| Site | Residue | pLDDT | pLDDT confidence | pLDDT10 | pLDDT10 confidence | SASA | SASA [Ų] | SASA10 | SASA10 [Ų] | RSA | RSA unformatted | RSA10 | RSA10 unformatted | Surface | Surface10 (not used) | Disorder (not used) | Disorder | Sec. str. | Secondary structure | Isomer | Phi (φ) | Psi (ψ) | Omega (ω) | Chi 1 (χ1) | Chi 2 (χ2) | Chi 3 (χ3) | Chi 4 (χ4) | Chi 5 (χ5) | Tau (τ) | Contacts (colored by PAE) | Contact details |
|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|
| 1 | M | 43.8 | Very low | 50.9 | Low | 244 Ų | 244 | 153.9 Ų | 153.9 | 100% | 1.202 | 83% | 0.832 | S | S | * | * | 0 | 115 | 0 | -67.1 | 159.5 | 90.1 | 0 | 0 | 106.9 | |||||
| 2 | V | 42.4 | Very low | 51 | Low | 136 Ų | 136 | 149.3 Ų | 149.3 | 82% | 0.824 | 82% | 0.816 | S | S | * | * | trans | -122.7 | 109 | -179.3 | -174.7 | 0 | 0 | 0 | 0 | 107 | V4 | V2-V4 PolarHBondContact O-N 3.42Š| ||
| 3 | L | 49.1 | Very low | 51.5 | Low | 157 Ų | 157 | 148.9 Ų | 148.9 | 82% | 0.822 | 82% | 0.821 | S | S | * | * | trans | -84.5 | 107.9 | 177.2 | -98.9 | 158.3 | 0 | 0 | 0 | 108.7 | ||||
| 4 | V | 52 | Low | 51.3 | Low | 117 Ų | 117 | 151.7 Ų | 151.7 | 71% | 0.709 | 82% | 0.821 | S | S | * | * | trans | -89.9 | 106.9 | 174 | -166.4 | 0 | 0 | 0 | 0 | 107.7 | V2 V6 | V2-V4 PolarHBondContact O-N 3.42Å; V4-V6 PolarHBondContact O-N 3.36Å | ||
| 5 | H | 59.8 | Low | 50.5 | Low | 174 Ų | 174 | 146.3 Ų | 146.3 | 81% | 0.806 | 81% | 0.814 | S | S | * | * | trans | -72.9 | 108.9 | 177.5 | -89.3 | -108.2 | 0 | 0 | 0 | 110.6 | ||||
| 6 | V | 51.6 | Low | 50.1 | Low | 141 Ų | 141 | 144.1 Ų | 144.1 | 86% | 0.855 | 81% | 0.812 | S | S | * | * | trans | -93.4 | 130.1 | 165.8 | 179 | 0 | 0 | 0 | 0 | 108.2 | V4 | V4-V6 PolarHBondContact O-N 3.36Š| ||
| 7 | G | 54.1 | Low | 49.9 | Very low | 68 Ų | 68 | 143.8 Ų | 143.8 | 70% | 0.701 | 81% | 0.814 | S | S | * | * | trans | 115.8 | 90.4 | 170 | 0 | 0 | 0 | 0 | 0 | 114.7 | ||||
| 8 | Y | 56.6 | Low | 49.8 | Very low | 231 Ų | 231 | 148.6 Ų | 148.6 | 91% | 0.906 | 82% | 0.817 | S | S | * | * | trans | -92.9 | 89.3 | 155.3 | -96.6 | -91.3 | 0 | 0 | 0 | 108.9 | V10 | Y8-V10 HydrophobicContact CD1-CG2 4.19Š| ||
| 9 | L | 51.9 | Low | 49.8 | Very low | 162 Ų | 162 | 149.2 Ų | 149.2 | 85% | 0.848 | 82% | 0.819 | S | S | * | * | trans | -83.3 | 103.9 | 156.9 | -88.5 | 168.2 | 0 | 0 | 0 | 107.5 | L11 | L9-L11 PolarHBondContact O-N 3.35Š| ||
| 10 | V | 52.3 | Low | 49.8 | Very low | 123 Ų | 123 | 153.6 Ų | 153.6 | 75% | 0.745 | 82% | 0.823 | S | S | * | * | trans | -89.5 | 98.5 | 171.2 | 179.6 | 0 | 0 | 0 | 0 | 108 | Y8 | Y8-V10 HydrophobicContact CD1-CG2 4.19Š| ||
| 11 | L | 46.1 | Very low | 49.1 | Very low | 140 Ų | 140 | 150.1 Ų | 150.1 | 73% | 0.733 | 82% | 0.823 | S | S | * | * | trans | -82.8 | 136.2 | 168.2 | -67.8 | 172.1 | 0 | 0 | 0 | 109.6 | L9 V13 | L9-L11 PolarHBondContact O-N 3.35Å; L11-V13 PolarHBondContact O-N 3.21Å | ||
| 12 | P | 52.4 | Low | 49.1 | Very low | 99 Ų | 99 | 143 Ų | 143 | 64% | 0.643 | 80% | 0.803 | S | S | * | * | trans | -70.4 | 126.2 | 175.6 | 28.3 | -32.9 | 0 | 0 | 0 | 110.9 | F14 | P12-F14 HydrophobicContact CG-CE2 4.48Å; P12-F14 PolarHBondContact O-N 3.49Å | ||
| 13 | V | 57.4 | Low | 49.2 | Very low | 144 Ų | 144 | 142.4 Ų | 142.4 | 87% | 0.873 | 80% | 0.802 | S | S | * | * | trans | -77.2 | 109 | 175.5 | 175.7 | 0 | 0 | 0 | 0 | 109.6 | L11 G15 | L11-V13 PolarHBondContact O-N 3.21Å; V13-G15 PolarHBondContact O-N 3.2Å; V13-G15 VanDerWaalsContact O-N 3.1Å | ||
| 14 | F | 48 | Very low | 48.9 | Very low | 188 Ų | 188 | 145 Ų | 145 | 83% | 0.825 | 81% | 0.807 | S | S | * | * | trans | -71.5 | 100.4 | 172.3 | -74.8 | -85 | 0 | 0 | 0 | 111.2 | P12 S16 | P12-F14 HydrophobicContact CG-CE2 4.48Å; P12-F14 PolarHBondContact O-N 3.49Å; F14-S16 PolarHBondContact O-N 2.84Å; F14-S16 VanDerWaalsContact O-N 3.12Å | ||
| 15 | G | 39.4 | Very low | 48.3 | Very low | 70 Ų | 70 | 148.9 Ų | 148.9 | 72% | 0.722 | 82% | 0.817 | S | S | * | * | trans | -70.4 | 99.2 | 172.5 | 0 | 0 | 0 | 0 | 0 | 112.3 | V13 V17 | V13-G15 PolarHBondContact O-N 3.2Å; V13-G15 VanDerWaalsContact O-N 3.1Å; G15-V17 PolarHBondContact O-N 3.29Å | ||
| 16 | S | 44.8 | Very low | 47.3 | Very low | 112 Ų | 112 | 152.2 Ų | 152.2 | 78% | 0.783 | 82% | 0.823 | S | S | * | * | trans | -79.4 | 102.1 | 177.5 | -168.8 | 0 | 0 | 0 | 0 | 111.9 | F14 | F14-S16 PolarHBondContact O-N 2.84Å; F14-S16 VanDerWaalsContact O-N 3.12Å | ||
| 17 | V | 46.3 | Very low | 46.9 | Very low | 139 Ų | 139 | 150.5 Ų | 150.5 | 84% | 0.842 | 82% | 0.817 | S | S | * | * | trans | -90.5 | 104.3 | 170.2 | 174.5 | 0 | 0 | 0 | 0 | 109.9 | G15 N19 | G15-V17 PolarHBondContact O-N 3.29Å; V17-N19 PolarHBondContact O-N 2.92Å | ||
| 18 | R | 48.2 | Very low | 46.3 | Very low | 229 Ų | 229 | 155.8 Ų | 155.8 | 86% | 0.864 | 82% | 0.824 | S | S | * | * | trans | -77 | 110.4 | 175 | -62.7 | 164.7 | 94.3 | -178.8 | 9.4 | 109.5 | ||||
| 19 | N | 50.1 | Low | 45.5 | Very low | 161 Ų | 161 | 152.4 Ų | 152.4 | 86% | 0.861 | 82% | 0.816 | S | S | * | * | trans | -83 | 131.5 | 169.2 | -159.2 | -10.9 | 0 | 0 | 0 | 110.3 | V17 | V17-N19 PolarHBondContact O-N 2.92Š| ||
| 20 | R | 49 | Very low | 45.1 | Very low | 237 Ų | 237 | 150 Ų | 150 | 89% | 0.894 | 81% | 0.81 | S | S | * | * | trans | -98.4 | 109.4 | -174.3 | -98 | -177 | 168.2 | -179.8 | -3.4 | 111.3 | ||||
| 21 | G | 36.4 | Very low | 44.8 | Very low | 80 Ų | 80 | 152 Ų | 152 | 83% | 0.825 | 81% | 0.811 | S | S | * | * | trans | 56.5 | 112.7 | 133.5 | 0 | 0 | 0 | 0 | 0 | 120.6 | ||||
| 22 | A | 44.3 | Very low | 44.4 | Very low | 95 Ų | 95 | 150.2 Ų | 150.2 | 79% | 0.785 | 82% | 0.816 | S | S | * | * | trans | -152.3 | 114.8 | 141.2 | 0 | 0 | 0 | 0 | 0 | 109.4 | ||||
| 23 | P | 44.4 | Very low | 43.9 | Very low | 123 Ų | 123 | 152 Ų | 152 | 80% | 0.799 | 83% | 0.825 | S | S | * | * | trans | -96.6 | 133.7 | 173.2 | 34.4 | -28.5 | 0 | 0 | 0 | 111.1 | ||||
| 24 | F | 41.3 | Very low | 43 | Very low | 212 Ų | 212 | 150.1 Ų | 150.1 | 93% | 0.93 | 82% | 0.819 | S | S | * | * | trans | -122.1 | 115.5 | 161.1 | -100.6 | -83.8 | 0 | 0 | 0 | 109.4 | ||||
| 25 | Q | 40.3 | Very low | 42.7 | Very low | 198 Ų | 198 | 146.4 Ų | 146.4 | 93% | 0.925 | 82% | 0.815 | S | S | * | * | trans | -71.9 | 137.3 | 168.9 | -68.2 | 176.4 | -79.8 | 0 | 0 | 109.9 | ||||
| 26 | R | 38.2 | Very low | 43 | Very low | 244 Ų | 244 | 153 Ų | 153 | 92% | 0.921 | 82% | 0.818 | S | S | * | * | trans | -144.7 | 145.1 | 136.6 | -155.4 | 159 | -176.2 | 159.7 | 0.1 | 111.5 | ||||
| 27 | S | 44.5 | Very low | 43 | Very low | 105 Ų | 105 | 154.4 Ų | 154.4 | 73% | 0.734 | 81% | 0.812 | S | S | * | * | trans | -63.9 | 145.7 | -167.4 | 48.4 | 0 | 0 | 0 | 0 | 115.3 | ||||
| 28 | Q | 40.3 | Very low | 42.7 | Very low | 180 Ų | 180 | 158.2 Ų | 158.2 | 84% | 0.841 | 82% | 0.817 | S | S | * | * | trans | -63.3 | 148.1 | 162.7 | -60.2 | 165.6 | -9.1 | 0 | 0 | 111.2 | ||||
| 29 | H | 40.5 | Very low | 42.4 | Very low | 160 Ų | 160 | 155 Ų | 155 | 74% | 0.741 | 81% | 0.812 | S | S | * | * | trans | -163.8 | 125 | 142.5 | -111.9 | -74.7 | 0 | 0 | 0 | 109.8 | ||||
| 30 | P | 43.1 | Very low | 42.3 | Very low | 112 Ų | 112 | 155.9 Ų | 155.9 | 73% | 0.727 | 82% | 0.816 | S | S | * | * | trans | -97.3 | 137.1 | 178.8 | 35.2 | -30.9 | 0 | 0 | 0 | 112.1 | ||||
| 31 | H | 45.3 | Very low | 41.7 | Very low | 165 Ų | 165 | 147.7 Ų | 147.7 | 76% | 0.764 | 81% | 0.805 | S | S | * | * | trans | -139.9 | 136.9 | 171.7 | -56.5 | -70.7 | 0 | 0 | 0 | 110 | ||||
| 32 | A | 38 | Very low | 42.1 | Very low | 102 Ų | 102 | 150 Ų | 150 | 84% | 0.843 | 81% | 0.805 | S | S | * | * | trans | -114.2 | 126.5 | -174 | 0 | 0 | 0 | 0 | 0 | 112.2 | ||||
| 33 | T | 41.7 | Very low | 42.5 | Very low | 136 Ų | 136 | 151.5 Ų | 151.5 | 83% | 0.834 | 81% | 0.807 | S | S | * | * | trans | -157.5 | 109.1 | 163.8 | -37.5 | 0 | 0 | 0 | 0 | 105.7 | ||||
| 34 | S | 39.9 | Very low | 42.5 | Very low | 105 Ų | 105 | 154.1 Ų | 154.1 | 73% | 0.734 | 81% | 0.808 | S | S | * | * | 65.1 | 137.2 | 73.5 | -162.1 | 0 | 0 | 0 | 0 | 115.2 | |||||
| 35 | C | 40.4 | Very low | 42.4 | Very low | 109 Ų | 109 | 150 Ų | 150 | 74% | 0.736 | 80% | 0.803 | S | S | * | * | trans | 74.4 | 147 | 176.2 | -65.2 | 0 | 0 | 0 | 0 | 119 | ||||
| 36 | R | 45.4 | Very low | 42.7 | Very low | 209 Ų | 209 | 149.9 Ų | 149.9 | 79% | 0.789 | 80% | 0.802 | S | S | * | * | cis | -166.1 | 148.6 | -29.6 | -115.6 | -171 | -179.7 | -168.7 | -1.5 | 108.1 | ||||
| 37 | H | 44.9 | Very low | 42.6 | Very low | 142 Ų | 142 | 146.8 Ų | 146.8 | 66% | 0.657 | 80% | 0.798 | S | S | * | * | trans | 30.9 | 121.2 | 154 | -65.2 | 75.8 | 0 | 0 | 0 | 120.9 | ||||
| 38 | F | 41.3 | Very low | 42.3 | Very low | 218 Ų | 218 | 150.4 Ų | 150.4 | 96% | 0.956 | 81% | 0.809 | S | S | * | * | trans | -128.6 | 131.2 | 137.3 | -90.1 | -83.1 | 0 | 0 | 0 | 110.5 | ||||
| 39 | H | 41.9 | Very low | 42.4 | Very low | 161 Ų | 161 | 145.8 Ų | 145.8 | 75% | 0.745 | 80% | 0.801 | S | S | * | * | trans | -101.2 | 131 | -176.8 | -122.6 | -89.9 | 0 | 0 | 0 | 108.9 | ||||
| 40 | L | 47 | Very low | 42.7 | Very low | 181 Ų | 181 | 143.6 Ų | 143.6 | 95% | 0.948 | 80% | 0.802 | S | S | * | * | trans | -140.6 | 117.1 | 155.4 | -75.1 | 179.5 | 0 | 0 | 0 | 107.9 | ||||
| 41 | G | 36.8 | Very low | 42.8 | Very low | 65 Ų | 65 | 145.6 Ų | 145.6 | 67% | 0.67 | 81% | 0.806 | S | S | * | * | trans | -106.9 | 169.1 | -177.6 | 0 | 0 | 0 | 0 | 0 | 113.3 | ||||
| 42 | P | 44 | Very low | 42.4 | Very low | 127 Ų | 127 | 146.8 Ų | 146.8 | 83% | 0.825 | 81% | 0.809 | S | S | * | * | trans | -96 | 164.4 | -174.2 | 38.3 | -35.7 | 0 | 0 | 0 | 113.7 | ||||
| 43 | P | 54 | Low | 42.9 | Very low | 127 Ų | 127 | 146.5 Ų | 146.5 | 83% | 0.825 | 80% | 0.799 | S | S | * | * | trans | -94.2 | 130.1 | 168.1 | 34.1 | -29.3 | 0 | 0 | 0 | 113.9 | ||||
| 44 | Q | 43 | Very low | 43 | Very low | 178 Ų | 178 | 147.7 Ų | 147.7 | 83% | 0.832 | 80% | 0.799 | S | S | * | * | trans | -2.3 | 145.8 | 159.3 | -64.2 | 180 | -18.9 | 0 | 0 | 122.9 | ||||
| 45 | P | 40.6 | Very low | 43.1 | Very low | 126 Ų | 126 | 146.9 Ų | 146.9 | 82% | 0.818 | 80% | 0.799 | S | S | * | * | P | Polyproline II helix | trans | -89.1 | 155.6 | 148.6 | 37 | -30.7 | 0 | 0 | 0 | 112.4 | ||
| 46 | Q | 45.4 | Very low | 43.3 | Very low | 195 Ų | 195 | 150.4 Ų | 150.4 | 91% | 0.911 | 80% | 0.804 | S | S | * | * | P | Polyproline II helix | trans | -99.8 | 138.7 | 176.3 | -70.6 | 179.4 | -57.1 | 0 | 0 | 112.7 | ||
| 47 | Q | 36 | Very low | 43.6 | Very low | 179 Ų | 179 | 146.9 Ų | 146.9 | 84% | 0.836 | 81% | 0.808 | S | S | * | * | P | Polyproline II helix | trans | -96.9 | 147.3 | 176.4 | -64.6 | 171.3 | -105.1 | 0 | 0 | 111.7 | ||
| 48 | L | 39 | Very low | 43.2 | Very low | 181 Ų | 181 | 146.4 Ų | 146.4 | 95% | 0.948 | 82% | 0.815 | S | S | * | * | trans | -139 | 142.7 | 141.6 | -76.7 | -179.5 | 0 | 0 | 0 | 109.5 | ||||
| 49 | A | 41.4 | Very low | 43.3 | Very low | 83 Ų | 83 | 144.8 Ų | 144.8 | 69% | 0.686 | 81% | 0.81 | S | S | * | * | trans | -148.8 | -165.8 | 179 | 0 | 0 | 0 | 0 | 0 | 106.3 | ||||
| 50 | P | 48.2 | Very low | 43.3 | Very low | 115 Ų | 115 | 141.3 Ų | 141.3 | 75% | 0.747 | 80% | 0.804 | S | S | * | * | cis | -127.9 | -178 | -20.1 | 36 | -18 | 0 | 0 | 0 | 112.4 | ||||
| 51 | D | 45.3 | Very low | 43 | Very low | 153 Ų | 153 | 141 Ų | 141 | 82% | 0.818 | 80% | 0.798 | S | S | * | * | -169.7 | 162.4 | 121.8 | -123 | -52.8 | 0 | 0 | 0 | 113.2 | |||||
| 52 | F | 37.2 | Very low | 43.7 | Very low | 191 Ų | 191 | 143.4 Ų | 143.4 | 84% | 0.838 | 80% | 0.802 | S | S | * | * | trans | -133 | -162 | -175.1 | -119.6 | -108 | 0 | 0 | 0 | 108 | ||||
| 53 | P | 46.6 | Very low | 43.7 | Very low | 96 Ų | 96 | 140.6 Ų | 140.6 | 62% | 0.623 | 80% | 0.796 | S | S | * | * | cis | -137.5 | -179.9 | -11.4 | 38.2 | -18.5 | 0 | 0 | 0 | 117.2 | ||||
| 54 | L | 43.8 | Very low | 43.5 | Very low | 161 Ų | 161 | 142.5 Ų | 142.5 | 84% | 0.843 | 80% | 0.798 | S | S | * | * | trans | 64.2 | 154.5 | 147.3 | -103.8 | 61.4 | 0 | 0 | 0 | 120.1 | ||||
| 55 | A | 43.9 | Very low | 43.4 | Very low | 87 Ų | 87 | 139.5 Ų | 139.5 | 72% | 0.719 | 80% | 0.797 | S | S | * | * | cis | -155.2 | 172.4 | 3.3 | 0 | 0 | 0 | 0 | 0 | 112.8 | ||||
| 56 | H | 42.8 | Very low | 43.5 | Very low | 184 Ų | 184 | 136.8 Ų | 136.8 | 85% | 0.852 | 79% | 0.785 | S | S | * | * | trans | -85.6 | 174.3 | 172.8 | -58.9 | -83.3 | 0 | 0 | 0 | 113.4 | ||||
| 57 | P | 51.8 | Low | 43.4 | Very low | 134 Ų | 134 | 135.5 Ų | 135.5 | 87% | 0.87 | 78% | 0.779 | S | S | * | * | -152 | -168.9 | 92.9 | 39.8 | -19.6 | 0 | 0 | 0 | 117.2 | |||||
| 58 | V | 38.3 | Very low | 43.9 | Very low | 133 Ų | 133 | 134.9 Ų | 134.9 | 81% | 0.806 | 78% | 0.778 | S | S | * | * | trans | -125.7 | 149.2 | -167.9 | 156.7 | 0 | 0 | 0 | 0 | 112.3 | ||||
| 59 | Q | 41.6 | Very low | 43.9 | Very low | 184 Ų | 184 | 130.3 Ų | 130.3 | 86% | 0.86 | 77% | 0.766 | S | S | * | * | trans | 179.1 | 160.7 | 152.6 | -102.2 | 167.5 | -34.7 | 0 | 0 | 111 | ||||
| 60 | S | 43.1 | Very low | 44 | Very low | 88 Ų | 88 | 132 Ų | 132 | 62% | 0.615 | 77% | 0.77 | S | S | * | * | cis | -177.9 | 135.7 | -33 | 53.1 | 0 | 0 | 0 | 0 | 114.9 | ||||
| 61 | Q | 40.7 | Very low | 43.4 | Very low | 174 Ų | 174 | 130.6 Ų | 130.6 | 81% | 0.813 | 77% | 0.768 | S | S | * | * | trans | 71 | 170 | 140.8 | -66.2 | -65 | -6.4 | 0 | 0 | 121.4 | ||||
| 62 | P | 51.4 | Low | 43.3 | Very low | 115 Ų | 115 | 132.5 Ų | 132.5 | 75% | 0.747 | 77% | 0.772 | S | S | * | * | cis | -139.2 | 169.2 | -26.9 | 30.8 | -10.7 | 0 | 0 | 0 | 117.9 | ||||
| 63 | G | 44.5 | Very low | 43.4 | Very low | 68 Ų | 68 | 131.8 Ų | 131.8 | 70% | 0.701 | 77% | 0.771 | S | S | * | * | trans | 106.5 | 143.9 | 141.2 | 0 | 0 | 0 | 0 | 0 | 119.2 | ||||
| 64 | L | 48.2 | Very low | 43.3 | Very low | 167 Ų | 167 | 136.3 Ų | 136.3 | 87% | 0.874 | 78% | 0.783 | S | S | * | * | cis | -153.7 | 144 | -6.9 | -79.5 | 173.3 | 0 | 0 | 0 | 110.7 | ||||
| 65 | S | 41.3 | Very low | 42.9 | Very low | 115 Ų | 115 | 134.7 Ų | 134.7 | 80% | 0.804 | 79% | 0.786 | S | S | * | * | trans | 36.4 | 147.2 | 138.7 | -54.7 | 0 | 0 | 0 | 0 | 123.4 | ||||
| 66 | A | 43.2 | Very low | 42.6 | Very low | 70 Ų | 70 | 134.1 Ų | 134.1 | 58% | 0.579 | 79% | 0.788 | S | S | * | * | cis | -175.2 | 167.4 | -8.3 | 0 | 0 | 0 | 0 | 0 | 112.5 | ||||
| 67 | H | 44.1 | Very low | 42.2 | Very low | 167 Ų | 167 | 130.3 Ų | 130.3 | 77% | 0.773 | 79% | 0.788 | S | S | * | * | trans | 67.2 | 142.7 | 149.5 | -67.3 | -39.1 | 0 | 0 | 0 | 120.3 | ||||
| 68 | M | 45.1 | Very low | 41.6 | Very low | 166 Ų | 166 | 131.6 Ų | 131.6 | 82% | 0.818 | 79% | 0.787 | S | S | * | * | cis | -150.4 | 163.1 | -4.3 | -81.4 | -131.4 | 172.8 | 0 | 0 | 111.6 | ||||
| 69 | A | 38.9 | Very low | 41.5 | Very low | 85 Ų | 85 | 133.8 Ų | 133.8 | 70% | 0.702 | 79% | 0.788 | S | S | * | * | trans | -119.5 | -176.9 | 158.4 | 0 | 0 | 0 | 0 | 0 | 107.3 | ||||
| 70 | P | 44.7 | Very low | 41.4 | Very low | 119 Ų | 119 | 133.9 Ų | 133.9 | 77% | 0.773 | 79% | 0.789 | S | S | * | * | cis | -145.8 | 179.6 | 16.2 | 43.5 | -22.6 | 0 | 0 | 0 | 118.2 | ||||
