0 | 112.8 | A250 A252 | A250-T254 PolarHBondContact O-OG1 2.81Å; A252-T254 VanDerWaalsContact C-N 3.35Å; A252-T254 PolarHBondContact O-N 2.98Å |
| 255 | H | 44.5 | Very low | 43.3 | Very low | 153 Ų | 153 | 124.8 Ų | 124.8 | 71% | 0.708 | 67% | 0.671 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -120.7 | 17.6 | -177.1 | -77.1 | -70.7 | 0 | 0 | 0 | 114 | A251 Y253 | A251-H255 PolarHBondContact O-CD2 2.8Å; Y253-H255 PolarHBondContact O-N 3.45Å |
| 256 | L | 37.6 | Very low | 42.6 | Very low | 207 Ų | 207 | 121.5 Ų | 121.5 | 100% | 1.084 | 66% | 0.663 | S | S | * | * | trans | -101.5 | 0 | 162.8 | -74.9 | 172.8 | 0 | 0 | 0 | 110.5 |
Retrieved 256 of 256 residues in 385.8 ms
(Link to these results)