| 71 | A | 35.2 | Very low | 41 | Very low | 85 Ų | 85 | 133.8 Ų | 133.8 | 70% | 0.702 | 79% | 0.788 | S | S | * | * | trans | 32.9 | 129.9 | 145.8 | 0 | 0 | 0 | 0 | 0 | 122.4 | ||||
| 72 | H | 43.4 | Very low | 40.6 | Very low | 193 Ų | 193 | 132.3 Ų | 132.3 | 89% | 0.894 | 79% | 0.785 | S | S | * | * | -153.3 | 140.4 | 127.2 | -108.7 | -78.1 | 0 | 0 | 0 | 111.6 | |||||
| 73 | Q | 39.4 | Very low | 40 | Very low | 177 Ų | 177 | 133.6 Ų | 133.6 | 83% | 0.827 | 79% | 0.791 | S | S | * | * | trans | -84.9 | 148 | 173.5 | -61.3 | 165.1 | -12.5 | 0 | 0 | 109.9 | ||||
| 74 | H | 43.1 | Very low | 39.7 | Very low | 190 Ų | 190 | 135.7 Ų | 135.7 | 88% | 0.88 | 79% | 0.792 | S | S | * | * | trans | -160.9 | 128.2 | 143.4 | -100.9 | -65.5 | 0 | 0 | 0 | 111.5 | ||||
| 75 | S | 37.3 | Very low | 39.3 | Very low | 128 Ų | 128 | 135.4 Ų | 135.4 | 90% | 0.895 | 79% | 0.791 | S | S | * | * | trans | -81.3 | 141.2 | 171.5 | -52.5 | 0 | 0 | 0 | 0 | 110.8 | ||||
| 76 | G | 36.4 | Very low | 39.3 | Very low | 75 Ų | 75 | 135.6 Ų | 135.6 | 77% | 0.773 | 79% | 0.789 | S | S | * | * | trans | -164.8 | 109.4 | 173.3 | 0 | 0 | 0 | 0 | 0 | 110.8 | ||||
| 77 | A | 34.9 | Very low | 39.1 | Very low | 103 Ų | 103 | 138.5 Ų | 138.5 | 85% | 0.851 | 80% | 0.8 | S | S | * | * | trans | -79.3 | 127.1 | -178.9 | 0 | 0 | 0 | 0 | 0 | 111 | ||||
| 78 | L | 39.5 | Very low | 38.9 | Very low | 162 Ų | 162 | 138.5 Ų | 138.5 | 85% | 0.848 | 81% | 0.805 | S | S | * | * | trans | -134.7 | 110.3 | 161.7 | -75 | 179.5 | 0 | 0 | 0 | 110.4 | Q80 | L78-Q80 PolarHBondContact O-N 3.39Š| ||
| 79 | H | 35.1 | Very low | 38.6 | Very low | 178 Ų | 178 | 138.9 Ų | 138.9 | 82% | 0.824 | 81% | 0.805 | S | S | * | * | trans | -67.1 | 116.5 | 171.9 | 171.5 | -95.1 | 0 | 0 | 0 | 109.7 | ||||
| 80 | Q | 40.7 | Very low | 38.5 | Very low | 187 Ų | 187 | 144.2 Ų | 144.2 | 87% | 0.874 | 81% | 0.812 | S | S | * | * | trans | -123.8 | 144.2 | 168 | -71.8 | -161.5 | 92.8 | 0 | 0 | 110.6 | L78 | L78-Q80 PolarHBondContact O-N 3.39Š| ||
| 81 | S | 34.5 | Very low | 38.4 | Very low | 86 Ų | 86 | 146.1 Ų | 146.1 | 60% | 0.601 | 81% | 0.811 | S | S | * | * | trans | -114.2 | 157.4 | -155.6 | -161.8 | 0 | 0 | 0 | 0 | 111.9 | ||||
| 82 | L | 32.1 | Very low | 38.6 | Very low | 143 Ų | 143 | 149.3 Ų | 149.3 | 75% | 0.749 | 82% | 0.816 | S | S | * | * | trans | 65.8 | 112.6 | 158.5 | -66.6 | 153.2 | 0 | 0 | 0 | 119.2 | ||||
| 83 | T | 39.2 | Very low | 38.7 | Very low | 142 Ų | 142 | 145.9 Ų | 145.9 | 87% | 0.871 | 81% | 0.809 | S | S | * | * | -159.5 | 116.6 | 118.8 | 6.9 | 0 | 0 | 0 | 0 | 110 | |||||
| 84 | P | 38.4 | Very low | 39.3 | Very low | 112 Ų | 112 | 144 Ų | 144 | 73% | 0.727 | 81% | 0.809 | S | S | * | * | P | Polyproline II helix | trans | -79.9 | 142 | 174.4 | -9.6 | 26.6 | 0 | 0 | 0 | 111.9 | ||
| 85 | L | 39.1 | Very low | 39.7 | Very low | 160 Ų | 160 | 137.5 Ų | 137.5 | 84% | 0.838 | 79% | 0.794 | S | S | * | * | P | Polyproline II helix | trans | -60.8 | 145.1 | 168.4 | -118.4 | 66.8 | 0 | 0 | 0 | 110.7 | T87 | L85-T87 PolarHBondContact O-N 3.31Š|
| 86 | P | 41.9 | Very low | 40.3 | Very low | 120 Ų | 120 | 135.7 Ų | 135.7 | 78% | 0.779 | 78% | 0.779 | S | S | * | * | P | Polyproline II helix | trans | -68.7 | 126.1 | -177.9 | 27.2 | -34.1 | 0 | 0 | 0 | 112 | L88 | P86-L88 PolarHBondContact O-N 2.86Š|
| 87 | T | 38.6 | Very low | 41.2 | Very low | 130 Ų | 130 | 137 Ų | 137 | 80% | 0.798 | 78% | 0.776 | S | S | * | * | P | Polyproline II helix | trans | -64.7 | 119.8 | 170.6 | -45.2 | 0 | 0 | 0 | 0 | 109.9 | L85 Q89 | L85-T87 PolarHBondContact O-N 3.31Å; T87-Q89 PolarHBondContact O-N 3.12Å |
| 88 | L | 39.5 | Very low | 42.2 | Very low | 168 Ų | 168 | 139.5 Ų | 139.5 | 88% | 0.88 | 77% | 0.768 | S | S | * | * | P | Polyproline II helix | trans | -66.1 | 117.5 | 169.3 | -71.9 | 179.6 | 0 | 0 | 0 | 109.4 | P86 F90 | P86-L88 PolarHBondContact O-N 2.86Å; L88-F90 PolarHBondContact O-N 3.38Å |
| 89 | Q | 39.4 | Very low | 42.8 | Very low | 174 Ų | 174 | 137.6 Ų | 137.6 | 81% | 0.813 | 76% | 0.758 | S | S | * | * | P | Polyproline II helix | trans | -72.4 | 127.4 | 171.8 | -70 | -162.9 | -44.6 | 0 | 0 | 110 | T87 Q91 | T87-Q89 PolarHBondContact O-N 3.12Å; Q89-Q91 PolarHBondContact O-N 3.02Å |
| 90 | F | 36.3 | Very low | 44.1 | Very low | 197 Ų | 197 | 133.5 Ų | 133.5 | 86% | 0.864 | 75% | 0.748 | S | S | * | * | trans | -72.6 | 105.6 | 171.1 | -149.8 | -94.9 | 0 | 0 | 0 | 107.8 | L88 | L88-F90 PolarHBondContact O-N 3.38Š| ||
| 91 | Q | 42.5 | Very low | 45.6 | Very low | 159 Ų | 159 | 131.3 Ų | 131.3 | 74% | 0.743 | 74% | 0.737 | S | S | * | * | trans | -83.7 | 119.3 | 171.7 | -78.6 | -179.5 | -4.6 | 0 | 0 | 109.1 | Q89 V93 | Q89-Q91 PolarHBondContact O-N 3.02Å; Q91-V93 VanDerWaalsContact C-N 3.26Å; Q91-V93 PolarHBondContact O-N 2.97Å | ||
| 92 | D | 39.7 | Very low | 47.2 | Very low | 152 Ų | 152 | 130.1 Ų | 130.1 | 81% | 0.813 | 73% | 0.732 | S | S | * | * | trans | -62.9 | 86.4 | 167.7 | -85.7 | -67.1 | 0 | 0 | 0 | 110.3 | T94 | D92-T94 PolarHBondContact O-N 2.92Š| ||
| 93 | V | 45.7 | Very low | 49.2 | Very low | 121 Ų | 121 | 129 Ų | 129 | 73% | 0.733 | 73% | 0.726 | S | S | * | * | trans | -76 | 109.2 | 167.4 | 173.9 | 0 | 0 | 0 | 0 | 107.9 | Q91 G95 | Q91-V93 VanDerWaalsContact C-N 3.26Å; Q91-V93 PolarHBondContact O-N 2.97Å; V93-G95 PolarHBondContact O-N 3.5Å | ||
| 94 | T | 52.4 | Low | 51.2 | Low | 136 Ų | 136 | 127.6 Ų | 127.6 | 83% | 0.834 | 71% | 0.71 | S | S | * | * | trans | -53.8 | 102.3 | 169.3 | 47.5 | 0 | 0 | 0 | 0 | 110.2 | D92 | D92-T94 PolarHBondContact O-N 2.92Š| ||
| 95 | G | 51.3 | Low | 53.4 | Low | 55 Ų | 55 | 129.2 Ų | 129.2 | 57% | 0.567 | 71% | 0.708 | S | S | * | * | trans | -63.4 | 148.2 | -176.9 | 0 | 0 | 0 | 0 | 0 | 112.7 | V93 S97 | V93-G95 PolarHBondContact O-N 3.5Å; G95-S97 PolarHBondContact O-N 3.21Å | ||
| 96 | P | 48.8 | Very low | 55.5 | Low | 89 Ų | 89 | 127.9 Ų | 127.9 | 58% | 0.578 | 70% | 0.697 | S | S | * | * | trans | -65.4 | 130.9 | -176.2 | 26.6 | -34.1 | 0 | 0 | 0 | 111.4 | F98 L99 | P96-F98 PolarHBondContact O-N 3.33Å; P96-L99 PolarHBondContact O-N 3.2Å | ||
| 97 | S | 56.4 | Low | 57.5 | Low | 102 Ų | 102 | 128.5 Ų | 128.5 | 71% | 0.713 | 69% | 0.685 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -62.3 | 3.4 | -179.2 | 44.7 | 0 | 0 | 0 | 0 | 115.6 | G95 P100 | G95-S97 PolarHBondContact O-N 3.21Å; S97-P100 WeakPolarHBondContact O-CD 3.49Å |
| 98 | F | 54.5 | Low | 60.1 | Low | 156 Ų | 156 | 126.2 Ų | 126.2 | 68% | 0.684 | 67% | 0.668 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -79.8 | -24.1 | 174.5 | -88.7 | -96.7 | 0 | 0 | 0 | 114.2 | P96 Q101 A102 | P96-F98 PolarHBondContact O-N 3.33Å; F98-Q101 PolarHBondContact O-N 3.09Å; F98-A102 PolarHBondContact O-N 2.79Å; F98-A102 VanDerWaalsContact O-N 3.09Å |
| 99 | L | 52.8 | Low | 62.4 | Low | 123 Ų | 123 | 123.9 Ų | 123.9 | 64% | 0.644 | 66% | 0.655 | S | S | * | * | H | α-helix | trans | -61.9 | -42.7 | -176.7 | -65.2 | 176.6 | 0 | 0 | 0 | 114 | P96 Q101 L103 | P96-L99 PolarHBondContact O-N 3.2Å; L99-Q101 VanDerWaalsContact C-N 3.26Å; L99-Q101 PolarHBondContact O-N 2.87Å; L99-L103 PolarHBondContact O-N 3.2Å |
| 100 | P | 63.3 | Low | 64.8 | Low | 92 Ų | 92 | 121.3 Ų | 121.3 | 60% | 0.597 | 64% | 0.643 | S | S | * | * | H | α-helix | trans | -61.1 | -34.9 | 174.7 | -23.2 | 34.5 | 0 | 0 | 0 | 113 | S97 L103 H104 | S97-P100 WeakPolarHBondContact O-CD 3.49Å; P100-L103 PolarHBondContact O-N 3.28Å; P100-H104 WeakPolarHBondContact O-CB 3.42Å; P100-H104 PolarHBondContact O-N 3.28Å |
| 101 | Q | 70.3 | Confident | 67.4 | Low | 141 Ų | 141 | 116 Ų | 116 | 66% | 0.659 | 62% | 0.621 | S | S | * | * | H | α-helix | trans | -78 | -35.4 | -174 | -160.2 | 157.5 | -15.5 | 0 | 0 | 112.1 | F98 L99 Q105 | F98-Q101 PolarHBondContact O-N 3.09Å; L99-Q101 VanDerWaalsContact C-N 3.26Å; L99-Q101 PolarHBondContact O-N 2.87Å; Q101-Q105 WeakPolarHBondContact O-CB 3.1Å; Q101-Q105 PolarHBondContact O-N 3.44Å |
| 102 | A | 69.3 | Low | 69.7 | Low | 60 Ų | 60 | 114.7 Ų | 114.7 | 50% | 0.496 | 62% | 0.615 | S | S | . | * | H | α-helix | trans | -64 | -43.3 | 169.7 | 0 | 0 | 0 | 0 | 0 | 112 | F98 Q105 Q106 | F98-A102 PolarHBondContact O-N 2.79Å; F98-A102 VanDerWaalsContact O-N 3.09Å; A102-Q105 PolarHBondContact O-N 3.04Å; A102-Q106 PolarHBondContact O-N 3.1Å |
| 103 | L | 73.3 | Confident | 72 | Confident | 119 Ų | 119 | 112.3 Ų | 112.3 | 62% | 0.623 | 60% | 0.602 | S | S | * | * | H | α-helix | trans | -65.4 | -41.2 | 178.3 | -149.2 | 170.2 | 0 | 0 | 0 | 111.2 | L99 P100 Q105 Q106 Y107 | L99-L103 PolarHBondContact O-N 3.2Å; P100-L103 PolarHBondContact O-N 3.28Å; L103-Q105 PolarHBondContact O-N 3.11Å; L103-Q106 PolarHBondContact O-N 2.65Å; L103-Y107 PolarHBondContact O-N 3.3Å |
| 104 | H | 82 | Confident | 74 | Confident | 113 Ų | 113 | 112.2 Ų | 112.2 | 52% | 0.523 | 60% | 0.596 | S | S | . | * | H | α-helix | trans | -61.3 | -42.8 | 173.5 | -173.6 | 73.1 | 0 | 0 | 0 | 112.5 | P100 Y107 L108 | P100-H104 WeakPolarHBondContact O-CB 3.42Å; P100-H104 PolarHBondContact O-N 3.28Å; H104-Y107 PolarHBondContact O-N 2.94Å; H104-L108 WeakPolarHBondContact O-CG 3.5Å; H104-L108 PolarHBondContact O-N 3.42Å |
| 105 | Q | 85.1 | Confident | 75.5 | Confident | 147 Ų | 147 | 111.7 Ų | 111.7 | 69% | 0.687 | 58% | 0.584 | S | S | * | * | H | α-helix | trans | -65.7 | -38 | 176.8 | -173.2 | 165 | 85.4 | 0 | 0 | 112.3 | Q101 A102 L103 L108 L109 | Q101-Q105 WeakPolarHBondContact O-CB 3.1Å; Q101-Q105 PolarHBondContact O-N 3.44Å; A102-Q105 PolarHBondContact O-N 3.04Å; L103-Q105 PolarHBondContact O-N 3.11Å; Q105-L108 PolarHBondContact O-N 3.44Å; Q105-L109 PolarHBondContact O-N 3.46Å; Q105-L109 VanDerWaalsContact O-N 3.09Å |
| 106 | Q | 82.2 | Confident | 76.9 | Confident | 131 Ų | 131 | 111.1 Ų | 111.1 | 61% | 0.612 | 58% | 0.575 | S | S | * | * | H | α-helix | trans | -65.3 | -40.1 | 174 | -171.8 | 174.8 | -2.3 | 0 | 0 | 112.1 | A102 L103 L109 Q110 | A102-Q106 PolarHBondContact O-N 3.1Å; L103-Q106 PolarHBondContact O-N 2.65Å; Q106-L109 PolarHBondContact O-N 3.49Å; Q106-Q110 WeakPolarHBondContact O-CB 3.35Å; Q106-Q110 PolarHBondContact O-N 3.41Å |
| 107 | Y | 84.9 | Confident | 78.4 | Confident | 134 Ų | 134 | 112.2 Ų | 112.2 | 53% | 0.525 | 57% | 0.572 | S | S | . | * | H | α-helix | trans | -61.2 | -44.6 | 174.4 | 173.9 | -97.8 | 0 | 0 | 0 | 112.4 | L103 H104 L109 Q110 Q111 | L103-Y107 PolarHBondContact O-N 3.3Å; H104-Y107 PolarHBondContact O-N 2.94Å; Y107-L109 PolarHBondContact O-N 3.2Å; Y107-Q110 WeakPolarHBondContact O-CB 3.42Å; Y107-Q110 PolarHBondContact O-N 3.48Å; Y107-Q111 WeakPolarHBondContact O-CB 3.49Å; Y107-Q111 PolarHBondContact O-N 3.15Å; Y107-Q111 PolarHBondContact OH-NE2 2.98Å |
| 108 | L | 91.6 | Very high | 79.3 | Confident | 82 Ų | 82 | 113.3 Ų | 113.3 | 43% | 0.429 | 57% | 0.566 | S | S | . | * | H | α-helix | trans | -62.1 | -42.2 | 176.2 | -69.9 | 173.3 | 0 | 0 | 0 | 112.1 | H104 Q105 Q111 Q112 | H104-L108 WeakPolarHBondContact O-CG 3.5Å; H104-L108 PolarHBondContact O-N 3.42Å; Q105-L108 PolarHBondContact O-N 3.44Å; L108-Q111 PolarHBondContact O-N 3.36Å; L108-Q112 PolarHBondContact O-N 3.08Å |
| 109 | L | 89.4 | Confident | 80.3 | Confident | 119 Ų | 119 | 115.8 Ų | 115.8 | 62% | 0.623 | 57% | 0.57 | S | S | * | * | H | α-helix | trans | -63.1 | -43 | 176.4 | -161.7 | 86.4 | 0 | 0 | 0 | 111.9 | Q105 Q106 Y107 Q111 Q112 L113 | Q105-L109 PolarHBondContact O-N 3.46Å; Q105-L109 VanDerWaalsContact O-N 3.09Å; Q106-L109 PolarHBondContact O-N 3.49Å; Y107-L109 PolarHBondContact O-N 3.2Å; L109-Q111 VanDerWaalsContact C-N 3.32Å; L109-Q111 PolarHBondContact O-N 3.13Å; L109-Q112 PolarHBondContact O-N 3.02Å; L109-L113 PolarHBondContact O-N 3.11Å |
| 110 | Q | 88.5 | Confident | 81.1 | Confident | 119 Ų | 119 | 119 Ų | 119 | 56% | 0.556 | 57% | 0.574 | S | S | * | * | H | α-helix | trans | -60.6 | -41.7 | 176.5 | -167.5 | 80.4 | 77 | 0 | 0 | 111.4 | Q106 Y107 L113 L114 | Q106-Q110 WeakPolarHBondContact O-CB 3.35Å; Q106-Q110 PolarHBondContact O-N 3.41Å; Y107-Q110 WeakPolarHBondContact O-CB 3.42Å; Y107-Q110 PolarHBondContact O-N 3.48Å; Q110-L113 PolarHBondContact O-N 2.95Å; Q110-L114 PolarHBondContact O-N 3.43Å; Q110-L114 VanDerWaalsContact O-N 3.11Å |
| 111 | Q | 90.7 | Very high | 81 | Confident | 85 Ų | 85 | 121.2 Ų | 121.2 | 40% | 0.397 | 58% | 0.58 | S | S | . | * | H | α-helix | trans | -65.8 | -46.3 | 178.6 | -173.6 | 156.9 | 89.7 | 0 | 0 | 111.6 | Y107 L108 L109 L113 L114 E115 | Y107-Q111 WeakPolarHBondContact O-CB 3.49Å; Y107-Q111 PolarHBondContact O-N 3.15Å; Y107-Q111 PolarHBondContact OH-NE2 2.98Å; L108-Q111 PolarHBondContact O-N 3.36Å; L109-Q111 VanDerWaalsContact C-N 3.32Å; L109-Q111 PolarHBondContact O-N 3.13Å; Q111-L113 VanDerWaalsContact C-N 3.32Å; Q111-L113 PolarHBondContact O-N 3.35Å; Q111-L114 PolarHBondContact O-N 3.43Å; Q111-E115 WeakPolarHBondContact O-CG 3.11Å; Q111-E115 PolarHBondContact O-N 2.97Å |
| 112 | Q | 90.8 | Very high | 80.5 | Confident | 132 Ų | 132 | 118.9 Ų | 118.9 | 62% | 0.617 | 58% | 0.575 | S | S | * | * | H | α-helix | trans | -62.1 | -37.2 | 177.1 | -166.9 | 178.2 | 25.8 | 0 | 0 | 112.6 | L108 L109 A116 | L108-Q112 PolarHBondContact O-N 3.08Å; L109-Q112 PolarHBondContact O-N 3.02Å; Q112-A116 WeakPolarHBondContact O-CB 3.33Å; Q112-A116 PolarHBondContact O-N 3.47Å |
| 113 | L | 88.6 | Confident | 79.7 | Confident | 103 Ų | 103 | 119.6 Ų | 119.6 | 54% | 0.539 | 58% | 0.577 | S | S | . | * | H | α-helix | trans | -66.3 | -40.4 | 175.6 | -172.2 | 66.6 | 0 | 0 | 0 | 111.9 | L109 Q110 Q111 A116 Q117 | L109-L113 PolarHBondContact O-N 3.11Å; Q110-L113 PolarHBondContact O-N 2.95Å; Q111-L113 VanDerWaalsContact C-N 3.32Å; Q111-L113 PolarHBondContact O-N 3.35Å; L113-A116 PolarHBondContact O-N 3.29Å; L113-Q117 PolarHBondContact O-N 3.05Å |
| 114 | L | 87.5 | Confident | 78.4 | Confident | 118 Ų | 118 | 121.9 Ų | 121.9 | 62% | 0.618 | 58% | 0.584 | S | S | * | * | H | α-helix | trans | -66.7 | -42.2 | 178.2 | -155.2 | 75.6 | 0 | 0 | 0 | 111.5 | Q110 Q111 A116 Q117 H118 | Q110-L114 PolarHBondContact O-N 3.43Å; Q110-L114 VanDerWaalsContact O-N 3.11Å; Q111-L114 PolarHBondContact O-N 3.43Å; L114-A116 VanDerWaalsContact C-N 3.35Å; L114-A116 PolarHBondContact O-N 3.32Å; L114-Q117 PolarHBondContact O-N 2.94Å; L114-H118 WeakPolarHBondContact O-CB 3.14Å; L114-H118 PolarHBondContact O-N 3.32Å |
| 115 | E | 85.1 | Confident | 76.4 | Confident | 125 Ų | 125 | 121.5 Ų | 121.5 | 58% | 0.584 | 59% | 0.591 | S | S | * | * | H | α-helix | trans | -62 | -40.4 | 172.5 | -71.6 | -175.3 | 157.4 | 0 | 0 | 112.2 | Q111 H118 R119 | Q111-E115 WeakPolarHBondContact O-CG 3.11Å; Q111-E115 PolarHBondContact O-N 2.97Å; E115-H118 PolarHBondContact O-N 3.4Å; E115-R119 WeakPolarHBondContact O-CB 3.25Å; E115-R119 WeakPolarHBondContact O-CG 3.44Å; E115-R119 PolarHBondContact O-N 3.39Å |
| 116 | A | 80.6 | Confident | 74.1 | Confident | 44 Ų | 44 | 125 Ų | 125 | 36% | 0.364 | 60% | 0.598 | S | S | . | * | H | α-helix | trans | -65.2 | -37.2 | 176 | 0 | 0 | 0 | 0 | 0 | 112.4 | Q112 L113 L114 R120 | Q112-A116 WeakPolarHBondContact O-CB 3.33Å; Q112-A116 PolarHBondContact O-N 3.47Å; L113-A116 PolarHBondContact O-N 3.29Å; L114-A116 VanDerWaalsContact C-N 3.35Å; L114-A116 PolarHBondContact O-N 3.32Å; A116-R120 WeakPolarHBondContact O-CG 3.31Å; A116-R120 PolarHBondContact O-N 3.49Å |
| 117 | Q | 79 | Confident | 72 | Confident | 111 Ų | 111 | 131 Ų | 131 | 52% | 0.519 | 62% | 0.615 | S | S | . | * | H | α-helix | trans | -67.8 | -44.9 | 172.1 | -74.7 | -168.6 | -34.4 | 0 | 0 | 111.9 | L113 L114 R119 R120 L121 | L113-Q117 PolarHBondContact O-N 3.05Å; L114-Q117 PolarHBondContact O-N 2.94Å; Q117-R119 VanDerWaalsContact C-N 3.31Å; Q117-R119 PolarHBondContact O-N 3.3Å; Q117-R120 PolarHBondContact O-N 3.04Å; Q117-R120 VanDerWaalsContact O-N 3.14Å; Q117-L121 WeakPolarHBondContact O-CG 3.31Å; Q117-L121 PolarHBondContact O-N 3.47Å |
| 118 | H | 76.8 | Confident | 69.7 | Low | 126 Ų | 126 | 130.7 Ų | 130.7 | 58% | 0.583 | 63% | 0.633 | S | S | * | * | H | α-helix | trans | -61.3 | -39.7 | 177 | -164.8 | -102.6 | 0 | 0 | 0 | 111.7 | L114 E115 R120 L121 V122 | L114-H118 WeakPolarHBondContact O-CB 3.14Å; L114-H118 PolarHBondContact O-N 3.32Å; E115-H118 PolarHBondContact O-N 3.4Å; H118-R120 PolarHBondContact O-N 3.21Å; H118-L121 PolarHBondContact O-N 3.15Å; H118-V122 WeakPolarHBondContact O-CB 3.44Å; H118-V122 VanDerWaalsContact O-CG2 3.31Å; H118-V122 WeakPolarHBondContact O-CG2 3.37Å; H118-V122 PolarHBondContact O-N 2.89Å |
| 119 | R | 74.4 | Confident | 67 | Low | 207 Ų | 207 | 134.7 Ų | 134.7 | 78% | 0.781 | 65% | 0.649 | S | S | * | * | H | α-helix | trans | -57 | -47.2 | 171.6 | -75.8 | -89.4 | -177.9 | 174 | -1.3 | 112.1 | E115 Q117 S123 | E115-R119 WeakPolarHBondContact O-CB 3.25Å; E115-R119 WeakPolarHBondContact O-CG 3.44Å; E115-R119 PolarHBondContact O-N 3.39Å; Q117-R119 VanDerWaalsContact C-N 3.31Å; Q117-R119 PolarHBondContact O-N 3.3Å; R119-S123 WeakPolarHBondContact O-CB 3.28Å; R119-S123 PolarHBondContact O-N 3.1Å; R119-S123 PolarHBondContact O-OG 2.87Å; R119-S123 VanDerWaalsContact O-OG 3.06Å |
| 120 | R | 69.6 | Low | 64.4 | Low | 192 Ų | 192 | 137.9 Ų | 137.9 | 73% | 0.725 | 66% | 0.661 | S | S | * | * | H | α-helix | trans | -66.7 | -36.1 | 178.7 | -69.8 | 179.3 | -163.3 | -106 | 7.1 | 113.2 | A116 Q117 H118 S123 | A116-R120 WeakPolarHBondContact O-CG 3.31Å; A116-R120 PolarHBondContact O-N 3.49Å; Q117-R120 PolarHBondContact O-N 3.04Å; Q117-R120 VanDerWaalsContact O-N 3.14Å; H118-R120 PolarHBondContact O-N 3.21Å; R120-S123 PolarHBondContact O-OG 3.34Å |
| 121 | L | 60.9 | Low | 62.1 | Low | 138 Ų | 138 | 144.1 Ų | 144.1 | 72% | 0.723 | 68% | 0.68 | S | S | * | * | H | α-helix | trans | -73.7 | -40 | 178.8 | -72.1 | 165.2 | 0 | 0 | 0 | 112 | Q117 H118 | Q117-L121 WeakPolarHBondContact O-CG 3.31Å; Q117-L121 PolarHBondContact O-N 3.47Å; H118-L121 PolarHBondContact O-N 3.15Å |
| 122 | V | 60.3 | Low | 59.4 | Low | 91 Ų | 91 | 146.5 Ų | 146.5 | 55% | 0.552 | 70% | 0.7 | S | S | * | * | H | α-helix | trans | -80.5 | -21.6 | -179.6 | 176.5 | 0 | 0 | 0 | 0 | 112.6 | H118 H124 | H118-V122 WeakPolarHBondContact O-CB 3.44Å; H118-V122 VanDerWaalsContact O-CG2 3.31Å; H118-V122 WeakPolarHBondContact O-CG2 3.37Å; H118-V122 PolarHBondContact O-N 2.89Å; V122-H124 PolarHBondContact O-N 2.81Å; V122-H124 VanDerWaalsContact O-N 3.17Å |
| 123 | S | 52.5 | Low | 56.9 | Low | 76 Ų | 76 | 146.2 Ų | 146.2 | 53% | 0.531 | 71% | 0.712 | S | S | . | * | T | Hydrogen-bonded Turn | trans | -73.9 | 2.9 | 179.7 | 61.7 | 0 | 0 | 0 | 0 | 115.7 | R119 R120 P125 | R119-S123 WeakPolarHBondContact O-CB 3.28Å; R119-S123 PolarHBondContact O-N 3.1Å; R119-S123 PolarHBondContact O-OG 2.87Å; R119-S123 VanDerWaalsContact O-OG 3.06Å; R120-S123 PolarHBondContact O-OG 3.34Å; S123-P125 WeakPolarHBondContact O-CD 3.14Å |
| 124 | H | 45.4 | Very low | 54.7 | Low | 166 Ų | 166 | 146.7 Ų | 146.7 | 77% | 0.769 | 72% | 0.719 | S | S | * | * | trans | -115.5 | 61.1 | 176.5 | -77.5 | -68.9 | 0 | 0 | 0 | 115.2 | V122 | V122-H124 PolarHBondContact O-N 2.81Å; V122-H124 VanDerWaalsContact O-N 3.17Å | ||
| 125 | P | 40.4 | Very low | 52.4 | Low | 105 Ų | 105 | 148.1 Ų | 148.1 | 68% | 0.682 | 72% | 0.722 | S | S | * | * | trans | -86.6 | 119.4 | 165.8 | 34 | -29 | 0 | 0 | 0 | 111.6 | S123 | S123-P125 WeakPolarHBondContact O-CD 3.14Š| ||
| 126 | R | 37.2 | Very low | 50.3 | Low | 222 Ų | 222 | 146.6 Ų | 146.6 | 84% | 0.838 | 72% | 0.723 | S | S | * | * | trans | 45.3 | 103.3 | 157.1 | -68 | -172.7 | 168.1 | -113.9 | -1.1 | 119.1 | ||||
| 127 | R | 38.5 | Very low | 48.5 | Very low | 255 Ų | 255 | 152.1 Ų | 152.1 | 96% | 0.962 | 74% | 0.741 | S | S | * | * | trans | -154.1 | 65.2 | 150.5 | -153.2 | 179 | -172.6 | 179.9 | 2.9 | 115.6 | ||||
| 128 | S | 35.5 | Very low | 46.6 | Very low | 128 Ų | 128 | 157 Ų | 157 | 90% | 0.895 | 76% | 0.755 | S | S | * | * | trans | -163.3 | 67 | 163.9 | 49 | 0 | 0 | 0 | 0 | 112.5 | ||||
| 129 | Q | 35.7 | Very low | 44.7 | Very low | 167 Ų | 167 | 158.4 Ų | 158.4 | 78% | 0.78 | 77% | 0.766 | S | S | * | * | trans | -108.7 | 152.2 | 159.9 | -166.3 | 167.7 | -5.7 | 0 | 0 | 107.5 | ||||
| 130 | E | 35.5 | Very low | 42.9 | Very low | 186 Ų | 186 | 156.4 Ų | 156.4 | 87% | 0.869 | 77% | 0.765 | S | S | * | * | trans | 83.4 | 84.9 | 171.1 | -149.9 | 178.6 | 147.2 | 0 | 0 | 118.4 | ||||
| 131 | R | 39.2 | Very low | 41.7 | Very low | 250 Ų | 250 | 151.6 Ų | 151.6 | 94% | 0.943 | 76% | 0.759 | S | S | * | * | -157 | 102.9 | 125.3 | -107.9 | -174.5 | -159.1 | 147.3 | 7.3 | 110.5 | |||||
| 132 | V | 34.3 | Very low | 40.7 | Very low | 135 Ų | 135 | 150.8 Ų | 150.8 | 82% | 0.818 | 77% | 0.765 | S | S | * | * | trans | -91.9 | 136.9 | 164.1 | 173.1 | 0 | 0 | 0 | 0 | 107.6 | V134 | V132-V134 HydrophobicContact CG1-CG2 4.22Š| ||
| 133 | S | 38 | Very low | 39.4 | Very low | 125 Ų | 125 | 155.2 Ų | 155.2 | 87% | 0.874 | 78% | 0.777 | S | S | * | * | trans | -149.7 | 150.4 | 166.8 | -157.9 | 0 | 0 | 0 | 0 | 112.2 | ||||
| 134 | V | 43.5 | Very low | 38.8 | Very low | 114 Ų | 114 | 159.4 Ų | 159.4 | 69% | 0.691 | 79% | 0.793 | S | S | * | * | trans | -137.7 | 148.2 | -155.9 | -169.1 | 0 | 0 | 0 | 0 | 108 | V132 | V132-V134 HydrophobicContact CG1-CG2 4.22Š| ||
| 135 | H | 38.6 | Very low | 38.3 | Very low | 147 Ų | 147 | 160.9 Ų | 160.9 | 68% | 0.681 | 80% | 0.798 | S | S | * | * | cis | -140.2 | 165.6 | 21.6 | -151.8 | 52.4 | 0 | 0 | 0 | 110.4 | H137 | H135-H137 AromaticContact CD2-NE2 3.98Š| ||
| 136 | P | 41.4 | Very low | 38.1 | Very low | 94 Ų | 94 | 159.2 Ų | 159.2 | 61% | 0.61 | 80% | 0.8 | S | S | * | * | trans | -86.1 | 167.8 | 174.9 | 37 | -33.5 | 0 | 0 | 0 | 112 | ||||
| 137 | H | 41.5 | Very low | 38.1 | Very low | 159 Ų | 159 | 157.5 Ų | 157.5 | 74% | 0.736 | 80% | 0.801 | S | S | * | * | trans | -171.7 | 133.7 | 146 | -86.7 | -32.1 | 0 | 0 | 0 | 114.9 | H135 | H135-H137 AromaticContact CD2-NE2 3.98Š| ||
| 138 | R | 38.8 | Very low | 37.6 | Very low | 215 Ų | 215 | 152.9 Ų | 152.9 | 81% | 0.811 | 80% | 0.795 | S | S | * | * | trans | 63.6 | 117.7 | 148.6 | -66 | -169.5 | 174.6 | -164.9 | -1.5 | 120 | ||||
| 139 | L | 38.5 | Very low | 37.4 | Very low | 154 Ų | 154 | 155.8 Ų | 155.8 | 81% | 0.806 | 79% | 0.794 | S | S | * | * | 64.3 | 134.1 | 86.5 | -63.2 | 174.7 | 0 | 0 | 0 | 112.8 | |||||
| 140 | H | 36 | Very low | 37.1 | Very low | 165 Ų | 165 | 154.3 Ų | 154.3 | 76% | 0.764 | 80% | 0.796 | S | S | * | * | cis | -157.5 | 158.5 | 18.1 | -175.6 | -91.5 | 0 | 0 | 0 | 110 | ||||
| 141 | P | 43.2 | Very low | 36.9 | Very low | 92 Ų | 92 | 151.4 Ų | 151.4 | 60% | 0.597 | 79% | 0.794 | S | S | * | * | trans | -89.7 | 168.9 | -177.9 | 36.3 | -38.2 | 0 | 0 | 0 | 114.9 | ||||
| 142 | S | 39.7 | Very low | 36.3 | Very low | 121 Ų | 121 | 147.3 Ų | 147.3 | 85% | 0.846 | 79% | 0.786 | S | S | * | * | trans | -146.4 | 143.9 | 158.2 | -76.7 | 0 | 0 | 0 | 0 | 110.8 | ||||
| 143 | F | 34.4 | Very low | 36.4 | Very low | 183 Ų | 183 | 146.4 Ų | 146.4 | 80% | 0.803 | 78% | 0.783 | S | S | * | * | trans | -83.7 | 158.7 | 178.1 | -66.8 | -109 | 0 | 0 | 0 | 111 | ||||
| 144 | D | 40.2 | Very low | 36.3 | Very low | 165 Ų | 165 | 150.8 Ų | 150.8 | 88% | 0.882 | 78% | 0.78 | S | S | * | * | trans | -148.8 | 153.5 | 132.2 | -132.6 | -47.6 | 0 | 0 | 0 | 112 | ||||
| 145 | F | 34.5 | Very low | 35.7 | Very low | 197 Ų | 197 | 156.7 Ų | 156.7 | 86% | 0.864 | 79% | 0.791 | S | S | * | * | trans | -120.4 | 125 | -163.8 | -134.6 | -93.8 | 0 | 0 | 0 | 109.4 | ||||
| 146 | G | 35.7 | Very low | 35.5 | Very low | 70 Ų | 70 | 155.2 Ų | 155.2 | 72% | 0.722 | 79% | 0.788 | S | S | * | * | trans | -159.1 | 109.5 | -173.3 | 0 | 0 | 0 | 0 | 0 | 116.1 | ||||
| 147 | Q | 36.6 | Very low | 35.1 | Very low | 185 Ų | 185 | 155.9 Ų | 155.9 | 86% | 0.864 | 80% | 0.801 | S | S | * | * | trans | 65.3 | 110.2 | 159.9 | -129.3 | 69.9 | -1.9 | 0 | 0 | 120.2 | ||||
| 148 | L | 28.1 | Very low | 34.8 | Very low | 158 Ų | 158 | 155.8 Ų | 155.8 | 83% | 0.827 | 80% | 0.801 | S | S | * | * | trans | -43.9 | 136.6 | 165 | -74.3 | 63.4 | 0 | 0 | 0 | 114.4 | ||||
| 149 | Q | 31.9 | Very low | 34.4 | Very low | 190 Ų | 190 | 149.1 Ų | 149.1 | 89% | 0.888 | 80% | 0.799 | S | S | * | * | -163 | 110 | 120.4 | -106.7 | 175 | 32.3 | 0 | 0 | 110.1 | P151 | Q149-P151 WeakPolarHBondContact O-CD 3.42Š| |||
| 150 | T | 28.7 | Very low | 34.4 | Very low | 135 Ų | 135 | 146.9 Ų | 146.9 | 83% | 0.828 | 79% | 0.792 | S | S | * | * | trans | -73.6 | 120.5 | 171.3 | 39.7 | 0 | 0 | 0 | 0 | 110.9 | Q152 | T150-Q152 PolarHBondContact O-N 3.09Š| ||
| 151 | P | 31.7 | Very low | 34.2 | Very low | 126 Ų | 126 | 145.8 Ų | 145.8 | 82% | 0.818 | 79% | 0.792 | S | S | * | * | trans | -79.6 | 112.7 | 159.7 | 18.8 | -4.7 | 0 | 0 | 0 | 108.2 | Q149 | Q149-P151 WeakPolarHBondContact O-CD 3.42Š| ||
| 152 | Q | 27.7 | Very low | 33.9 | Very low | 164 Ų | 164 | 150.2 Ų | 150.2 | 77% | 0.766 | 80% | 0.797 | S | S | * | * | trans | -58.9 | 146.6 | 167.6 | -73.8 | -158.6 | 19.9 | 0 | 0 | 110.3 | T150 R154 | T150-Q152 PolarHBondContact O-N 3.09Å; Q152-R154 VanDerWaalsContact C-N 3.33Å; Q152-R154 PolarHBondContact O-N 3.08Å | ||
| 153 | P | 35.2 | Very low | 33.8 | Very low | 116 Ų | 116 | 149.6 Ų | 149.6 | 75% | 0.753 | 78% | 0.784 | S | S | * | * | trans | -67.1 | 95.2 | 166.3 | 29.5 | -32.4 | 0 | 0 | 0 | 108.4 | Y155 | P153-Y155 PolarHBondContact O-N 3.32Š| ||
| 154 | R | 36.6 | Very low | 33.7 | Very low | 216 Ų | 216 | 148.7 Ų | 148.7 | 82% | 0.815 | 79% | 0.787 | S | S | * | * | trans | -62.5 | 110.5 | 172.4 | -83.9 | -172.9 | 166.4 | 138.4 | -2.1 | 108.8 | Q152 L156 | Q152-R154 VanDerWaalsContact C-N 3.33Å; Q152-R154 PolarHBondContact O-N 3.08Å; R154-L156 HydrophobicContact CB-CG 4.48Å; R154-L156 PolarHBondContact O-N 2.59Å | ||
| 155 | Y | 31 | Very low | 33.6 | Very low | 238 Ų | 238 | 145.3 Ų | 145.3 | 93% | 0.933 | 78% | 0.776 | S | S | * | * | trans | -61.9 | 87 | 152.8 | -92.9 | -99.5 | 0 | 0 | 0 | 107.9 | P153 | P153-Y155 PolarHBondContact O-N 3.32Š| ||
| 156 | L | 34.2 | Very low | 33.6 | Very low | 117 Ų | 117 | 142.6 Ų | 142.6 | 61% | 0.613 | 78% | 0.775 | S | S | * | * | trans | -91.7 | 108.1 | 164.7 | -95.2 | 167.6 | 0 | 0 | 0 | 108 | R154 E158 | R154-L156 HydrophobicContact CB-CG 4.48Å; R154-L156 PolarHBondContact O-N 2.59Å; L156-E158 VanDerWaalsContact C-N 3.26Å; L156-E158 HydrophobicContact CD2-CG 4.41Å; L156-E158 PolarHBondContact O-N 3.08Å | ||
| 157 | A | 33.1 | Very low | 33.5 | Very low | 108 Ų | 108 | 146.8 Ų | 146.8 | 89% | 0.893 | 78% | 0.781 | S | S | * | * | trans | -77.1 | 80.2 | 168.4 | 0 | 0 | 0 | 0 | 0 | 108.8 | ||||
| 158 | E | 34.5 | Very low | 33.3 | Very low | 157 Ų | 157 | 142.5 Ų | 142.5 | 73% | 0.734 | 78% | 0.777 | S | S | * | * | trans | -120.2 | 128 | 169.3 | -68.9 | -176.1 | 178.7 | 0 | 0 | 108.2 | L156 | L156-E158 VanDerWaalsContact C-N 3.26Å; L156-E158 HydrophobicContact CD2-CG 4.41Å; L156-E158 PolarHBondContact O-N 3.08Å | ||
| 159 | G | 31.2 | Very low | 33.6 | Very low | 74 Ų | 74 | 138.2 Ų | 138.2 | 76% | 0.763 | 77% | 0.771 | S | S | * | * | trans | -63.7 | 150.4 | -164.1 | 0 | 0 | 0 | 0 | 0 | 112.9 | D161 | G159-D161 PolarHBondContact O-N 2.92Š| ||
| 160 | T | 37.9 | Very low | 33.7 | Very low | 107 Ų | 107 | 137.8 Ų | 137.8 | 66% | 0.656 | 77% | 0.774 | S | S | * | * | trans | -55.5 | 107.3 | 163.5 | 45.2 | 0 | 0 | 0 | 0 | 109.2 | W162 | T160-W162 VanDerWaalsContact CB-NE1 3.32Å; T160-W162 PolarHBondContact O-N 2.88Å; T160-W162 VanDerWaalsContact O-N 3.11Å; T160-W162 VanDerWaalsContact OG1-CD1 3.3Å; T160-W162 PolarHBondContact OG1-NE1 3.11Å | ||
| 161 | D | 32.8 | Very low | 33.8 | Very low | 142 Ų | 142 | 136.5 Ų | 136.5 | 76% | 0.759 | 77% | 0.771 | S | S | * | * | trans | -61.9 | 108.4 | 168.8 | -177.8 | 45.1 | 0 | 0 | 0 | 108.8 | G159 | G159-D161 PolarHBondContact O-N 2.92Š| ||
| 162 | W | 37.3 | Very low | 34.1 | Very low | 186 Ų | 186 | 136.9 Ų | 136.9 | 71% | 0.705 | 77% | 0.773 | S | S | * | * | trans | -112 | 42 | 175.2 | -67.5 | 108.5 | 0 | 0 | 0 | 109.7 | T160 L164 | T160-W162 VanDerWaalsContact CB-NE1 3.32Å; T160-W162 PolarHBondContact O-N 2.88Å; T160-W162 VanDerWaalsContact O-N 3.11Å; T160-W162 VanDerWaalsContact OG1-CD1 3.3Å; T160-W162 PolarHBondContact OG1-NE1 3.11Å; W162-L164 PolarHBondContact O-N 2.68Å | ||
| 163 | D | 37.5 | Very low | 34.5 | Very low | 108 Ų | 108 | 133.1 Ų | 133.1 | 58% | 0.578 | 77% | 0.77 | S | S | * | * | trans | -70.3 | 99.9 | 176.1 | -168.6 | 48.6 | 0 | 0 | 0 | 111.1 | S165 | D163-S165 PolarHBondContact O-N 2.97Å; D163-S165 VanDerWaalsContact OD2-CB 3.29Å; D163-S165 WeakPolarHBondContact OD2-CB 3.45Å; D163-S165 PolarHBondContact OD2-OG 3.24Å | ||
| 164 | L | 31.9 | Very low | 34.4 | Very low | 164 Ų | 164 | 136.4 Ų | 136.4 | 86% | 0.859 | 78% | 0.776 | S | S | * | * | trans | -80 | 63.7 | 168.4 | -72.5 | 169.3 | 0 | 0 | 0 | 109.5 | W162 V166 | W162-L164 PolarHBondContact O-N 2.68Å; L164-V166 VanDerWaalsContact C-N 3.33Å; L164-V166 PolarHBondContact O-N 3.03Å | ||
| 165 | S | 36.7 | Very low | 34.3 | Very low | 93 Ų | 93 | 136 Ų | 136 | 65% | 0.65 | 78% | 0.78 | S | S | * | * | trans | -66 | 96 | 168 | -89.4 | 0 | 0 | 0 | 0 | 110 | D163 D167 | D163-S165 PolarHBondContact O-N 2.97Å; D163-S165 VanDerWaalsContact OD2-CB 3.29Å; D163-S165 WeakPolarHBondContact OD2-CB 3.45Å; D163-S165 PolarHBondContact OD2-OG 3.24Å; S165-D167 PolarHBondContact O-N 3.08Å | ||
| 166 | V | 34.6 | Very low | 34.3 | Very low | 141 Ų | 141 | 134.3 Ų | 134.3 | 86% | 0.855 | 78% | 0.78 | S | S | * | * | trans | -56.1 | 114.1 | 154.8 | 161.4 | 0 | 0 | 0 | 0 | 107.7 | L164 | L164-V166 VanDerWaalsContact C-N 3.33Å; L164-V166 PolarHBondContact O-N 3.03Å | ||
| 167 | D | 34.6 | Very low | 34.5 | Very low | 157 Ų | 157 | 135.1 Ų | 135.1 | 84% | 0.84 | 79% | 0.79 | S | S | * | * | trans | -148 | 152.9 | 147.8 | -135.3 | -35.1 | 0 | 0 | 0 | 112.8 | S165 | S165-D167 PolarHBondContact O-N 3.08Š| ||
| 168 | A | 33 | Very low | 34.7 | Very low | 95 Ų | 95 | 140.8 Ų | 140.8 | 79% | 0.785 | 79% | 0.788 | S | S | * | * | trans | -94.7 | 105.9 | -162.5 | 0 | 0 | 0 | 0 | 0 | 112.6 | ||||
| 169 | G | 32.5 | Very low | 35 | Very low | 69 Ų | 69 | 139 Ų | 139 | 71% | 0.711 | 79% | 0.791 | S | S | * | * | trans | 86.8 | 134.1 | 163.8 | 0 | 0 | 0 | 0 | 0 | 114.9 | ||||
| 170 | L | 34.5 | Very low | 35.7 | Very low | 181 Ų | 181 | 142.6 Ų | 142.6 | 95% | 0.948 | 79% | 0.791 | S | S | * | * | trans | 177.3 | 160.2 | 139.7 | -91.8 | 168.9 | 0 | 0 | 0 | 107.5 | ||||
| 171 | S | 32.3 | Very low | 35.8 | Very low | 107 Ų | 107 | 142 Ų | 142 | 75% | 0.748 | 79% | 0.789 | S | S | * | * | trans | -81.9 | 150.4 | -159.8 | 46.3 | 0 | 0 | 0 | 0 | 115.3 | ||||
| 172 | P | 37.3 | Very low | 36.6 | Very low | 135 Ų | 135 | 143.4 Ų | 143.4 | 88% | 0.877 | 79% | 0.791 | S | S | * | * | trans | -84.1 | 120.5 | 178.8 | 32.6 | -32.5 | 0 | 0 | 0 | 111.7 | ||||
| 173 | A | 35.1 | Very low | 37.1 | Very low | 85 Ų | 85 | 141.3 Ų | 141.3 | 70% | 0.702 | 79% | 0.789 | S | S | * | * | trans | -129.6 | 117.4 | 168.2 | 0 | 0 | 0 | 0 | 0 | 111.4 | ||||
| 174 | Q | 34.3 | Very low | 37.4 | Very low | 185 Ų | 185 | 144.9 Ų | 144.9 | 86% | 0.864 | 80% | 0.795 | S | S | * | * | trans | 60.1 | 86.6 | 150.5 | -56.6 | -178.6 | -3.2 | 0 | 0 | 119.1 | ||||
| 175 | F | 34.6 | Very low | 38.1 | Very low | 208 Ų | 208 | 144.6 Ų | 144.6 | 91% | 0.912 | 79% | 0.789 | S | S | * | * | trans | -134.3 | 114.1 | 140.3 | -93 | -85.1 | 0 | 0 | 0 | 110.1 | ||||
| 176 | Q | 30.6 | Very low | 38.5 | Very low | 201 Ų | 201 | 148.5 Ų | 148.5 | 94% | 0.939 | 80% | 0.797 | S | S | * | * | trans | -89.1 | 112.2 | 173 | -77.2 | -169.6 | -38.2 | 0 | 0 | 110.2 | ||||
| 177 | V | 38.1 | Very low | 38.9 | Very low | 135 Ų | 135 | 152.4 Ų | 152.4 | 82% | 0.818 | 80% | 0.798 | S | S | * | * | trans | -105.7 | 132.5 | 167.8 | -178.7 | 0 | 0 | 0 | 0 | 108.6 | ||||
| 178 | R | 36.3 | Very low | 39.2 | Very low | 226 Ų | 226 | 152.2 Ų | 152.2 | 85% | 0.853 | 80% | 0.796 | S | S | * | * | P | Polyproline II helix | trans | -67.8 | 146.1 | -175.7 | -69.3 | -161.4 | 74.1 | -170.1 | 2.5 | 112 | ||
| 179 | P | 42.2 | Very low | 39.6 | Very low | 121 Ų | 121 | 151.7 Ų | 151.7 | 79% | 0.786 | 79% | 0.792 | S | S | * | * | P | Polyproline II helix | trans | -75.4 | 129.5 | 179.1 | 29.3 | -32.4 | 0 | 0 | 0 | 111.9 | ||
| 180 | I | 45.5 | Very low | 40.2 | Very low | 149 Ų | 149 | 154.3 Ų | 154.3 | 76% | 0.764 | 80% | 0.795 | S | S | * | * | P | Polyproline II helix | trans | -88 | 141.9 | 171.5 | -64.3 | 172 | 0 | 0 | 0 | 108.8 | Q182 | I180-Q182 PolarHBondContact O-N 2.87Š|
| 181 | P | 39.4 | Very low | 40.8 | Very low | 95 Ų | 95 | 150.6 Ų | 150.6 | 62% | 0.617 | 78% | 0.781 | S | S | * | * | P | Polyproline II helix | trans | -60.9 | 131.2 | -173.5 | -26.8 | 36.7 | 0 | 0 | 0 | 115.1 | H183 | P181-H183 VanDerWaalsContact C-N 3.3Å; P181-H183 PolarHBondContact O-N 2.82Å |
| 182 | Q | 49.8 | Very low | 41.4 | Very low | 170 Ų | 170 | 154.7 Ų | 154.7 | 79% | 0.794 | 78% | 0.78 | S | S | * | * | S | Bend | trans | -77.5 | 12.2 | -160.9 | -62.6 | 173.8 | -49.6 | 0 | 0 | 117.1 | I180 Y184 | I180-Q182 PolarHBondContact O-N 2.87Å; Q182-Y184 PolarHBondContact O-N 3Å |
| 183 | H | 48.1 | Very low | 41.7 | Very low | 143 Ų | 143 | 154.8 Ų | 154.8 | 66% | 0.662 | 77% | 0.771 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -86.2 | 1.9 | -162.7 | 58.6 | -79.3 | 0 | 0 | 0 | 116.3 | P181 | P181-H183 VanDerWaalsContact C-N 3.3Å; P181-H183 PolarHBondContact O-N 2.82Å |
| 184 | Y | 44.4 | Very low | 42.3 | Very low | 183 Ų | 183 | 157.1 Ų | 157.1 | 72% | 0.718 | 77% | 0.767 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -120.9 | 1.9 | -178.6 | -84.9 | -79 | 0 | 0 | 0 | 115.9 | Q182 H186 | Q182-Y184 PolarHBondContact O-N 3Å; Y184-H186 PolarHBondContact O-N 2.95Å |
| 185 | Q | 45.3 | Very low | 42.6 | Very low | 157 Ų | 157 | 156.9 Ų | 156.9 | 73% | 0.734 | 77% | 0.765 | S | S | * | * | G | 310 helix | trans | -75.9 | -15.1 | -173.4 | -72.7 | -144.4 | -52.2 | 0 | 0 | 115.9 | Y187 | Q185-Y187 PolarHBondContact O-N 2.99Š|
| 186 | H | 45.8 | Very low | 42.8 | Very low | 176 Ų | 176 | 155.2 Ų | 155.2 | 82% | 0.815 | 76% | 0.758 | S | S | * | * | G | 310 helix | trans | -80.1 | -8.6 | -171.8 | -69.3 | -62.3 | 0 | 0 | 0 | 115.9 | Y184 | Y184-H186 PolarHBondContact O-N 2.95Š|
| 187 | Y | 42.7 | Very low | 43.2 | Very low | 223 Ų | 223 | 151 Ų | 151 | 88% | 0.875 | 75% | 0.748 | S | S | * | * | G | 310 helix | trans | -107.4 | -4.5 | -178 | -80.8 | -81.1 | 0 | 0 | 0 | 115.3 | Q185 | Q185-Y187 PolarHBondContact O-N 2.99Š|
| 188 | L | 41.7 | Very low | 43.4 | Very low | 152 Ų | 152 | 156.9 Ų | 156.9 | 80% | 0.796 | 76% | 0.755 | S | S | * | * | trans | -125 | 7.2 | -173.2 | -66.6 | 176.6 | 0 | 0 | 0 | 114.7 | T190 | L188-T190 VanDerWaalsContact C-N 3.29Å; L188-T190 PolarHBondContact O-N 3.45Å | ||
| 189 | A | 40.7 | Very low | 43.6 | Very low | 85 Ų | 85 | 151.7 Ų | 151.7 | 70% | 0.702 | 75% | 0.745 | S | S | * | * | trans | -79.9 | 73.1 | 176.2 | 0 | 0 | 0 | 0 | 0 | 111.5 | ||||
| 190 | T | 46.4 | Very low | 44 | Very low | 124 Ų | 124 | 151.5 Ų | 151.5 | 76% | 0.761 | 75% | 0.746 | S | S | * | * | trans | -59.2 | 127.3 | 157.6 | 44.4 | 0 | 0 | 0 | 0 | 108.1 | L188 R192 | L188-T190 VanDerWaalsContact C-N 3.29Å; L188-T190 PolarHBondContact O-N 3.45Å; T190-R192 PolarHBondContact O-N 3.02Å | ||
| 191 | P | 46.7 | Very low | 43.9 | Very low | 103 Ų | 103 | 148.8 Ų | 148.8 | 67% | 0.669 | 74% | 0.74 | S | S | * | * | trans | -62 | 115.3 | 178.9 | -22.3 | 33.4 | 0 | 0 | 0 | 109.6 | M193 | P191-M193 PolarHBondContact O-N 3.48Š| ||
| 192 | R | 45.2 | Very low | 44.2 | Very low | 192 Ų | 192 | 147.1 Ų | 147.1 | 73% | 0.725 | 73% | 0.731 | S | S | * | * | trans | -62.6 | 101.9 | 173.6 | -177.4 | 179.2 | 178.2 | 113.5 | -2.5 | 107.7 | T190 H194 | T190-R192 PolarHBondContact O-N 3.02Å; R192-H194 PolarHBondContact O-CD2 3.26Å; R192-H194 PolarHBondContact O-N 3.42Å | ||
| 193 | M | 43.3 | Very low | 43.9 | Very low | 138 Ų | 138 | 144.5 Ų | 144.5 | 68% | 0.68 | 73% | 0.727 | S | S | * | * | trans | -60.5 | 102.4 | 176.7 | -78.2 | -63.2 | -59.2 | 0 | 0 | 109.6 | P191 H195 | P191-M193 PolarHBondContact O-N 3.48Å; M193-H195 PolarHBondContact O-N 2.99Å | ||
| 194 | H | 46.9 | Very low | 43.7 | Very low | 133 Ų | 133 | 146.4 Ų | 146.4 | 62% | 0.616 | 74% | 0.736 | S | S | * | * | trans | -64.6 | 132.2 | 173.3 | -72.5 | -97.7 | 0 | 0 | 0 | 109.1 | R192 F196 | R192-H194 PolarHBondContact O-CD2 3.26Å; R192-H194 PolarHBondContact O-N 3.42Å; H194-F196 HydrophobicContact CB-CE2 4.21Å; H194-F196 VanDerWaalsContact O-CD2 3.27Å; H194-F196 WeakPolarHBondContact O-CD2 3.39Å; H194-F196 PolarHBondContact O-N 2.97Å; H194-F196 VanDerWaalsContact O-N 3.09Å | ||
| 195 | H | 40.5 | Very low | 43.6 | Very low | 181 Ų | 181 | 144.8 Ų | 144.8 | 84% | 0.838 | 74% | 0.737 | S | S | * | * | trans | -68.6 | 106.1 | 174.7 | -80.2 | 49.2 | 0 | 0 | 0 | 109 | M193 | M193-H195 PolarHBondContact O-N 2.99Š| ||
| 196 | F | 39.7 | Very low | 43.8 | Very low | 172 Ų | 172 | 141.2 Ų | 141.2 | 75% | 0.754 | 73% | 0.725 | S | S | * | * | trans | -82.5 | 136.8 | 175.9 | -79.9 | -84.1 | 0 | 0 | 0 | 111.2 | H194 | H194-F196 HydrophobicContact CB-CE2 4.21Å; H194-F196 VanDerWaalsContact O-CD2 3.27Å; H194-F196 WeakPolarHBondContact O-CD2 3.39Å; H194-F196 PolarHBondContact O-N 2.97Å; H194-F196 VanDerWaalsContact O-N 3.09Å | ||
| 197 | P | 38.5 | Very low | 43.9 | Very low | 112 Ų | 112 | 137 Ų | 137 | 73% | 0.727 | 71% | 0.712 | S | S | * | * | trans | -71.1 | 146.5 | -176.8 | 29 | -34.7 | 0 | 0 | 0 | 111.9 | N199 | P197-N199 PolarHBondContact O-N 3.27Š| ||
| 198 | R | 41.5 | Very low | 44 | Very low | 260 Ų | 260 | 133.7 Ų | 133.7 | 98% | 0.981 | 70% | 0.704 | S | S | * | * | trans | -61.2 | 97.3 | 169.9 | -83.5 | 175 | 152.7 | -169.1 | -4.9 | 110.4 | ||||
| 199 | N | 41.2 | Very low | 44.3 | Very low | 117 Ų | 117 | 133.9 Ų | 133.9 | 63% | 0.626 | 70% | 0.701 | S | S | * | * | trans | -141.1 | 132.3 | 155.8 | -154.6 | 6.3 | 0 | 0 | 0 | 110.3 | P197 S201 | P197-N199 PolarHBondContact O-N 3.27Å; N199-S201 PolarHBondContact O-N 3.25Å | ||
| 200 | S | 49.8 | Very low | 44.7 | Very low | 116 Ų | 116 | 131.6 Ų | 131.6 | 81% | 0.811 | 68% | 0.677 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -74.6 | 6 | -164 | 52.1 | 0 | 0 | 0 | 0 | 115.3 | ||
| 201 | S | 45.2 | Very low | 45 | Very low | 93 Ų | 93 | 135.1 Ų | 135.1 | 65% | 0.65 | 68% | 0.676 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -100 | -7.3 | -176.3 | 47.9 | 0 | 0 | 0 | 0 | 114.9 | N199 T203 | N199-S201 PolarHBondContact O-N 3.25Å; S201-T203 VanDerWaalsContact C-N 3.35Å; S201-T203 PolarHBondContact O-N 3.35Å |
| 202 | S | 45.7 | Very low | 45.3 | Very low | 60 Ų | 60 | 136.9 Ų | 136.9 | 42% | 0.42 | 68% | 0.68 | S | S | . | * | G | 310 helix | trans | -83.9 | 2.9 | -170.5 | -153.3 | 0 | 0 | 0 | 0 | 115.8 | Q204 M205 | S202-Q204 PolarHBondContact O-N 2.95Å; S202-M205 PolarHBondContact O-N 3.48Å |
| 203 | T | 42.4 | Very low | 45.7 | Very low | 115 Ų | 115 | 133.7 Ų | 133.7 | 71% | 0.706 | 67% | 0.668 | S | S | * | * | G | 310 helix | trans | -59.4 | -23.8 | -177.1 | -47.8 | 0 | 0 | 0 | 0 | 113.6 | S201 | S201-T203 VanDerWaalsContact C-N 3.35Å; S201-T203 PolarHBondContact O-N 3.35Å |
| 204 | Q | 43.6 | Very low | 46.6 | Very low | 183 Ų | 183 | 132 Ų | 132 | 86% | 0.855 | 67% | 0.668 | S | S | * | * | G | 310 helix | trans | -84.1 | -14.2 | 177.1 | -67.5 | -165 | -11.6 | 0 | 0 | 114.8 | S202 | S202-Q204 PolarHBondContact O-N 2.95Š|
| 205 | M | 43.2 | Very low | 47.2 | Very low | 148 Ų | 148 | 132.1 Ų | 132.1 | 73% | 0.729 | 66% | 0.664 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -92.4 | -19 | -175.9 | -72.3 | -122.4 | 60.8 | 0 | 0 | 114.1 | S202 V207 | S202-M205 PolarHBondContact O-N 3.48Å; M205-V207 PolarHBondContact O-N 3.47Å |
| 206 | V | 48.8 | Very low | 48.2 | Very low | 82 Ų | 82 | 128.1 Ų | 128.1 | 50% | 0.497 | 65% | 0.654 | S | S | . | * | T | Hydrogen-bonded Turn | trans | -79 | -16.7 | -174.7 | -176.2 | 0 | 0 | 0 | 0 | 112.9 | H208 I210 | V206-H208 PolarHBondContact O-N 3.11Å; V206-I210 HydrophobicContact CG1-CD1 4.46Å; V206-I210 VanDerWaalsContact O-CD1 3.3Å; V206-I210 WeakPolarHBondContact O-CD1 3.27Å; V206-I210 VanDerWaalsContact O-CG1 3.29Å; V206-I210 WeakPolarHBondContact O-CG1 3.17Å |
| 207 | V | 47.3 | Very low | 49 | Very low | 89 Ų | 89 | 127.3 Ų | 127.3 | 54% | 0.539 | 65% | 0.653 | S | S | . | * | T | Hydrogen-bonded Turn | trans | -79.7 | -18.9 | -170.5 | -171.7 | 0 | 0 | 0 | 0 | 113.8 | M205 | M205-V207 PolarHBondContact O-N 3.47Š|
| 208 | H | 44.8 | Very low | 50.2 | Low | 152 Ų | 152 | 125.7 Ų | 125.7 | 70% | 0.704 | 64% | 0.638 | S | S | * | * | S | Bend | trans | -84 | -33.1 | -168.2 | -138.8 | 82.5 | 0 | 0 | 0 | 114.8 | V206 | V206-H208 PolarHBondContact O-N 3.11Š|
| 209 | E | 48.1 | Very low | 50.9 | Low | 157 Ų | 157 | 116.2 Ų | 116.2 | 73% | 0.734 | 60% | 0.604 | S | S | * | * | G | 310 helix | trans | -80.2 | -18.6 | -179 | -76.5 | -69 | 131.4 | 0 | 0 | 113.7 | R211 | E209-R211 PolarHBondContact O-N 3.02Å; E209-R211 VanDerWaalsContact O-N 3.16Å |
| 210 | I | 50.2 | Low | 51.5 | Low | 37 Ų | 37 | 117.8 Ų | 117.8 | 19% | 0.19 | 61% | 0.606 | C | S | . | * | G | 310 helix | trans | -69.7 | -16.2 | -173.6 | -46.8 | 178.9 | 0 | 0 | 0 | 112.2 | V206 N212 Y213 | V206-I210 HydrophobicContact CG1-CD1 4.46Å; V206-I210 VanDerWaalsContact O-CD1 3.3Å; V206-I210 WeakPolarHBondContact O-CD1 3.27Å; V206-I210 VanDerWaalsContact O-CG1 3.29Å; V206-I210 WeakPolarHBondContact O-CG1 3.17Å; I210-N212 VanDerWaalsContact C-N 3.3Å; I210-N212 PolarHBondContact O-N 3.16Å; I210-Y213 PolarHBondContact O-N 3.41Å |
| 211 | R | 52.4 | Low | 52 | Low | 198 Ų | 198 | 117.5 Ų | 117.5 | 75% | 0.747 | 60% | 0.595 | S | S | * | * | G | 310 helix | trans | -71.8 | -17.2 | -176.8 | -71.2 | -175.9 | 171.7 | -171.5 | -3.3 | 114.8 | E209 | E209-R211 PolarHBondContact O-N 3.02Å; E209-R211 VanDerWaalsContact O-N 3.16Å |
| 212 | N | 53.2 | Low | 52.4 | Low | 140 Ų | 140 | 115.5 Ų | 115.5 | 75% | 0.749 | 58% | 0.583 | S | S | * | * | G | 310 helix | trans | -99.5 | 10.7 | -179.9 | -72.7 | -16.6 | 0 | 0 | 0 | 113.8 | I210 P214 | I210-N212 VanDerWaalsContact C-N 3.3Å; I210-N212 PolarHBondContact O-N 3.16Å; N212-P214 WeakPolarHBondContact O-CD 3.38Å |
| 213 | Y | 52.5 | Low | 52.9 | Low | 124 Ų | 124 | 116.6 Ų | 116.6 | 49% | 0.486 | 58% | 0.584 | S | S | . | * | trans | -72.3 | 122.2 | -177.5 | -144.7 | -98.6 | 0 | 0 | 0 | 111.3 | I210 Y215 L218 | I210-Y213 PolarHBondContact O-N 3.41Å; Y213-Y215 PolarHBondContact O-N 3.45Å; Y213-L218 HydrophobicContact CD1-CB 4.31Å; Y213-L218 HydrophobicContact CE1-CB 4.03Å; Y213-L218 HydrophobicContact CE1-CD1 3.88Å | ||
| 214 | P | 64 | Low | 53.6 | Low | 103 Ų | 103 | 117.2 Ų | 117.2 | 67% | 0.669 | 58% | 0.579 | S | S | * | * | S | Bend | trans | -71.1 | -0.1 | -172.3 | 27.3 | -34.4 | 0 | 0 | 0 | 114.7 | N212 | N212-P214 WeakPolarHBondContact O-CD 3.38Š|
| 215 | Y | 59.3 | Low | 54.1 | Low | 135 Ų | 135 | 109.6 Ų | 109.6 | 53% | 0.529 | 55% | 0.55 | S | S | . | . | trans | -125.4 | 92.4 | 179.7 | -68 | -77.8 | 0 | 0 | 0 | 110.7 | Y213 Q217 L218 H219 | Y213-Y215 PolarHBondContact O-N 3.45Å; Y215-Q217 PolarHBondContact O-N 2.99Å; Y215-Q217 VanDerWaalsContact O-N 3.11Å; Y215-L218 HydrophobicContact CD2-CD1 4.41Å; Y215-L218 HydrophobicContact CG-CD1 4.23Å; Y215-L218 PolarHBondContact O-N 3.06Å; Y215-H219 PolarHBondContact O-N 3.49Å | ||
| 216 | P | 60.3 | Low | 54.5 | Low | 98 Ų | 98 | 107.3 Ų | 107.3 | 64% | 0.636 | 54% | 0.54 | S | S | * | . | H | α-helix | trans | -63.3 | -17.5 | 179 | 24.7 | -34 | 0 | 0 | 0 | 113.3 | H219 | P216-H219 WeakPolarHBondContact O-CB 3.49Å; P216-H219 PolarHBondContact O-N 3.32Å |
| 217 | Q | 58 | Low | 54.5 | Low | 155 Ų | 155 | 106.8 Ų | 106.8 | 72% | 0.724 | 53% | 0.534 | S | S | * | . | H | α-helix | trans | -70.6 | -36.2 | 173 | -67.9 | 156.4 | -11.8 | 0 | 0 | 112.2 | Y215 H219 F220 | Y215-Q217 PolarHBondContact O-N 2.99Å; Y215-Q217 VanDerWaalsContact O-N 3.11Å; Q217-H219 VanDerWaalsContact C-N 3.25Å; Q217-H219 PolarHBondContact O-N 3.32Å; Q217-F220 PolarHBondContact O-N 2.98Å |
| 218 | L | 62.2 | Low | 54.7 | Low | 78 Ų | 78 | 108.7 Ų | 108.7 | 41% | 0.408 | 55% | 0.548 | S | S | . | . | H | α-helix | trans | -75 | -18 | 175.4 | -64 | 178.1 | 0 | 0 | 0 | 112.2 | Y213 Y215 F220 L221 A222 | Y213-L218 HydrophobicContact CD1-CB 4.31Å; Y213-L218 HydrophobicContact CE1-CB 4.03Å; Y213-L218 HydrophobicContact CE1-CD1 3.88Å; Y215-L218 HydrophobicContact CD2-CD1 4.41Å; Y215-L218 HydrophobicContact CG-CD1 4.23Å; Y215-L218 PolarHBondContact O-N 3.06Å; L218-F220 VanDerWaalsContact C-N 3.31Å; L218-F220 PolarHBondContact O-N 3.37Å; L218-L221 HydrophobicContact CD2-CD2 4.43Å; L218-L221 PolarHBondContact O-N 2.79Å; L218-A222 PolarHBondContact O-N 2.97Å |
| 219 | H | 55.8 | Low | 55.1 | Low | 61 Ų | 61 | 106.8 Ų | 106.8 | 28% | 0.282 | 55% | 0.552 | S | S | . | * | H | α-helix | trans | -59.7 | -39.9 | 172.8 | -156.2 | 94 | 0 | 0 | 0 | 111.9 | Y215 P216 Q217 A222 L223 | Y215-H219 PolarHBondContact O-N 3.49Å; P216-H219 WeakPolarHBondContact O-CB 3.49Å; P216-H219 PolarHBondContact O-N 3.32Å; Q217-H219 VanDerWaalsContact C-N 3.25Å; Q217-H219 PolarHBondContact O-N 3.32Å; H219-A222 PolarHBondContact O-N 3.26Å; H219-L223 WeakPolarHBondContact O-CB 3.37Å; H219-L223 VanDerWaalsContact O-CG 3.31Å; H219-L223 WeakPolarHBondContact O-CG 3.48Å; H219-L223 PolarHBondContact O-N 3.07Å |
| 220 | F | 55.6 | Low | 55.2 | Low | 150 Ų | 150 | 108.7 Ų | 108.7 | 66% | 0.658 | 55% | 0.553 | S | S | * | * | H | α-helix | trans | -66.7 | -39.8 | 176.2 | -100.2 | -85.8 | 0 | 0 | 0 | 112.7 | Q217 L218 L223 Q224 | Q217-F220 PolarHBondContact O-N 2.98Å; L218-F220 VanDerWaalsContact C-N 3.31Å; L218-F220 PolarHBondContact O-N 3.37Å; F220-L223 PolarHBondContact O-N 3.09Å; F220-Q224 WeakPolarHBondContact O-CB 3.48Å; F220-Q224 VanDerWaalsContact O-CG 3.25Å; F220-Q224 WeakPolarHBondContact O-CG 3.19Å; F220-Q224 PolarHBondContact O-N 2.84Å |
| 221 | L | 58.8 | Low | 54.9 | Low | 110 Ų | 110 | 115.5 Ų | 115.5 | 58% | 0.576 | 58% | 0.583 | S | S | * | * | H | α-helix | trans | -63.9 | -44.2 | 174.4 | -98.3 | 65.4 | 0 | 0 | 0 | 111.4 | L218 L223 Q224 G225 | L218-L221 HydrophobicContact CD2-CD2 4.43Å; L218-L221 PolarHBondContact O-N 2.79Å; L221-L223 PolarHBondContact O-N 3.24Å; L221-Q224 PolarHBondContact O-N 2.62Å; L221-G225 PolarHBondContact O-N 3.09Å |
| 222 | A | 53.8 | Low | 54.6 | Low | 50 Ų | 50 | 109.5 Ų | 109.5 | 41% | 0.413 | 57% | 0.569 | S | S | . | * | H | α-helix | trans | -62.4 | -41.9 | 177.7 | 0 | 0 | 0 | 0 | 0 | 112.5 | L218 H219 G225 | L218-A222 PolarHBondContact O-N 2.97Å; H219-A222 PolarHBondContact O-N 3.26Å; A222-G225 PolarHBondContact O-N 3.04Å |
| 223 | L | 57.6 | Low | 54.2 | Low | 83 Ų | 83 | 105.6 Ų | 105.6 | 44% | 0.435 | 55% | 0.553 | S | S | . | * | H | α-helix | trans | -73.4 | -30 | 177.7 | -68.1 | 179.2 | 0 | 0 | 0 | 113.4 | H219 F220 L221 G225 L226 | H219-L223 WeakPolarHBondContact O-CB 3.37Å; H219-L223 VanDerWaalsContact O-CG 3.31Å; H219-L223 WeakPolarHBondContact O-CG 3.48Å; H219-L223 PolarHBondContact O-N 3.07Å; F220-L223 PolarHBondContact O-N 3.09Å; L221-L223 PolarHBondContact O-N 3.24Å; L223-G225 PolarHBondContact O-N 2.93Å; L223-L226 HydrophobicContact CD2-CD1 3.86Å; L223-L226 PolarHBondContact O-N 2.82Å; L223-L226 VanDerWaalsContact O-N 3.13Å |
| 224 | Q | 56.3 | Low | 54.2 | Low | 129 Ų | 129 | 103.2 Ų | 103.2 | 60% | 0.603 | 56% | 0.559 | S | S | * | * | H | α-helix | trans | -61.8 | -30.1 | 169.7 | -77.9 | 173.5 | 2.7 | 0 | 0 | 111.6 | F220 L221 L226 | F220-Q224 WeakPolarHBondContact O-CB 3.48Å; F220-Q224 VanDerWaalsContact O-CG 3.25Å; F220-Q224 WeakPolarHBondContact O-CG 3.19Å; F220-Q224 PolarHBondContact O-N 2.84Å; L221-Q224 PolarHBondContact O-N 2.62Å; Q224-L226 PolarHBondContact O-N 2.75Å; Q224-L226 VanDerWaalsContact O-N 3.15Å |
| 225 | G | 54 | Low | 53.6 | Low | 23 Ų | 23 | 104.4 Ų | 104.4 | 24% | 0.237 | 56% | 0.563 | C | S | . | * | T | Hydrogen-bonded Turn | trans | -71 | 11.2 | 171.3 | 0 | 0 | 0 | 0 | 0 | 116.1 | L221 A222 L223 T232 | L221-G225 PolarHBondContact O-N 3.09Å; A222-G225 PolarHBondContact O-N 3.04Å; L223-G225 PolarHBondContact O-N 2.93Å; G225-T232 VanDerWaalsContact O-CB 3.22Å; G225-T232 WeakPolarHBondContact O-CB 3.46Å; G225-T232 VanDerWaalsContact O-CG2 3.23Å; G225-T232 WeakPolarHBondContact O-CG2 3.49Å |
| 226 | L | 52.8 | Low | 53.1 | Low | 99 Ų | 99 | 107.3 Ų | 107.3 | 52% | 0.518 | 57% | 0.573 | S | S | . | * | T | Hydrogen-bonded Turn | trans | -116.8 | 6.1 | 177.7 | -61.9 | 177.2 | 0 | 0 | 0 | 114.3 | L223 Q224 P228 | L223-L226 HydrophobicContact CD2-CD1 3.86Å; L223-L226 PolarHBondContact O-N 2.82Å; L223-L226 VanDerWaalsContact O-N 3.13Å; Q224-L226 PolarHBondContact O-N 2.75Å; Q224-L226 VanDerWaalsContact O-N 3.15Å; L226-P228 VanDerWaalsContact O-CD 3.31Å; L226-P228 WeakPolarHBondContact O-CD 3.44Å |
| 227 | N | 48.1 | Very low | 52.6 | Low | 72 Ų | 72 | 107.7 Ų | 107.7 | 39% | 0.385 | 57% | 0.567 | S | S | . | * | trans | -86.3 | 110.9 | -179.6 | -170.6 | -40.2 | 0 | 0 | 0 | 111.8 | S229 R230 T232 | N227-S229 PolarHBondContact O-N 3.29Å; N227-S229 PolarHBondContact OD1-N 2.89Å; N227-R230 HydrophobicContact CB-CB 4.43Å; N227-R230 PolarHBondContact O-N 3.04Å; N227-R230 VanDerWaalsContact O-N 3.08Å; N227-T232 VanDerWaalsContact O-CG2 3.31Å; N227-T232 WeakPolarHBondContact O-CG2 3.4Å | ||
| 228 | P | 51.6 | Low | 52.9 | Low | 128 Ų | 128 | 101.8 Ų | 101.8 | 83% | 0.831 | 54% | 0.543 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -64 | -16.7 | -175.7 | -20.3 | 33.6 | 0 | 0 | 0 | 114.4 | L226 | L226-P228 VanDerWaalsContact O-CD 3.31Å; L226-P228 WeakPolarHBondContact O-CD 3.44Å |
| 229 | S | 52.2 | Low | 53.6 | Low | 112 Ų | 112 | 106.4 Ų | 106.4 | 78% | 0.783 | 56% | 0.556 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -99.5 | 3.3 | -179.2 | -53.1 | 0 | 0 | 0 | 0 | 113.7 | N227 | N227-S229 PolarHBondContact O-N 3.29Å; N227-S229 PolarHBondContact OD1-N 2.89Å |
| 230 | R | 50.2 | Low | 54.7 | Low | 198 Ų | 198 | 109.7 Ų | 109.7 | 75% | 0.747 | 57% | 0.571 | S | S | * | * | S | Bend | trans | -133.7 | 95.9 | 171.1 | -69.8 | -172.6 | 179.6 | -132.9 | 0.6 | 109.3 | N227 T232 | N227-R230 HydrophobicContact CB-CB 4.43Å; N227-R230 PolarHBondContact O-N 3.04Å; N227-R230 VanDerWaalsContact O-N 3.08Å; R230-T232 VanDerWaalsContact O-CG2 3.28Å; R230-T232 WeakPolarHBondContact O-CG2 3.31Å; R230-T232 PolarHBondContact O-N 2.85Å |
| 231 | H | 45.2 | Very low | 55.8 | Low | 179 Ų | 179 | 106.7 Ų | 106.7 | 83% | 0.829 | 56% | 0.559 | S | S | * | * | trans | -8.9 | 92.2 | 171.4 | -95.8 | -107.2 | 0 | 0 | 0 | 114.1 | S233 | H231-S233 PolarHBondContact O-N 3.34Š| ||
| 232 | T | 44.7 | Very low | 56.5 | Low | 72 Ų | 72 | 105.5 Ų | 105.5 | 44% | 0.442 | 55% | 0.553 | S | S | . | * | trans | -84.5 | 51.5 | -178.3 | 61.6 | 0 | 0 | 0 | 0 | 110.4 | G225 N227 R230 A234 | G225-T232 VanDerWaalsContact O-CB 3.22Å; G225-T232 WeakPolarHBondContact O-CB 3.46Å; G225-T232 VanDerWaalsContact O-CG2 3.23Å; G225-T232 WeakPolarHBondContact O-CG2 3.49Å; N227-T232 VanDerWaalsContact O-CG2 3.31Å; N227-T232 WeakPolarHBondContact O-CG2 3.4Å; R230-T232 VanDerWaalsContact O-CG2 3.28Å; R230-T232 WeakPolarHBondContact O-CG2 3.31Å; R230-T232 PolarHBondContact O-N 2.85Å; T232-A234 VanDerWaalsContact C-N 3.26Å | ||
| 233 | S | 46.5 | Very low | 57.6 | Low | 59 Ų | 59 | 106.2 Ų | 106.2 | 41% | 0.413 | 55% | 0.55 | S | S | . | . | trans | -81.1 | -3.8 | 173.1 | 44.8 | 0 | 0 | 0 | 0 | 112.9 | H231 V235 R236 E237 | H231-S233 PolarHBondContact O-N 3.34Å; S233-V235 PolarHBondContact O-N 3.37Å; S233-R236 CarbonylContact O-C 3.4Å; S233-R236 PolarHBondContact O-N 2.93Å; S233-E237 PolarHBondContact O-N 3.24Å | ||
| 234 | A | 51.9 | Low | 58.7 | Low | 74 Ų | 74 | 107.3 Ų | 107.3 | 61% | 0.612 | 55% | 0.553 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -61.7 | 3.5 | -169.5 | 0 | 0 | 0 | 0 | 0 | 117.9 | T232 | T232-A234 VanDerWaalsContact C-N 3.26Š|
| 235 | V | 50.3 | Low | 59.6 | Low | 127 Ų | 127 | 104.6 Ų | 104.6 | 77% | 0.77 | 54% | 0.542 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -121.6 | -5.7 | 173.6 | -171.1 | 0 | 0 | 0 | 0 | 111.3 | S233 | S233-V235 PolarHBondContact O-N 3.37Š|
| 236 | R | 48.7 | Very low | 60.7 | Low | 196 Ų | 196 | 109.8 Ų | 109.8 | 74% | 0.74 | 56% | 0.56 | S | S | * | * | trans | -144.8 | 45.3 | -175.4 | -149.5 | -176.3 | 104.6 | 140.8 | 9.1 | 111.4 | S233 S238 | S233-R236 CarbonylContact O-C 3.4Å; S233-R236 PolarHBondContact O-N 2.93Å; R236-S238 VanDerWaalsContact C-N 3.34Å; R236-S238 PolarHBondContact O-N 3.08Å | ||
| 237 | E | 51.6 | Low | 61.9 | Low | 107 Ų | 107 | 111.7 Ų | 111.7 | 50% | 0.5 | 57% | 0.571 | S | S | . | * | trans | -45.3 | 110 | 144.6 | -64.7 | 177.8 | 164.6 | 0 | 0 | 105.3 | S233 E241 L242 | S233-E237 PolarHBondContact O-N 3.24Å; E237-E241 WeakPolarHBondContact CA-OE2 3.28Å; E237-L242 HydrophobicContact CB-CG 4.35Å | ||
| 238 | S | 62.9 | Low | 63.2 | Low | 31 Ų | 31 | 118.2 Ų | 118.2 | 22% | 0.217 | 59% | 0.59 | C | S | . | * | trans | -64.6 | 154.3 | -176.5 | 67 | 0 | 0 | 0 | 0 | 108.2 | R236 E240 E241 L242 | R236-S238 VanDerWaalsContact C-N 3.34Å; R236-S238 PolarHBondContact O-N 3.08Å; S238-E240 PolarHBondContact O-N 2.92Å; S238-E241 WeakPolarHBondContact O-CA 3.22Å; S238-E241 PolarHBondContact O-N 3.38Å; S238-E241 PolarHBondContact OG-N 3.49Å; S238-L242 PolarHBondContact O-N 3.48Å | ||
| 239 | Y | 76.5 | Confident | 64.1 | Low | 174 Ų | 174 | 117.5 Ų | 117.5 | 68% | 0.682 | 58% | 0.578 | S | S | * | * | H | α-helix | trans | -50.8 | -33.6 | 171.4 | 172.5 | -97.2 | 0 | 0 | 0 | 111.2 | L242 L243 | Y239-L242 PolarHBondContact O-N 3.2Å; Y239-L243 HydrophobicContact CD1-CD1 4.14Å; Y239-L243 HydrophobicContact CD1-CD2 4.42Å; Y239-L243 HydrophobicContact CD2-CD1 4.08Å; Y239-L243 HydrophobicContact CE1-CD1 3.7Å; Y239-L243 HydrophobicContact CE1-CD2 3.7Å; Y239-L243 HydrophobicContact CE1-CG 4.36Å; Y239-L243 HydrophobicContact CE2-CD1 3.64Å; Y239-L243 HydrophobicContact CG-CD1 4.32Å; Y239-L243 VanDerWaalsContact CZ-CD1 3.43Å; Y239-L243 WeakPolarHBondContact O-CD1 3.3Å; Y239-L243 PolarHBondContact O-N 2.94Å |
| 240 | E | 80.6 | Confident | 64.7 | Low | 130 Ų | 130 | 114.1 Ų | 114.1 | 61% | 0.607 | 56% | 0.561 | S | S | * | * | H | α-helix | trans | -66.8 | -41 | 173 | -54.7 | 175.5 | 143.9 | 0 | 0 | 113.6 | S238 L242 L243 Q244 | S238-E240 PolarHBondContact O-N 2.92Å; E240-L242 VanDerWaalsContact C-N 3.33Å; E240-L243 PolarHBondContact O-N 2.75Å; E240-Q244 WeakPolarHBondContact O-CB 3.48Å; E240-Q244 VanDerWaalsContact O-CD 3.31Å; E240-Q244 WeakPolarHBondContact O-CG 3.23Å; E240-Q244 PolarHBondContact O-N 2.79Å; E240-Q244 PolarHBondContact O-NE2 2.85Å |
| 241 | E | 76.8 | Confident | 65.3 | Low | 87 Ų | 87 | 112.1 Ų | 112.1 | 41% | 0.407 | 57% | 0.566 | S | S | . | * | H | α-helix | trans | -65 | -37 | 173.3 | -76.4 | 178.7 | 171.5 | 0 | 0 | 111.4 | E237 S238 Q244 L245 | E237-E241 WeakPolarHBondContact CA-OE2 3.28Å; S238-E241 WeakPolarHBondContact O-CA 3.22Å; S238-E241 PolarHBondContact O-N 3.38Å; S238-E241 PolarHBondContact OG-N 3.49Å; E241-Q244 PolarHBondContact O-N 3.39Å; E241-L245 WeakPolarHBondContact O-CB 3.49Å; E241-L245 WeakPolarHBondContact O-CG 3.46Å; E241-L245 PolarHBondContact O-N 2.91Å |
| 242 | L | 74.6 | Confident | 66.3 | Low | 85 Ų | 85 | 106.8 Ų | 106.8 | 45% | 0.445 | 55% | 0.545 | S | S | . | . | H | α-helix | trans | -66 | -41.6 | 173.8 | -71.5 | 172.5 | 0 | 0 | 0 | 112.3 | E237 S238 Y239 E240 L245 E246 | E237-L242 HydrophobicContact CB-CG 4.35Å; S238-L242 PolarHBondContact O-N 3.48Å; Y239-L242 PolarHBondContact O-N 3.2Å; E240-L242 VanDerWaalsContact C-N 3.33Å; L242-L245 HydrophobicContact CD2-CD1 4.49Å; L242-L245 WeakPolarHBondContact O-CB 3.44Å; L242-L245 PolarHBondContact O-N 3.46Å; L242-E246 PolarHBondContact O-N 2.84Å |
| 243 | L | 77.4 | Confident | 67.2 | Low | 66 Ų | 66 | 108.5 Ų | 108.5 | 35% | 0.346 | 56% | 0.556 | S | S | . | * | H | α-helix | trans | -63.9 | -44.2 | 172.4 | -98.8 | 63.5 | 0 | 0 | 0 | 111.7 | Y239 E240 L245 E246 D247 | Y239-L243 HydrophobicContact CD1-CD1 4.14Å; Y239-L243 HydrophobicContact CD1-CD2 4.42Å; Y239-L243 HydrophobicContact CD2-CD1 4.08Å; Y239-L243 HydrophobicContact CE1-CD1 3.7Å; Y239-L243 HydrophobicContact CE1-CD2 3.7Å; Y239-L243 HydrophobicContact CE1-CG 4.36Å; Y239-L243 HydrophobicContact CE2-CD1 3.64Å; Y239-L243 HydrophobicContact CG-CD1 4.32Å; Y239-L243 VanDerWaalsContact CZ-CD1 3.43Å; Y239-L243 WeakPolarHBondContact O-CD1 3.3Å; Y239-L243 PolarHBondContact O-N 2.94Å; E240-L243 PolarHBondContact O-N 2.75Å; L243-L245 PolarHBondContact O-N 2.83Å; L243-E246 WeakPolarHBondContact O-CB 3.32Å; L243-E246 PolarHBondContact O-N 2.9Å; L243-E246 VanDerWaalsContact O-N 3.09Å; L243-D247 PolarHBondContact O-N 3.5Å |
| 244 | Q | 81 | Confident | 68.9 | Low | 106 Ų | 106 | 113.7 Ų | 113.7 | 50% | 0.495 | 57% | 0.566 | S | S | . | * | H | α-helix | trans | -64.1 | -29.5 | 175.7 | -70.6 | 161.6 | 35.8 | 0 | 0 | 112.2 | E240 E241 R248 | E240-Q244 WeakPolarHBondContact O-CB 3.48Å; E240-Q244 VanDerWaalsContact O-CD 3.31Å; E240-Q244 WeakPolarHBondContact O-CG 3.23Å; E240-Q244 PolarHBondContact O-N 2.79Å; E240-Q244 PolarHBondContact O-NE2 2.85Å; E241-Q244 PolarHBondContact O-N 3.39Å; Q244-R248 WeakPolarHBondContact O-CB 3.42Å; Q244-R248 WeakPolarHBondContact O-CD 3.47Å; Q244-R248 WeakPolarHBondContact O-CG 3.35Å; Q244-R248 PolarHBondContact O-N 3.18Å |
| 245 | L | 75 | Confident | 70.7 | Confident | 72 Ų | 72 | 111 Ų | 111 | 38% | 0.377 | 55% | 0.546 | S | S | . | . | H | α-helix | trans | -71.8 | -39.8 | 171.1 | -75.5 | 167.2 | 0 | 0 | 0 | 111.6 | E241 L242 L243 R248 L249 | E241-L245 WeakPolarHBondContact O-CB 3.49Å; E241-L245 WeakPolarHBondContact O-CG 3.46Å; E241-L245 PolarHBondContact O-N 2.91Å; L242-L245 HydrophobicContact CD2-CD1 4.49Å; L242-L245 WeakPolarHBondContact O-CB 3.44Å; L242-L245 PolarHBondContact O-N 3.46Å; L243-L245 PolarHBondContact O-N 2.83Å; L245-R248 PolarHBondContact O-N 3.26Å; L245-L249 VanDerWaalsContact O-CB 3.22Å; L245-L249 WeakPolarHBondContact O-CB 3.38Å; L245-L249 WeakPolarHBondContact O-CD1 3.5Å; L245-L249 WeakPolarHBondContact O-CG 3.49Å; L245-L249 PolarHBondContact O-N 2.98Å |
| 246 | E | 77 | Confident | 72.6 | Confident | 132 Ų | 132 | 105.4 Ų | 105.4 | 62% | 0.617 | 51% | 0.513 | S | S | * | . | H | α-helix | trans | -61.3 | -49.6 | 172.9 | -174.9 | 166.4 | -152.4 | 0 | 0 | 111.4 | L242 L243 R248 L249 G250 | L242-E246 PolarHBondContact O-N 2.84Å; L243-E246 WeakPolarHBondContact O-CB 3.32Å; L243-E246 PolarHBondContact O-N 2.9Å; L243-E246 VanDerWaalsContact O-N 3.09Å; E246-R248 PolarHBondContact O-N 3.29Å; E246-L249 PolarHBondContact O-N 3.32Å; E246-G250 WeakPolarHBondContact O-CA 3.49Å; E246-G250 PolarHBondContact O-N 3.49Å |
| 247 | D | 77.5 | Confident | 74.7 | Confident | 138 Ų | 138 | 101 Ų | 101 | 74% | 0.738 | 51% | 0.508 | S | S | * | . | H | α-helix | trans | -60.2 | -40.6 | 176.4 | -78.7 | -27.4 | 0 | 0 | 0 | 112.7 | L243 | L243-D247 PolarHBondContact O-N 3.5Å |
| 248 | R | 75.6 | Confident | 76.7 | Confident | 209 Ų | 209 | 100 Ų | 100 | 79% | 0.789 | 50% | 0.503 | S | S | * | . | H | α-helix | trans | -77.2 | -30.1 | -178.8 | -75.4 | 177.5 | 66.9 | -157.8 | -0.9 | 113.9 | Q244 L245 E246 | Q244-R248 WeakPolarHBondContact O-CB 3.42Å; Q244-R248 WeakPolarHBondContact O-CD 3.47Å; Q244-R248 WeakPolarHBondContact O-CG 3.35Å; Q244-R248 PolarHBondContact O-N 3.18Å; L245-R248 PolarHBondContact O-N 3.26Å; E246-R248 PolarHBondContact O-N 3.29Å |
| 249 | L | 71 | Confident | 78.2 | Confident | 113 Ų | 113 | 102.7 Ų | 102.7 | 59% | 0.592 | 52% | 0.515 | S | S | * | . | H | α-helix | trans | -82.6 | -31.3 | 174.7 | -69.5 | 169 | 0 | 0 | 0 | 111 | L245 E246 V252 | L245-L249 VanDerWaalsContact O-CB 3.22Å; L245-L249 WeakPolarHBondContact O-CB 3.38Å; L245-L249 WeakPolarHBondContact O-CD1 3.5Å; L245-L249 WeakPolarHBondContact O-CG 3.49Å; L245-L249 PolarHBondContact O-N 2.98Å; E246-L249 PolarHBondContact O-N 3.32Å; L249-V252 HydrophobicContact CB-CG2 4.03Å; L249-V252 WeakPolarHBondContact O-CG2 3.48Å |
| 250 | G | 64.1 | Low | 79.1 | Confident | 41 Ų | 41 | 95.3 Ų | 95.3 | 42% | 0.423 | 49% | 0.488 | S | S | . | . | trans | 61.7 | -172.5 | -168.7 | 0 | 0 | 0 | 0 | 0 | 112.6 | E246 V252 | E246-G250 WeakPolarHBondContact O-CA 3.49Å; E246-G250 PolarHBondContact O-N 3.49Å; G250-V252 PolarHBondContact O-N 3.47Å | ||
| 251 | N | 63.6 | Low | 79.8 | Confident | 157 Ų | 157 | 89.1 Ų | 89.1 | 84% | 0.84 | 46% | 0.459 | S | S | * | . | trans | -67.5 | 82.2 | 168.2 | -79.7 | 94.7 | 0 | 0 | 0 | 110.7 | T253 | N251-T253 VanDerWaalsContact C-N 3.28Å; N251-T253 PolarHBondContact O-N 3.36Å | ||
| 252 | V | 65 | Low | 80.7 | Confident | 67 Ų | 67 | 89.9 Ų | 89.9 | 41% | 0.406 | 46% | 0.462 | S | S | . | . | trans | -69.4 | 86.8 | 171.5 | -170.3 | 0 | 0 | 0 | 0 | 109.2 | L249 G250 R254 | L249-V252 HydrophobicContact CB-CG2 4.03Å; L249-V252 WeakPolarHBondContact O-CG2 3.48Å; G250-V252 PolarHBondContact O-N 3.47Å; V252-R254 HydrophobicContact CG1-CG 3.89Å; V252-R254 PolarHBondContact O-N 3.06Å | ||
| 253 | T | 64.2 | Low | 81.6 | Confident | 107 Ų | 107 | 93.9 Ų | 93.9 | 66% | 0.656 | 47% | 0.472 | S | S | * | . | trans | -65.4 | 93.3 | 171.7 | 43.7 | 0 | 0 | 0 | 0 | 109.7 | N251 G255 | N251-T253 VanDerWaalsContact C-N 3.28Å; N251-T253 PolarHBondContact O-N 3.36Å; T253-G255 PolarHBondContact O-N 3.01Å; T253-G255 VanDerWaalsContact O-N 3.08Å | ||
| 254 | R | 82.2 | Confident | 82.4 | Confident | 169 Ų | 169 | 94 Ų | 94 | 64% | 0.638 | 47% | 0.47 | S | S | * | . | B | Isolated β-bridge | trans | -82.3 | 34 | 174.1 | -64.1 | -175.4 | 174.9 | 82.4 | -4.6 | 111.6 | V252 M327 S328 K329 | V252-R254 HydrophobicContact CG1-CG 3.89Å; V252-R254 PolarHBondContact O-N 3.06Å; R254-M327 CarbonylContact C-O 3.51Å; R254-M327 PolarHBondContact N-O 3Å; R254-S328 WeakPolarHBondContact O-CA 3.13Å; R254-K329 WeakPolarHBondContact O-CG 3.23Å; R254-K329 PolarHBondContact O-N 3.24Å |
| 255 | G | 89.6 | Confident | 83.1 | Confident | 18 Ų | 18 | 89.8 Ų | 89.8 | 19% | 0.186 | 45% | 0.451 | C | S | . | . | P | Polyproline II helix | trans | -84 | 173.8 | -179.2 | 0 | 0 | 0 | 0 | 0 | 113.3 | T253 L325 M327 K329 | T253-G255 PolarHBondContact O-N 3.01Å; T253-G255 VanDerWaalsContact O-N 3.08Å; G255-L325 CarbonylContact C-O 3.58Å; G255-L325 WeakPolarHBondContact CA-O 3.16Å; G255-M327 PolarHBondContact N-O 2.76Å; G255-K329 WeakPolarHBondContact O-CE 3.37Å |
| 256 | A | 90.7 | Very high | 84.1 | Confident | 9 Ų | 9 | 92.8 Ų | 92.8 | 7% | 0.074 | 46% | 0.461 | C | S | . | . | P | Polyproline II helix | trans | -96.6 | 144.2 | 166.7 | 0 | 0 | 0 | 0 | 0 | 110.2 | T260 I261 L325 K329 I338 | A256-T260 HydrophobicContact CB-CG2 3.72Å; A256-I261 HydrophobicContact CB-CD1 4.4Å; A256-I261 HydrophobicContact CB-CG1 3.6Å; A256-L325 PolarHBondContact N-O 3.17Å; A256-K329 HydrophobicContact CB-CG 3.95Å; A256-I338 HydrophobicContact CB-CD1 3.91Å |
| 257 | V | 92.4 | Very high | 85 | Confident | 103 Ų | 103 | 89.1 Ų | 89.1 | 62% | 0.624 | 45% | 0.449 | S | S | * | . | P | Polyproline II helix | trans | -67.7 | 150.4 | 162.7 | -65 | 0 | 0 | 0 | 0 | 109.5 | N259 T260 I261 | V257-N259 VanDerWaalsContact C-N 3.26Å; V257-N259 PolarHBondContact O-N 2.99Å; V257-N259 VanDerWaalsContact O-N 3.1Å; V257-T260 WeakPolarHBondContact CG2-OG1 3.45Å; V257-T260 WeakPolarHBondContact O-CA 3.41Å; V257-T260 VanDerWaalsContact O-CB 3.27Å; V257-T260 WeakPolarHBondContact O-CB 3.39Å; V257-T260 PolarHBondContact O-N 2.8Å; V257-I261 PolarHBondContact O-N 2.73Å; V257-I261 VanDerWaalsContact O-N 3.08Å |
| 258 | Q | 93.9 | Very high | 85.9 | Confident | 85 Ų | 85 | 85 Ų | 85 | 40% | 0.397 | 43% | 0.425 | S | S | . | . | H | α-helix | trans | -50.2 | -42.7 | -174.3 | -174.8 | 63.3 | 18.5 | 0 | 0 | 113.8 | T260 I261 E262 D322 | Q258-T260 VanDerWaalsContact C-N 3.29Å; Q258-T260 PolarHBondContact O-N 2.94Å; Q258-I261 WeakPolarHBondContact O-CA 3.49Å; Q258-I261 WeakPolarHBondContact O-CB 3.43Å; Q258-I261 PolarHBondContact O-N 2.97Å; Q258-E262 WeakPolarHBondContact CG-OE1 3.44Å; Q258-E262 PolarHBondContact NE2-OE1 3.22Å; Q258-E262 WeakPolarHBondContact O-CG 3.49Å; Q258-E262 PolarHBondContact O-N 2.84Å; Q258-D322 PolarHBondContact NE2-OD2 3.38Å |
| 259 | N | 94.3 | Very high | 86.9 | Confident | 88 Ų | 88 | 80.6 Ų | 80.6 | 47% | 0.471 | 41% | 0.411 | S | S | . | . | H | α-helix | trans | -65.5 | -28.6 | 178.2 | -172.1 | -24.3 | 0 | 0 | 0 | 112.9 | V257 R263 | V257-N259 VanDerWaalsContact C-N 3.26Å; V257-N259 PolarHBondContact O-N 2.99Å; V257-N259 VanDerWaalsContact O-N 3.1Å; N259-R263 PolarHBondContact ND2-NH2 2.93Å; N259-R263 WeakPolarHBondContact O-CB 3.21Å; N259-R263 WeakPolarHBondContact O-CG 3.13Å; N259-R263 PolarHBondContact O-N 3.37Å; N259-R263 VanDerWaalsContact O-N 3.15Å; N259-R263 PolarHBondContact O-NE 2.89Å; N259-R263 VanDerWaalsContact OD1-CZ 3.25Å; N259-R263 PolarHBondContact OD1-NE 3.43Å; N259-R263 PolarHBondContact OD1-NH2 3.43Å |
| 260 | T | 94 | Very high | 88.1 | Confident | 19 Ų | 19 | 75.8 Ų | 75.8 | 12% | 0.117 | 39% | 0.386 | C | S | . | . | H | α-helix | trans | -71.5 | -44.2 | 169.1 | -66.4 | 0 | 0 | 0 | 0 | 110.4 | A256 V257 Q258 E262 R263 F264 E339 | A256-T260 HydrophobicContact CB-CG2 3.72Å; V257-T260 WeakPolarHBondContact CG2-OG1 3.45Å; V257-T260 WeakPolarHBondContact O-CA 3.41Å; V257-T260 VanDerWaalsContact O-CB 3.27Å; V257-T260 WeakPolarHBondContact O-CB 3.39Å; V257-T260 PolarHBondContact O-N 2.8Å; Q258-T260 VanDerWaalsContact C-N 3.29Å; Q258-T260 PolarHBondContact O-N 2.94Å; T260-E262 VanDerWaalsContact C-N 3.32Å; T260-E262 PolarHBondContact O-N 3.47Å; T260-R263 PolarHBondContact O-N 3.09Å; T260-F264 HydrophobicContact CG2-CD2 3.73Å; T260-F264 HydrophobicContact CG2-CE2 4.1Å; T260-F264 WeakPolarHBondContact O-CD2 3.21Å; T260-F264 PolarHBondContact O-N 3.13Å; T260-F264 VanDerWaalsContact O-N 3.08Å; T260-E339 HydrophobicContact CG2-CG 4.27Å; T260-E339 WeakPolarHBondContact CG2-OE1 3.23Å |
| 261 | I | 95.6 | Very high | 89.4 | Confident | 1 Ų | 1 | 82.1 Ų | 82.1 | 1% | 0.005 | 40% | 0.401 | C | S | . | . | H | α-helix | trans | -55.7 | -49.7 | 175.9 | -57.5 | 173.5 | 0 | 0 | 0 | 109.9 | A256 V257 Q258 R263 F264 T265 L325 I338 | A256-I261 HydrophobicContact CB-CD1 4.4Å; A256-I261 HydrophobicContact CB-CG1 3.6Å; V257-I261 PolarHBondContact O-N 2.73Å; V257-I261 VanDerWaalsContact O-N 3.08Å; Q258-I261 WeakPolarHBondContact O-CA 3.49Å; Q258-I261 WeakPolarHBondContact O-CB 3.43Å; Q258-I261 PolarHBondContact O-N 2.97Å; I261-R263 VanDerWaalsContact C-N 3.34Å; I261-R263 PolarHBondContact O-N 2.85Å; I261-F264 PolarHBondContact O-N 2.96Å; I261-T265 HydrophobicContact CG2-CG2 4.37Å; I261-T265 WeakPolarHBondContact O-CB 3.19Å; I261-T265 WeakPolarHBondContact O-CG2 3.31Å; I261-T265 PolarHBondContact O-N 3.34Å; I261-T265 VanDerWaalsContact O-N 3.09Å; I261-T265 PolarHBondContact O-OG1 3.39Å; I261-L325 HydrophobicContact CD1-CB 3.64Å; I261-L325 HydrophobicContact CG1-CB 3.95Å; I261-L325 HydrophobicContact CG1-CD1 4.45Å; I261-L325 HydrophobicContact CG2-CD1 3.75Å; I261-I338 HydrophobicContact CG1-CD1 4.44Å |
| 262 | E | 95.4 | Very high | 90.6 | Very high | 102 Ų | 102 | 77.3 Ų | 77.3 | 48% | 0.477 | 37% | 0.373 | S | S | . | . | H | α-helix | trans | -64.1 | -32.6 | 179.8 | -72.5 | 167 | -173.3 | 0 | 0 | 114 | Q258 T260 | Q258-E262 WeakPolarHBondContact CG-OE1 3.44Å; Q258-E262 PolarHBondContact NE2-OE1 3.22Å; Q258-E262 WeakPolarHBondContact O-CG 3.49Å; Q258-E262 PolarHBondContact O-N 2.84Å; T260-E262 VanDerWaalsContact C-N 3.32Å; T260-E262 PolarHBondContact O-N 3.47Å |
| 263 | R | 94.6 | Very high | 91.5 | Very high | 170 Ų | 170 | 85.1 Ų | 85.1 | 64% | 0.642 | 40% | 0.395 | S | S | * | . | H | α-helix | trans | -73.2 | -33.7 | 175.9 | -84.9 | -177.4 | -101.5 | 172.1 | -11.7 | 114 | N259 T260 I261 | N259-R263 PolarHBondContact ND2-NH2 2.93Å; N259-R263 WeakPolarHBondContact O-CB 3.21Å; N259-R263 WeakPolarHBondContact O-CG 3.13Å; N259-R263 PolarHBondContact O-N 3.37Å; N259-R263 VanDerWaalsContact O-N 3.15Å; N259-R263 PolarHBondContact O-NE 2.89Å; N259-R263 VanDerWaalsContact OD1-CZ 3.25Å; N259-R263 PolarHBondContact OD1-NE 3.43Å; N259-R263 PolarHBondContact OD1-NH2 3.43Å; T260-R263 PolarHBondContact O-N 3.09Å; I261-R263 VanDerWaalsContact C-N 3.34Å; I261-R263 PolarHBondContact O-N 2.85Å |
| 264 | F | 94.4 | Very high | 92 | Very high | 69 Ų | 69 | 88.5 Ų | 88.5 | 30% | 0.303 | 40% | 0.396 | S | S | . | . | H | α-helix | trans | -106.4 | 5.2 | -171 | -74.8 | -75.2 | 0 | 0 | 0 | 114.1 | T260 I261 P311 I338 E339 | T260-F264 HydrophobicContact CG2-CD2 3.73Å; T260-F264 HydrophobicContact CG2-CE2 4.1Å; T260-F264 WeakPolarHBondContact O-CD2 3.21Å; T260-F264 PolarHBondContact O-N 3.13Å; T260-F264 VanDerWaalsContact O-N 3.08Å; I261-F264 PolarHBondContact O-N 2.96Å; F264-P311 VanDerWaalsContact O-CD 3.28Å; F264-P311 WeakPolarHBondContact O-CD 3.17Å; F264-P311 WeakPolarHBondContact O-CG 3.44Å; F264-I338 HydrophobicContact CB-CB 4.27Å; F264-I338 HydrophobicContact CB-CD1 4.45Å; F264-I338 HydrophobicContact CB-CG1 4.35Å; F264-I338 WeakPolarHBondContact CB-O 3.4Å; F264-I338 WeakPolarHBondContact CD1-O 3.22Å; F264-E339 HydrophobicContact CD2-CG 4Å; F264-E339 HydrophobicContact CE1-CB 4.48Å; F264-E339 HydrophobicContact CE2-CG 3.93Å; F264-E339 HydrophobicContact CG-CG 4.36Å; F264-E339 HydrophobicContact CZ-CB 4.46Å; F264-E339 HydrophobicContact CZ-CG 4.22Å |
| 265 | T | 94.9 | Very high | 91.4 | Very high | 16 Ų | 16 | 86.2 Ų | 86.2 | 10% | 0.098 | 40% | 0.403 | C | S | . | . | S | Bend | trans | -140.9 | 163.6 | -179.4 | 68.2 | 0 | 0 | 0 | 0 | 111.2 | I261 P267 R308 L310 L325 I338 | I261-T265 HydrophobicContact CG2-CG2 4.37Å; I261-T265 WeakPolarHBondContact O-CB 3.19Å; I261-T265 WeakPolarHBondContact O-CG2 3.31Å; I261-T265 PolarHBondContact O-N 3.34Å; I261-T265 VanDerWaalsContact O-N 3.09Å; I261-T265 PolarHBondContact O-OG1 3.39Å; T265-P267 WeakPolarHBondContact O-CD 3.12Å; T265-R308 WeakPolarHBondContact OG1-CD 3.34Å; T265-R308 WeakPolarHBondContact OG1-CG 3.11Å; T265-R308 PolarHBondContact OG1-NH1 3.43Å; T265-L310 HydrophobicContact CG2-CD1 4.15Å; T265-L310 HydrophobicContact CG2-CG 4.12Å; T265-L325 HydrophobicContact CG2-CD1 4.25Å; T265-I338 HydrophobicContact CG2-CB 4.36Å; T265-I338 HydrophobicContact CG2-CG2 4.1Å |
| 266 | F | 95.6 | Very high | 90.2 | Very high | 136 Ų | 136 | 94.3 Ų | 94.3 | 60% | 0.596 | 44% | 0.436 | S | S | * | . | E | Extended strand (participates in β ladder) | trans | -114.9 | 94.8 | -174.5 | -171.7 | -104.4 | 0 | 0 | 0 | 112.2 | H268 R308 R309 | F266-H268 HydrophobicContact CD1-CB 4.22Å; F266-H268 AromaticContact CD1-ND1 3.59Å; F266-H268 HydrophobicContact CE1-CB 3.74Å; F266-H268 AromaticContact CE1-CG 3.82Å; F266-H268 AromaticContact CE1-ND1 3.89Å; F266-H268 HydrophobicContact CZ-CB 4.46Å; F266-H268 PolarHBondContact O-ND1 3.27Å; F266-R308 WeakPolarHBondContact O-CA 3.49Å; F266-R309 PolarHBondContact N-O 3.45Å; F266-R309 PolarHBondContact O-N 2.74Å |
| 267 | P | 96.7 | Very high | 88.6 | Confident | 55 Ų | 55 | 102 Ų | 102 | 36% | 0.357 | 48% | 0.476 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -74.4 | 135.3 | 171.5 | 31.5 | -31.8 | 0 | 0 | 0 | 110.4 | T265 V307 | T265-P267 WeakPolarHBondContact O-CD 3.12Å; P267-V307 CarbonylContact C-O 3.5Å; P267-V307 WeakPolarHBondContact CA-O 3.47Å |
| 268 | H | 96.2 | Very high | 86.9 | Confident | 52 Ų | 52 | 100.3 Ų | 100.3 | 24% | 0.241 | 48% | 0.48 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -158.6 | 169.8 | 177.4 | 62.3 | -66 | 0 | 0 | 0 | 111.3 | F266 V307 L315 | F266-H268 HydrophobicContact CD1-CB 4.22Å; F266-H268 AromaticContact CD1-ND1 3.59Å; F266-H268 HydrophobicContact CE1-CB 3.74Å; F266-H268 AromaticContact CE1-CG 3.82Å; F266-H268 AromaticContact CE1-ND1 3.89Å; F266-H268 HydrophobicContact CZ-CB 4.46Å; F266-H268 PolarHBondContact O-ND1 3.27Å; H268-V307 PolarHBondContact N-O 2.75Å; H268-V307 VanDerWaalsContact O-CG2 3.27Å; H268-V307 WeakPolarHBondContact O-CG2 3.21Å; H268-V307 PolarHBondContact O-N 3.48Å; H268-L315 VanDerWaalsContact CE1-CD1 3.5Å; H268-L315 WeakPolarHBondContact CE1-CD1 3.49Å |
| 269 | K | 96.4 | Very high | 84.8 | Confident | 115 Ų | 115 | 107 Ų | 107 | 50% | 0.5 | 51% | 0.507 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -80 | 129.5 | 170.9 | -68.9 | -66.3 | -171.8 | -177.9 | 0 | 110.6 | G304 E305 D306 | K269-G304 VanDerWaalsContact CD-O 3.24Å; K269-G304 WeakPolarHBondContact CD-O 3.37Å; K269-G304 PolarHBondContact NZ-O 3.35Å; K269-G304 VanDerWaalsContact NZ-O 3.13Å; K269-E305 WeakPolarHBondContact CA-O 3.39Å; K269-D306 WeakPolarHBondContact CD-OD1 3.46Å; K269-D306 WeakPolarHBondContact CE-OD1 3.29Å; K269-D306 IonicContact NZ-OD1 3.63Å; K269-D306 PolarHBondContact NZ-OD1 3.19Å; K269-D306 IonicContact NZ-OD2 2.62Å; K269-D306 PolarHBondContact NZ-OD2 2.81Å |
| 270 | Y | 95.6 | Very high | 82.8 | Confident | 13 Ų | 13 | 106 Ų | 106 | 5% | 0.051 | 52% | 0.518 | C | S | . | . | trans | -66.6 | 144.3 | 176.3 | -175.9 | -113.7 | 0 | 0 | 0 | 110.5 | K272 E292 L301 E302 G304 E305 V307 L315 | Y270-K272 HydrophobicContact CE1-CB 4.03Å; Y270-E292 HydrophobicContact CE2-CB 4.26Å; Y270-E292 HydrophobicContact CE2-CG 4.47Å; Y270-L301 HydrophobicContact CD1-CB 3.83Å; Y270-L301 HydrophobicContact CD2-CB 4.35Å; Y270-L301 HydrophobicContact CD2-CD1 4.36Å; Y270-L301 HydrophobicContact CE1-CB 3.75Å; Y270-L301 WeakPolarHBondContact CE1-O 3.32Å; Y270-L301 HydrophobicContact CE2-CB 4.29Å; Y270-L301 HydrophobicContact CE2-CD1 4.29Å; Y270-L301 HydrophobicContact CG-CB 4.12Å; Y270-E302 WeakPolarHBondContact CD1-O 3.28Å; Y270-G304 PolarHBondContact O-N 3.35Å; Y270-E305 PolarHBondContact N-O 2.96Å; Y270-V307 HydrophobicContact CD2-CG2 4.43Å; Y270-V307 HydrophobicContact CG-CG1 4.49Å; Y270-L315 HydrophobicContact CD2-CD2 3.73Å; Y270-L315 HydrophobicContact CE2-CD2 3.92Å | ||
| 271 | K | 92.6 | Very high | 80.9 | Confident | 173 Ų | 173 | 114.9 Ų | 114.9 | 75% | 0.752 | 56% | 0.555 | S | S | * | * | trans | -142.6 | 106.8 | 174.4 | -174.5 | 167.2 | -176.2 | 169.1 | 0 | 109.6 | R273 D303 | K271-R273 PolarHBondContact O-N 3.31Å; K271-D303 WeakPolarHBondContact CA-OD1 3.49Å | ||
| 272 | K | 87.6 | Confident | 78.6 | Confident | 56 Ų | 56 | 123.9 Ų | 123.9 | 24% | 0.243 | 59% | 0.594 | C | S | . | * | trans | -58.1 | 128.6 | 177.1 | -171.1 | 168.9 | -176.2 | 168.2 | 0 | 109.3 | Y270 R274 D291 D303 | Y270-K272 HydrophobicContact CE1-CB 4.03Å; K272-R274 PolarHBondContact O-N 2.98Å; K272-D291 WeakPolarHBondContact CE-OD1 3.47Å; K272-D291 IonicContact NZ-OD1 3.7Å; K272-D291 PolarHBondContact NZ-OD1 3.32Å; K272-D291 IonicContact NZ-OD2 3.76Å; K272-D291 PolarHBondContact NZ-OD2 2.79Å; K272-D303 WeakPolarHBondContact CB-OD1 3.13Å; K272-D303 PolarHBondContact N-OD1 3.38Å | ||
| 273 | R | 84 | Confident | 76.6 | Confident | 232 Ų | 232 | 126.9 Ų | 126.9 | 88% | 0.875 | 61% | 0.614 | S | S | * | * | trans | -69.7 | 96.2 | 175.8 | -77.6 | -175 | 158.6 | -160 | -5.7 | 109.7 | K271 P275 | K271-R273 PolarHBondContact O-N 3.31Å; R273-P275 WeakPolarHBondContact O-CD 3.38Å | ||
| 274 | R | 74.5 | Confident | 74.4 | Confident | 177 Ų | 177 | 127.2 Ų | 127.2 | 67% | 0.668 | 62% | 0.622 | S | S | * | * | P | Polyproline II helix | trans | -64.3 | 123.8 | 167.8 | -57.1 | -63.8 | 171.3 | 156.2 | -4.9 | 108.4 | K272 Q276 D303 | K272-R274 PolarHBondContact O-N 2.98Å; R274-Q276 PolarHBondContact O-N 3.39Å; R274-D303 IonicContact CZ-OD2 2.74Å; R274-D303 IonicContact NE-OD2 3.46Å; R274-D303 IonicContact NH2-OD2 3.2Å; R274-D303 PolarHBondContact NH2-OD2 2.9Å |
| 275 | P | 71.1 | Confident | 72 | Confident | 122 Ų | 122 | 127.5 Ų | 127.5 | 79% | 0.792 | 65% | 0.645 | S | S | * | * | P | Polyproline II helix | trans | -59 | 124.9 | 170.6 | -21.9 | 33.5 | 0 | 0 | 0 | 109.2 | R273 | R273-P275 WeakPolarHBondContact O-CD 3.38Š|
| 276 | Q | 64.2 | Low | 69.9 | Low | 188 Ų | 188 | 136 Ų | 136 | 88% | 0.879 | 68% | 0.683 | S | S | * | * | P | Polyproline II helix | trans | -67.8 | 143.6 | 171.9 | -85.1 | -174.8 | -29.8 | 0 | 0 | 110.1 | R274 G278 | R274-Q276 PolarHBondContact O-N 3.39Å; Q276-G278 VanDerWaalsContact C-N 3.35Å; Q276-G278 PolarHBondContact O-N 2.88Å |
| 277 | D | 57 | Low | 67.5 | Low | 169 Ų | 169 | 137.1 Ų | 137.1 | 90% | 0.904 | 69% | 0.691 | S | S | * | * | trans | -48.6 | 80.1 | -166.7 | -60.1 | -93.1 | 0 | 0 | 0 | 116.5 | K279 | D277-K279 PolarHBondContact O-N 3.05Š| ||
| 278 | G | 55.8 | Low | 65 | Low | 69 Ų | 69 | 137.2 Ų | 137.2 | 71% | 0.711 | 69% | 0.693 | S | S | * | * | trans | -83.9 | 102.4 | 161.4 | 0 | 0 | 0 | 0 | 0 | 109.6 | Q276 G280 | Q276-G278 VanDerWaalsContact C-N 3.35Å; Q276-G278 PolarHBondContact O-N 2.88Å; G278-G280 VanDerWaalsContact C-N 3.28Å; G278-G280 PolarHBondContact O-N 3.09Å | ||
| 279 | K | 51.3 | Low | 62.8 | Low | 224 Ų | 224 | 142.4 Ų | 142.4 | 97% | 0.974 | 72% | 0.722 | S | S | * | * | trans | -56.2 | 80 | 177.9 | -177.1 | 179 | 174.5 | 177.9 | 0 | 112.7 | D277 | D277-K279 PolarHBondContact O-N 3.05Š| ||
| 280 | G | 52.4 | Low | 60.9 | Low | 67 Ų | 67 | 141.8 Ų | 141.8 | 69% | 0.691 | 73% | 0.728 | S | S | * | * | trans | -122.3 | 143.6 | 176.3 | 0 | 0 | 0 | 0 | 0 | 110.5 | G278 | G278-G280 VanDerWaalsContact C-N 3.28Å; G278-G280 PolarHBondContact O-N 3.09Å | ||
| 281 | K | 53.5 | Low | 59.5 | Low | 207 Ų | 207 | 143.2 Ų | 143.2 | 90% | 0.9 | 74% | 0.737 | S | S | * | * | trans | -66.9 | 147.3 | -175.2 | -69.3 | 174.9 | 175.5 | 177.9 | 0 | 111.1 | D283 | K281-D283 PolarHBondContact O-N 2.96Š| ||
| 282 | K | 47.6 | Very low | 59.2 | Low | 190 Ų | 190 | 138.8 Ų | 138.8 | 83% | 0.826 | 72% | 0.719 | S | S | * | * | trans | -53.5 | 123.3 | 159.9 | -70.2 | -179.5 | 171.2 | -171.1 | 0 | 108.9 | ||||
| 283 | D | 53.1 | Low | 59.4 | Low | 165 Ų | 165 | 142.3 Ų | 142.3 | 88% | 0.882 | 73% | 0.734 | S | S | * | * | trans | -120 | 142.5 | 147.2 | -133.1 | -32.5 | 0 | 0 | 0 | 106.7 | K281 | K281-D283 PolarHBondContact O-N 2.96Š| ||
| 284 | E | 47.5 | Very low | 60 | Low | 176 Ų | 176 | 131.2 Ų | 131.2 | 82% | 0.822 | 69% | 0.692 | S | S | * | * | S | Bend | trans | -102 | 107.1 | -165.7 | -60.7 | 178.6 | 155.9 | 0 | 0 | 109.1 | ||
| 285 | G | 45.5 | Very low | 61 | Low | 76 Ų | 76 | 125.8 Ų | 125.8 | 78% | 0.784 | 68% | 0.679 | S | S | * | * | trans | 158.2 | -0.7 | 171.4 | 0 | 0 | 0 | 0 | 0 | 121.7 | ||||
| 286 | E | 49.3 | Very low | 62.2 | Low | 193 Ų | 193 | 122.8 Ų | 122.8 | 90% | 0.902 | 66% | 0.655 | S | S | * | * | trans | -113.7 | 104.7 | 171.6 | -82.1 | -174.9 | 151.9 | 0 | 0 | 111.2 | S288 | E286-S288 PolarHBondContact O-N 3.33Š| ||
| 287 | E | 45 | Very low | 63.7 | Low | 160 Ų | 160 | 116.3 Ų | 116.3 | 75% | 0.748 | 63% | 0.63 | S | S | * | * | trans | -59.6 | 115.3 | 161.1 | -177.6 | 174.1 | -165.7 | 0 | 0 | 107.5 | D289 | E287-D289 PolarHBondContact O-N 2.86Š| ||
| 288 | S | 45.2 | Very low | 65.5 | Low | 57 Ų | 57 | 115 Ų | 115 | 40% | 0.399 | 62% | 0.622 | S | S | . | * | trans | -66.8 | 111.1 | -164.2 | 56.4 | 0 | 0 | 0 | 0 | 111.8 | E286 T290 D291 | E286-S288 PolarHBondContact O-N 3.33Å; S288-T290 WeakPolarHBondContact CB-OG1 3.03Å; S288-T290 PolarHBondContact O-N 3.42Å; S288-T290 PolarHBondContact OG-OG1 2.84Å; S288-D291 PolarHBondContact O-N 3.29Å; S288-D291 PolarHBondContact OG-OD1 2.95Å | ||
| 289 | D | 49.9 | Very low | 67.4 | Low | 161 Ų | 161 | 114.7 Ų | 114.7 | 86% | 0.861 | 61% | 0.609 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -62.7 | 14.5 | 173.4 | -158.8 | 31 | 0 | 0 | 0 | 113.6 | E287 D291 | E287-D289 PolarHBondContact O-N 2.86Å; D289-D291 VanDerWaalsContact C-N 3.33Å |
| 290 | T | 57.1 | Low | 69.4 | Low | 103 Ų | 103 | 108.5 Ų | 108.5 | 63% | 0.632 | 59% | 0.585 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -85.9 | -2.8 | 170.6 | 57.9 | 0 | 0 | 0 | 0 | 113.5 | S288 E292 | S288-T290 WeakPolarHBondContact CB-OG1 3.03Å; S288-T290 PolarHBondContact O-N 3.42Å; S288-T290 PolarHBondContact OG-OG1 2.84Å; T290-E292 PolarHBondContact O-N 3.41Å |
| 291 | D | 65.9 | Low | 71.3 | Confident | 43 Ų | 43 | 105.8 Ų | 105.8 | 23% | 0.23 | 56% | 0.555 | C | S | . | * | trans | -83.1 | 102.1 | -173.3 | -75.3 | 17.5 | 0 | 0 | 0 | 110.5 | K272 S288 D289 K293 | K272-D291 WeakPolarHBondContact CE-OD1 3.47Å; K272-D291 IonicContact NZ-OD1 3.7Å; K272-D291 PolarHBondContact NZ-OD1 3.32Å; K272-D291 IonicContact NZ-OD2 3.76Å; K272-D291 PolarHBondContact NZ-OD2 2.79Å; S288-D291 PolarHBondContact O-N 3.29Å; S288-D291 PolarHBondContact OG-OD1 2.95Å; D289-D291 VanDerWaalsContact C-N 3.33Å; D291-K293 PolarHBondContact O-N 3.39Å | ||
| 292 | E | 84.8 | Confident | 73.2 | Confident | 79 Ų | 79 | 102.2 Ų | 102.2 | 37% | 0.369 | 54% | 0.541 | S | S | . | . | trans | -57.6 | 127.4 | 175.4 | -59.4 | -175 | -158.5 | 0 | 0 | 109.5 | Y270 T290 L301 R309 L315 | Y270-E292 HydrophobicContact CE2-CB 4.26Å; Y270-E292 HydrophobicContact CE2-CG 4.47Å; T290-E292 PolarHBondContact O-N 3.41Å; E292-L301 HydrophobicContact CB-CD1 3.92Å; E292-L301 VanDerWaalsContact O-CB 3.26Å; E292-L301 WeakPolarHBondContact O-CB 3.37Å; E292-L301 VanDerWaalsContact O-CG 3.32Å; E292-L301 WeakPolarHBondContact O-CG 3.2Å; E292-L301 PolarHBondContact O-N 2.99Å; E292-R309 IonicContact OE2-NH2 3.21Å; E292-L315 WeakPolarHBondContact OE2-CD2 3.24Å | ||
| 293 | K | 93.3 | Very high | 75.3 | Confident | 130 Ų | 130 | 96.9 Ų | 96.9 | 57% | 0.565 | 52% | 0.522 | S | S | * | . | B | Isolated β-bridge | trans | -119.6 | 142.2 | -179.7 | 68.9 | -167.4 | 170.9 | -149.4 | 0 | 111.4 | D291 T295 S299 | D291-K293 PolarHBondContact O-N 3.39Å; K293-T295 PolarHBondContact O-N 2.98Å; K293-S299 CarbonylContact C-O 3.32Å; K293-S299 WeakPolarHBondContact CA-O 3.42Å; K293-S299 WeakPolarHBondContact CB-O 3.27Å |
| 294 | C | 96.3 | Very high | 77.3 | Confident | 0 Ų | 0 | 91 Ų | 91 | 0% | 0 | 50% | 0.5 | C | S | . | . | trans | -75.2 | 111.7 | 175.8 | -179.4 | 0 | 0 | 0 | 0 | 109.8 | I296 C297 L298 S299 L301 H317 | C294-I296 PolarHBondContact O-N 3.33Å; C294-C297 VanDerWaalsContact CB-SG 3.53Å; C294-C297 VanDerWaalsContact SG-SG 3.6Å; C294-L298 VanDerWaalsContact O-CA 3.23Å; C294-L298 WeakPolarHBondContact O-CA 3.37Å; C294-L298 PolarHBondContact O-N 2.89Å; C294-S299 PolarHBondContact N-O 3.04Å; C294-L301 HydrophobicContact CB-CD2 3.86Å; C294-H317 WeakPolarHBondContact CB-ND1 3.47Å; C294-H317 PolarHBondContact SG-N 3.47Å; C294-H317 PolarHBondContact SG-ND1 2.76Å | ||
| 295 | T | 94.9 | Very high | 79.6 | Confident | 62 Ų | 62 | 85.5 Ų | 85.5 | 38% | 0.38 | 47% | 0.474 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -73.6 | 4.3 | -176.6 | 75.4 | 0 | 0 | 0 | 0 | 114.4 | K293 F316 I333 | K293-T295 PolarHBondContact O-N 2.98Å; T295-F316 WeakPolarHBondContact OG1-CE1 3.37Å; T295-I333 HydrophobicContact CG2-CD1 3.92Å; T295-I333 HydrophobicContact CG2-CG1 4.48Å |
| 296 | I | 96 | Very high | 82 | Confident | 59 Ų | 59 | 85.6 Ų | 85.6 | 30% | 0.303 | 46% | 0.457 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -96 | -49.3 | 178.9 | -57.5 | 172.1 | 0 | 0 | 0 | 110.3 | C294 F316 C320 V321 W324 P332 | C294-I296 PolarHBondContact O-N 3.33Å; I296-F316 HydrophobicContact CD1-CB 4.24Å; I296-F316 HydrophobicContact CD1-CD1 3.74Å; I296-F316 HydrophobicContact CD1-CE1 4.37Å; I296-F316 HydrophobicContact CD1-CG 4.08Å; I296-F316 HydrophobicContact CG1-CD1 3.86Å; I296-F316 HydrophobicContact CG1-CE1 4.3Å; I296-C320 HydrophobicContact CB-CB 3.89Å; I296-C320 HydrophobicContact CD1-CB 4.03Å; I296-C320 HydrophobicContact CG2-CB 3.84Å; I296-V321 HydrophobicContact CD1-CB 3.88Å; I296-V321 HydrophobicContact CD1-CG2 4.26Å; I296-W324 HydrophobicContact CD1-CB 4.44Å; I296-P332 HydrophobicContact CD1-CG 4.07Å; I296-P332 HydrophobicContact CG1-CG 4.25Å |
| 297 | C | 96.6 | Very high | 84.3 | Confident | 52 Ų | 52 | 76.4 Ų | 76.4 | 35% | 0.351 | 41% | 0.414 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -94.5 | -7.8 | 174.8 | 62.1 | 0 | 0 | 0 | 0 | 113.7 | C294 S299 H317 | C294-C297 VanDerWaalsContact CB-SG 3.53Å; C294-C297 VanDerWaalsContact SG-SG 3.6Å; C297-S299 PolarHBondContact O-N 3.06Å; C297-H317 PolarHBondContact SG-ND1 3.27Å |
| 298 | L | 94.7 | Very high | 86.8 | Confident | 141 Ų | 141 | 68.8 Ų | 68.8 | 74% | 0.738 | 38% | 0.378 | S | S | * | . | trans | 62.9 | 12.3 | -176.6 | -51.3 | 178.3 | 0 | 0 | 0 | 115 | C294 | C294-L298 VanDerWaalsContact O-CA 3.23Å; C294-L298 WeakPolarHBondContact O-CA 3.37Å; C294-L298 PolarHBondContact O-N 2.89Å | ||
| 299 | S | 94.6 | Very high | 89.2 | Confident | 63 Ų | 63 | 69 Ų | 69 | 44% | 0.441 | 37% | 0.371 | S | S | . | . | P | Polyproline II helix | trans | -87.9 | 153.5 | 175.3 | -48.2 | 0 | 0 | 0 | 0 | 112.2 | K293 C294 C297 | K293-S299 CarbonylContact C-O 3.32Å; K293-S299 WeakPolarHBondContact CA-O 3.42Å; K293-S299 WeakPolarHBondContact CB-O 3.27Å; C294-S299 PolarHBondContact N-O 3.04Å; C297-S299 PolarHBondContact O-N 3.06Å |
| 300 | M | 93.5 | Very high | 91.4 | Very high | 94 Ų | 94 | 61.6 Ų | 61.6 | 46% | 0.463 | 33% | 0.331 | S | S | . | . | B | Isolated β-bridge | trans | -65.1 | 154.8 | 170.9 | -62.8 | 179.6 | -178 | 0 | 0 | 110.7 | ||
| 301 | L | 94.1 | Very high | 93.2 | Very high | 10 Ų | 10 | 58.6 Ų | 58.6 | 5% | 0.052 | 31% | 0.313 | C | S | . | . | P | Polyproline II helix | trans | -91.4 | 126.4 | 171.5 | -60 | 177.9 | 0 | 0 | 0 | 110.1 | Y270 E292 C294 E305 V307 L315 H317 | Y270-L301 HydrophobicContact CD1-CB 3.83Å; Y270-L301 HydrophobicContact CD2-CB 4.35Å; Y270-L301 HydrophobicContact CD2-CD1 4.36Å; Y270-L301 HydrophobicContact CE1-CB 3.75Å; Y270-L301 WeakPolarHBondContact CE1-O 3.32Å; Y270-L301 HydrophobicContact CE2-CB 4.29Å; Y270-L301 HydrophobicContact CE2-CD1 4.29Å; Y270-L301 HydrophobicContact CG-CB 4.12Å; E292-L301 HydrophobicContact CB-CD1 3.92Å; E292-L301 VanDerWaalsContact O-CB 3.26Å; E292-L301 WeakPolarHBondContact O-CB 3.37Å; E292-L301 VanDerWaalsContact O-CG 3.32Å; E292-L301 WeakPolarHBondContact O-CG 3.2Å; E292-L301 PolarHBondContact O-N 2.99Å; C294-L301 HydrophobicContact CB-CD2 3.86Å; L301-E305 WeakPolarHBondContact CA-OE2 3.49Å; L301-V307 HydrophobicContact CD1-CG1 4.23Å; L301-V307 HydrophobicContact CD2-CG1 3.84Å; L301-L315 HydrophobicContact CD1-CD2 3.52Å; L301-L315 HydrophobicContact CD1-CG 4Å; L301-H317 WeakPolarHBondContact CD2-NE2 3.47Å |
| 302 | E | 92.4 | Very high | 94.6 | Very high | 133 Ų | 133 | 57.5 Ų | 57.5 | 62% | 0.621 | 31% | 0.309 | S | S | * | . | trans | -105 | 149.5 | -176.8 | -63.2 | -169.5 | -175.2 | 0 | 0 | 113.4 | Y270 G304 E305 | Y270-E302 WeakPolarHBondContact CD1-O 3.28Å; E302-G304 PolarHBondContact O-N 3.49Å; E302-G304 VanDerWaalsContact O-N 3.11Å; E302-E305 HydrophobicContact CB-CG 3.96Å; E302-E305 PolarHBondContact N-OE2 2.95Å; E302-E305 WeakPolarHBondContact O-CB 3.43Å; E302-E305 WeakPolarHBondContact O-CG 3.42Å; E302-E305 PolarHBondContact O-N 3.14Å; E302-E305 VanDerWaalsContact O-N 3.08Å | ||
| 303 | D | 92.7 | Very high | 95 | Very high | 77 Ų | 77 | 59.8 Ų | 59.8 | 41% | 0.412 | 32% | 0.321 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -55.4 | 115 | -179.9 | -87.5 | -47.8 | 0 | 0 | 0 | 111.4 | K271 K272 R274 | K271-D303 WeakPolarHBondContact CA-OD1 3.49Å; K272-D303 WeakPolarHBondContact CB-OD1 3.13Å; K272-D303 PolarHBondContact N-OD1 3.38Å; R274-D303 IonicContact CZ-OD2 2.74Å; R274-D303 IonicContact NE-OD2 3.46Å; R274-D303 IonicContact NH2-OD2 3.2Å; R274-D303 PolarHBondContact NH2-OD2 2.9Å |
| 304 | G | 93.2 | Very high | 95.1 | Very high | 42 Ų | 42 | 56.3 Ų | 56.3 | 43% | 0.433 | 31% | 0.307 | S | S | . | . | T | Hydrogen-bonded Turn | trans | 96.2 | 0.9 | -180 | 0 | 0 | 0 | 0 | 0 | 116.1 | K269 Y270 E302 | K269-G304 VanDerWaalsContact CD-O 3.24Å; K269-G304 WeakPolarHBondContact CD-O 3.37Å; K269-G304 PolarHBondContact NZ-O 3.35Å; K269-G304 VanDerWaalsContact NZ-O 3.13Å; Y270-G304 PolarHBondContact O-N 3.35Å; E302-G304 PolarHBondContact O-N 3.49Å; E302-G304 VanDerWaalsContact O-N 3.11Å |
| 305 | E | 96.1 | Very high | 95.1 | Very high | 60 Ų | 60 | 57 Ų | 57 | 28% | 0.28 | 31% | 0.311 | S | S | . | . | trans | -69 | 152.5 | 170.2 | -69.3 | -171.2 | 127.4 | 0 | 0 | 112.6 | K269 Y270 L301 E302 V307 H317 | K269-E305 WeakPolarHBondContact CA-O 3.39Å; Y270-E305 PolarHBondContact N-O 2.96Å; L301-E305 WeakPolarHBondContact CA-OE2 3.49Å; E302-E305 HydrophobicContact CB-CG 3.96Å; E302-E305 PolarHBondContact N-OE2 2.95Å; E302-E305 WeakPolarHBondContact O-CB 3.43Å; E302-E305 WeakPolarHBondContact O-CG 3.42Å; E302-E305 PolarHBondContact O-N 3.14Å; E302-E305 VanDerWaalsContact O-N 3.08Å; E305-V307 PolarHBondContact O-N 3.39Å; E305-H317 IonicContact OE1-CD2 2.8Å; E305-H317 IonicContact OE1-NE2 3.88Å; E305-H317 PolarHBondContact OE1-NE2 3.26Å; E305-H317 IonicContact OE2-CD2 2.6Å; E305-H317 PolarHBondContact OE2-CD2 3.02Å; E305-H317 IonicContact OE2-CE1 3.91Å; E305-H317 IonicContact OE2-NE2 2.76Å; E305-H317 PolarHBondContact OE2-NE2 2.85Å | ||
| 306 | D | 97.5 | Very high | 95.2 | Very high | 78 Ų | 78 | 54.1 Ų | 54.1 | 42% | 0.417 | 29% | 0.292 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -79.5 | 114 | 172.9 | -68.1 | -61.1 | 0 | 0 | 0 | 110.4 | K269 Q318 | K269-D306 WeakPolarHBondContact CD-OD1 3.46Å; K269-D306 WeakPolarHBondContact CE-OD1 3.29Å; K269-D306 IonicContact NZ-OD1 3.63Å; K269-D306 PolarHBondContact NZ-OD1 3.19Å; K269-D306 IonicContact NZ-OD2 2.62Å; K269-D306 PolarHBondContact NZ-OD2 2.81Å; D306-Q318 HydrophobicContact CB-CB 4.11Å; D306-Q318 PolarHBondContact O-N 3.31Å |
| 307 | V | 97.2 | Very high | 95.3 | Very high | 0 Ų | 0 | 52.3 Ų | 52.3 | 0% | 0 | 28% | 0.283 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -124.3 | 149.8 | -178.9 | -67 | 0 | 0 | 0 | 0 | 110.9 | P267 H268 Y270 L301 E305 L315 F316 | P267-V307 CarbonylContact C-O 3.5Å; P267-V307 WeakPolarHBondContact CA-O 3.47Å; H268-V307 PolarHBondContact N-O 2.75Å; H268-V307 VanDerWaalsContact O-CG2 3.27Å; H268-V307 WeakPolarHBondContact O-CG2 3.21Å; H268-V307 PolarHBondContact O-N 3.48Å; Y270-V307 HydrophobicContact CD2-CG2 4.43Å; Y270-V307 HydrophobicContact CG-CG1 4.49Å; L301-V307 HydrophobicContact CD1-CG1 4.23Å; L301-V307 HydrophobicContact CD2-CG1 3.84Å; E305-V307 PolarHBondContact O-N 3.39Å; V307-L315 HydrophobicContact CB-CD1 3.88Å; V307-L315 HydrophobicContact CB-CD2 4.34Å; V307-L315 HydrophobicContact CB-CG 4.13Å; V307-L315 HydrophobicContact CG2-CD1 3.89Å; V307-L315 HydrophobicContact CG2-CD2 4.24Å; V307-L315 HydrophobicContact CG2-CG 4.4Å; V307-F316 CarbonylContact C-O 3.59Å; V307-F316 WeakPolarHBondContact CA-O 3.36Å; V307-F316 WeakPolarHBondContact CB-O 3.46Å |
| 308 | R | 97.1 | Very high | 95.3 | Very high | 0 Ų | 0 | 52.1 Ų | 52.1 | 0% | 0 | 28% | 0.277 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -124.2 | 125.6 | 178.3 | -177.9 | -172.8 | -66.3 | -77.8 | 9.7 | 109.8 | T265 F266 L310 F316 Q318 V321 D322 | T265-R308 WeakPolarHBondContact OG1-CD 3.34Å; T265-R308 WeakPolarHBondContact OG1-CG 3.11Å; T265-R308 PolarHBondContact OG1-NH1 3.43Å; F266-R308 WeakPolarHBondContact O-CA 3.49Å; R308-L310 HydrophobicContact CG-CD1 4.46Å; R308-F316 PolarHBondContact N-O 3.11Å; R308-F316 PolarHBondContact O-N 2.95Å; R308-Q318 HydrophobicContact CB-CB 4.35Å; R308-Q318 HydrophobicContact CB-CG 4.47Å; R308-V321 HydrophobicContact CB-CG1 3.81Å; R308-V321 HydrophobicContact CG-CG1 4.25Å; R308-D322 WeakPolarHBondContact CD-OD1 3.43Å; R308-D322 IonicContact CZ-OD1 2.79Å; R308-D322 IonicContact CZ-OD2 2.71Å; R308-D322 IonicContact NE-OD1 3.09Å; R308-D322 PolarHBondContact NE-OD1 2.88Å; R308-D322 IonicContact NE-OD2 3.85Å; R308-D322 IonicContact NH2-OD1 2.68Å; R308-D322 PolarHBondContact NH2-OD1 3.08Å; R308-D322 VanDerWaalsContact NH2-OD1 3.09Å; R308-D322 IonicContact NH2-OD2 3.11Å; R308-D322 PolarHBondContact NH2-OD2 3.13Å |
| 309 | R | 96.3 | Very high | 95.4 | Very high | 62 Ų | 62 | 52.3 Ų | 52.3 | 23% | 0.234 | 28% | 0.278 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -94.3 | 130.8 | 173.4 | -162 | 170.2 | -65.8 | -90.8 | 1.3 | 109.3 | F266 E292 M313 H314 L315 | F266-R309 PolarHBondContact N-O 3.45Å; F266-R309 PolarHBondContact O-N 2.74Å; E292-R309 IonicContact OE2-NH2 3.21Å; R309-M313 WeakPolarHBondContact CG-O 3.27Å; R309-M313 PolarHBondContact NH1-O 2.71Å; R309-H314 WeakPolarHBondContact CA-O 3.21Å; R309-L315 HydrophobicContact CB-CD1 3.87Å; R309-L315 HydrophobicContact CG-CD1 4.39Å |
| 310 | L | 96 | Very high | 95.6 | Very high | 6 Ų | 6 | 50.5 Ų | 50.5 | 3% | 0.031 | 27% | 0.265 | C | S | . | . | trans | -85.1 | 164.8 | 174.6 | -88.4 | 60 | 0 | 0 | 0 | 110.3 | T265 R308 C312 M313 H314 F316 V321 L325 C331 I338 | T265-L310 HydrophobicContact CG2-CD1 4.15Å; T265-L310 HydrophobicContact CG2-CG 4.12Å; R308-L310 HydrophobicContact CG-CD1 4.46Å; L310-C312 PolarHBondContact O-N 2.78Å; L310-C312 VanDerWaalsContact O-N 3.11Å; L310-M313 WeakPolarHBondContact O-CA 3.31Å; L310-M313 PolarHBondContact O-N 2.74Å; L310-H314 PolarHBondContact N-O 3.46Å; L310-F316 HydrophobicContact CD1-CD2 4.17Å; L310-F316 HydrophobicContact CD1-CE2 4.29Å; L310-F316 HydrophobicContact CD2-CE2 4.32Å; L310-V321 HydrophobicContact CD1-CG2 3.83Å; L310-V321 HydrophobicContact CD2-CG2 4.5Å; L310-L325 HydrophobicContact CD1-CD1 4.37Å; L310-C331 HydrophobicContact CD2-CB 3.77Å; L310-I338 HydrophobicContact CD2-CG2 3.82Å; L310-I338 HydrophobicContact CG-CG2 3.87Å | ||
| 311 | P | 94.3 | Very high | 95.8 | Very high | 40 Ų | 40 | 46 Ų | 46 | 26% | 0.26 | 24% | 0.243 | S | C | . | . | T | Hydrogen-bonded Turn | trans | -53.9 | -32 | 175.6 | -27.6 | 35.9 | 0 | 0 | 0 | 113.1 | F264 M313 L342 | F264-P311 VanDerWaalsContact O-CD 3.28Å; F264-P311 WeakPolarHBondContact O-CD 3.17Å; F264-P311 WeakPolarHBondContact O-CG 3.44Å; P311-M313 PolarHBondContact O-N 2.87Å; P311-M313 VanDerWaalsContact O-N 3.08Å; P311-L342 HydrophobicContact CB-CD1 4.38Å |
| 312 | C | 95.2 | Very high | 95.9 | Very high | 20 Ų | 20 | 46.4 Ų | 46.4 | 14% | 0.135 | 25% | 0.245 | C | C | . | . | T | Hydrogen-bonded Turn | trans | -76.8 | 19.7 | 175.5 | 62.2 | 0 | 0 | 0 | 0 | 114.4 | L310 H314 C331 C334 V336 L342 | L310-C312 PolarHBondContact O-N 2.78Å; L310-C312 VanDerWaalsContact O-N 3.11Å; C312-H314 PolarHBondContact O-N 3.46Å; C312-H314 PolarHBondContact O-ND1 3.2Å; C312-H314 PolarHBondContact SG-ND1 3.29Å; C312-H314 VanDerWaalsContact SG-ND1 3.38Å; C312-C331 PolarHBondContact SG-SG 2.9Å; C312-C334 WeakPolarHBondContact CB-SG 3.36Å; C312-V336 HydrophobicContact CB-CB 4.33Å; C312-L342 HydrophobicContact CB-CD1 3.69Å |
| 313 | M | 93.6 | Very high | 96 | Very high | 127 Ų | 127 | 47 Ų | 47 | 63% | 0.626 | 25% | 0.247 | S | C | * | . | S | Bend | trans | 60.2 | -6.6 | 178.1 | -61.4 | -60.9 | -72.9 | 0 | 0 | 117.2 | R309 L310 P311 | R309-M313 WeakPolarHBondContact CG-O 3.27Å; R309-M313 PolarHBondContact NH1-O 2.71Å; L310-M313 WeakPolarHBondContact O-CA 3.31Å; L310-M313 PolarHBondContact O-N 2.74Å; P311-M313 PolarHBondContact O-N 2.87Å; P311-M313 VanDerWaalsContact O-N 3.08Å |
| 314 | H | 95.5 | Very high | 96.2 | Very high | 57 Ų | 57 | 48.2 Ų | 48.2 | 26% | 0.264 | 25% | 0.247 | S | C | . | . | trans | -63.5 | 142.1 | 172.4 | -65 | 97.2 | 0 | 0 | 0 | 112.1 | R309 L310 C312 F316 I333 | R309-H314 WeakPolarHBondContact CA-O 3.21Å; L310-H314 PolarHBondContact N-O 3.46Å; C312-H314 PolarHBondContact O-N 3.46Å; C312-H314 PolarHBondContact O-ND1 3.2Å; C312-H314 PolarHBondContact SG-ND1 3.29Å; C312-H314 VanDerWaalsContact SG-ND1 3.38Å; H314-F316 HydrophobicContact CB-CE2 3.68Å; H314-F316 HydrophobicContact CB-CZ 3.84Å; H314-I333 HydrophobicContact CB-CD1 4.21Å; H314-I333 VanDerWaalsContact CD2-CD1 3.44Å; H314-I333 WeakPolarHBondContact CD2-CD1 3.4Å; H314-I333 WeakPolarHBondContact NE2-CG2 3.41Å | ||
| 315 | L | 95.5 | Very high | 96.3 | Very high | 15 Ų | 15 | 46.2 Ų | 46.2 | 8% | 0.079 | 23% | 0.226 | C | C | . | . | E | Extended strand (participates in β ladder) | trans | -117.7 | 141.1 | -176.4 | -168.6 | 72.1 | 0 | 0 | 0 | 111.3 | H268 Y270 E292 L301 V307 R309 | H268-L315 VanDerWaalsContact CE1-CD1 3.5Å; H268-L315 WeakPolarHBondContact CE1-CD1 3.49Å; Y270-L315 HydrophobicContact CD2-CD2 3.73Å; Y270-L315 HydrophobicContact CE2-CD2 3.92Å; E292-L315 WeakPolarHBondContact OE2-CD2 3.24Å; L301-L315 HydrophobicContact CD1-CD2 3.52Å; L301-L315 HydrophobicContact CD1-CG 4Å; V307-L315 HydrophobicContact CB-CD1 3.88Å; V307-L315 HydrophobicContact CB-CD2 4.34Å; V307-L315 HydrophobicContact CB-CG 4.13Å; V307-L315 HydrophobicContact CG2-CD1 3.89Å; V307-L315 HydrophobicContact CG2-CD2 4.24Å; V307-L315 HydrophobicContact CG2-CG 4.4Å; R309-L315 HydrophobicContact CB-CD1 3.87Å; R309-L315 HydrophobicContact CG-CD1 4.39Å |
| 316 | F | 97.7 | Very high | 96.2 | Very high | 0 Ų | 0 | 46 Ų | 46 | 0% | 0 | 23% | 0.234 | C | C | . | . | E | Extended strand (participates in β ladder) | trans | -147.2 | 162.8 | 178.3 | -49.5 | -88.8 | 0 | 0 | 0 | 109.7 | T295 I296 V307 R308 L310 H314 Q318 V321 P332 I333 | T295-F316 WeakPolarHBondContact OG1-CE1 3.37Å; I296-F316 HydrophobicContact CD1-CB 4.24Å; I296-F316 HydrophobicContact CD1-CD1 3.74Å; I296-F316 HydrophobicContact CD1-CE1 4.37Å; I296-F316 HydrophobicContact CD1-CG 4.08Å; I296-F316 HydrophobicContact CG1-CD1 3.86Å; I296-F316 HydrophobicContact CG1-CE1 4.3Å; V307-F316 CarbonylContact C-O 3.59Å; V307-F316 WeakPolarHBondContact CA-O 3.36Å; V307-F316 WeakPolarHBondContact CB-O 3.46Å; R308-F316 PolarHBondContact N-O 3.11Å; R308-F316 PolarHBondContact O-N 2.95Å; L310-F316 HydrophobicContact CD1-CD2 4.17Å; L310-F316 HydrophobicContact CD1-CE2 4.29Å; L310-F316 HydrophobicContact CD2-CE2 4.32Å; H314-F316 HydrophobicContact CB-CE2 3.68Å; H314-F316 HydrophobicContact CB-CZ 3.84Å; F316-Q318 PolarHBondContact O-N 3.28Å; F316-V321 HydrophobicContact CB-CB 3.76Å; F316-V321 HydrophobicContact CB-CG1 4.07Å; F316-V321 HydrophobicContact CB-CG2 4.38Å; F316-V321 HydrophobicContact CD2-CB 4.13Å; F316-V321 HydrophobicContact CD2-CG2 3.81Å; F316-V321 HydrophobicContact CE2-CG2 4.36Å; F316-V321 HydrophobicContact CG-CB 4.07Å; F316-V321 HydrophobicContact CG-CG2 4.16Å; F316-P332 HydrophobicContact CE1-CB 4.29Å; F316-P332 HydrophobicContact CE1-CG 4.06Å; F316-P332 HydrophobicContact CZ-CB 4.39Å; F316-P332 HydrophobicContact CZ-CG 4.04Å; F316-I333 HydrophobicContact CE1-CD1 3.69Å; F316-I333 HydrophobicContact CE1-CG1 4.02Å; F316-I333 HydrophobicContact CZ-CD1 3.64Å; F316-I333 HydrophobicContact CZ-CG1 3.93Å |
| 317 | H | 97.9 | Very high | 96 | Very high | 22 Ų | 22 | 48.7 Ų | 48.7 | 10% | 0.102 | 25% | 0.246 | C | C | . | . | E | Extended strand (participates in β ladder) | trans | -56 | 136.1 | 161.8 | -69.2 | 116.2 | 0 | 0 | 0 | 110.3 | C294 C297 L301 E305 L319 C320 V321 | C294-H317 WeakPolarHBondContact CB-ND1 3.47Å; C294-H317 PolarHBondContact SG-N 3.47Å; C294-H317 PolarHBondContact SG-ND1 2.76Å; C297-H317 PolarHBondContact SG-ND1 3.27Å; L301-H317 WeakPolarHBondContact CD2-NE2 3.47Å; E305-H317 IonicContact OE1-CD2 2.8Å; E305-H317 IonicContact OE1-NE2 3.88Å; E305-H317 PolarHBondContact OE1-NE2 3.26Å; E305-H317 IonicContact OE2-CD2 2.6Å; E305-H317 PolarHBondContact OE2-CD2 3.02Å; E305-H317 IonicContact OE2-CE1 3.91Å; E305-H317 IonicContact OE2-NE2 2.76Å; E305-H317 PolarHBondContact OE2-NE2 2.85Å; H317-L319 PolarHBondContact O-N 2.73Å; H317-C320 HydrophobicContact CB-CB 4.07Å; H317-C320 PolarHBondContact O-N 3.35Å; H317-V321 PolarHBondContact O-N 3.31Å; H317-V321 VanDerWaalsContact O-N 3.09Å |
| 318 | Q | 97.2 | Very high | 95.8 | Very high | 47 Ų | 47 | 50.2 Ų | 50.2 | 22% | 0.22 | 26% | 0.257 | C | S | . | . | H | α-helix | trans | -56.3 | -48.6 | -176.9 | 179.7 | 176.9 | -29.2 | 0 | 0 | 111.5 | D306 R308 F316 C320 V321 D322 | D306-Q318 HydrophobicContact CB-CB 4.11Å; D306-Q318 PolarHBondContact O-N 3.31Å; R308-Q318 HydrophobicContact CB-CB 4.35Å; R308-Q318 HydrophobicContact CB-CG 4.47Å; F316-Q318 PolarHBondContact O-N 3.28Å; Q318-C320 PolarHBondContact O-N 3.03Å; Q318-V321 PolarHBondContact O-N 2.86Å; Q318-D322 VanDerWaalsContact O-CB 3.28Å; Q318-D322 WeakPolarHBondContact O-CB 3.39Å; Q318-D322 PolarHBondContact O-N 3.39Å |
| 319 | L | 96.9 | Very high | 95.6 | Very high | 145 Ų | 145 | 52.7 Ų | 52.7 | 76% | 0.759 | 27% | 0.267 | S | S | * | . | H | α-helix | trans | -60.3 | -44.3 | 179.6 | -64.4 | 176.7 | 0 | 0 | 0 | 112.5 | H317 Q323 | H317-L319 PolarHBondContact O-N 2.73Å; L319-Q323 PolarHBondContact O-N 3.13Å; L319-Q323 VanDerWaalsContact O-N 3.13Å |
| 320 | C | 97.8 | Very high | 95.5 | Very high | 26 Ų | 26 | 54.6 Ų | 54.6 | 18% | 0.176 | 28% | 0.277 | C | S | . | . | H | α-helix | trans | -65.3 | -42 | -177.6 | -61.8 | 0 | 0 | 0 | 0 | 112.1 | I296 H317 Q318 W324 | I296-C320 HydrophobicContact CB-CB 3.89Å; I296-C320 HydrophobicContact CD1-CB 4.03Å; I296-C320 HydrophobicContact CG2-CB 3.84Å; H317-C320 HydrophobicContact CB-CB 4.07Å; H317-C320 PolarHBondContact O-N 3.35Å; Q318-C320 PolarHBondContact O-N 3.03Å; C320-W324 PolarHBondContact O-N 2.91Å |
| 321 | V | 97.1 | Very high | 95.5 | Very high | 0 Ų | 0 | 54.3 Ų | 54.3 | 0% | 0 | 28% | 0.276 | C | S | . | . | H | α-helix | trans | -82 | -27.8 | -179.8 | 74 | 0 | 0 | 0 | 0 | 112.9 | I296 R308 L310 F316 H317 Q318 W324 L325 | I296-V321 HydrophobicContact CD1-CB 3.88Å; I296-V321 HydrophobicContact CD1-CG2 4.26Å; R308-V321 HydrophobicContact CB-CG1 3.81Å; R308-V321 HydrophobicContact CG-CG1 4.25Å; L310-V321 HydrophobicContact CD1-CG2 3.83Å; L310-V321 HydrophobicContact CD2-CG2 4.5Å; F316-V321 HydrophobicContact CB-CB 3.76Å; F316-V321 HydrophobicContact CB-CG1 4.07Å; F316-V321 HydrophobicContact CB-CG2 4.38Å; F316-V321 HydrophobicContact CD2-CB 4.13Å; F316-V321 HydrophobicContact CD2-CG2 3.81Å; F316-V321 HydrophobicContact CE2-CG2 4.36Å; F316-V321 HydrophobicContact CG-CB 4.07Å; F316-V321 HydrophobicContact CG-CG2 4.16Å; H317-V321 PolarHBondContact O-N 3.31Å; H317-V321 VanDerWaalsContact O-N 3.09Å; Q318-V321 PolarHBondContact O-N 2.86Å; V321-W324 PolarHBondContact O-N 3.04Å; V321-L325 HydrophobicContact CG2-CD1 3.97Å; V321-L325 HydrophobicContact CG2-CG 4.05Å; V321-L325 VanDerWaalsContact O-CB 3.31Å; V321-L325 WeakPolarHBondContact O-CB 2.96Å; V321-L325 VanDerWaalsContact O-CG 3.23Å; V321-L325 WeakPolarHBondContact O-CG 3.32Å; V321-L325 PolarHBondContact O-N 2.98Å |
| 322 | D | 96.4 | Very high | 95.5 | Very high | 17 Ų | 17 | 54 Ų | 54 | 9% | 0.091 | 27% | 0.274 | C | S | . | . | H | α-helix | trans | -64.7 | -42.5 | 172.8 | -74.9 | 5.7 | 0 | 0 | 0 | 110.6 | Q258 R308 Q318 W324 L325 A326 | Q258-D322 PolarHBondContact NE2-OD2 3.38Å; R308-D322 WeakPolarHBondContact CD-OD1 3.43Å; R308-D322 IonicContact CZ-OD1 2.79Å; R308-D322 IonicContact CZ-OD2 2.71Å; R308-D322 IonicContact NE-OD1 3.09Å; R308-D322 PolarHBondContact NE-OD1 2.88Å; R308-D322 IonicContact NE-OD2 3.85Å; R308-D322 IonicContact NH2-OD1 2.68Å; R308-D322 PolarHBondContact NH2-OD1 3.08Å; R308-D322 VanDerWaalsContact NH2-OD1 3.09Å; R308-D322 IonicContact NH2-OD2 3.11Å; R308-D322 PolarHBondContact NH2-OD2 3.13Å; Q318-D322 VanDerWaalsContact O-CB 3.28Å; Q318-D322 WeakPolarHBondContact O-CB 3.39Å; Q318-D322 PolarHBondContact O-N 3.39Å; D322-W324 VanDerWaalsContact C-N 3.34Å; D322-W324 PolarHBondContact O-N 3.03Å; D322-L325 PolarHBondContact O-N 2.92Å; D322-A326 WeakPolarHBondContact O-CB 3.46Å; D322-A326 PolarHBondContact O-N 3.46Å |
| 323 | Q | 95.8 | Very high | 95.5 | Very high | 145 Ų | 145 | 56.9 Ų | 56.9 | 68% | 0.678 | 29% | 0.287 | S | S | * | . | H | α-helix | trans | -60.9 | -41.8 | 173.7 | -171.7 | 177.6 | 25.2 | 0 | 0 | 112.3 | L319 | L319-Q323 PolarHBondContact O-N 3.13Å; L319-Q323 VanDerWaalsContact O-N 3.13Å |
| 324 | W | 96.1 | Very high | 95.5 | Very high | 104 Ų | 104 | 53.2 Ų | 53.2 | 39% | 0.394 | 27% | 0.273 | S | S | . | . | H | α-helix | trans | -65.8 | -46.2 | 175.5 | 175.4 | -87.1 | 0 | 0 | 0 | 112.3 | I296 C320 V321 D322 A326 M327 S328 K330 P332 | I296-W324 HydrophobicContact CD1-CB 4.44Å; C320-W324 PolarHBondContact O-N 2.91Å; V321-W324 PolarHBondContact O-N 3.04Å; D322-W324 VanDerWaalsContact C-N 3.34Å; D322-W324 PolarHBondContact O-N 3.03Å; W324-A326 VanDerWaalsContact C-N 3.28Å; W324-A326 PolarHBondContact O-N 3.06Å; W324-M327 PolarHBondContact O-N 3.09Å; W324-S328 PolarHBondContact O-N 2.6Å; W324-K330 PolarHBondContact NE1-O 3.21Å; W324-P332 HydrophobicContact CD2-CG 4Å; W324-P332 HydrophobicContact CG-CG 3.94Å; W324-P332 HydrophobicContact CZ2-CB 4.44Å; W324-P332 HydrophobicContact CZ2-CG 4.48Å |
| 325 | L | 96.2 | Very high | 95.4 | Very high | 0 Ų | 0 | 59.9 Ų | 59.9 | 0% | 0 | 30% | 0.296 | C | S | . | . | H | α-helix | trans | -69 | -25.8 | -177.4 | -70.7 | 175.5 | 0 | 0 | 0 | 112.8 | G255 A256 I261 T265 L310 V321 D322 M327 S328 I338 | G255-L325 CarbonylContact C-O 3.58Å; G255-L325 WeakPolarHBondContact CA-O 3.16Å; A256-L325 PolarHBondContact N-O 3.17Å; I261-L325 HydrophobicContact CD1-CB 3.64Å; I261-L325 HydrophobicContact CG1-CB 3.95Å; I261-L325 HydrophobicContact CG1-CD1 4.45Å; I261-L325 HydrophobicContact CG2-CD1 3.75Å; T265-L325 HydrophobicContact CG2-CD1 4.25Å; L310-L325 HydrophobicContact CD1-CD1 4.37Å; V321-L325 HydrophobicContact CG2-CD1 3.97Å; V321-L325 HydrophobicContact CG2-CG 4.05Å; V321-L325 VanDerWaalsContact O-CB 3.31Å; V321-L325 WeakPolarHBondContact O-CB 2.96Å; V321-L325 VanDerWaalsContact O-CG 3.23Å; V321-L325 WeakPolarHBondContact O-CG 3.32Å; V321-L325 PolarHBondContact O-N 2.98Å; D322-L325 PolarHBondContact O-N 2.92Å; L325-M327 PolarHBondContact O-N 3.15Å; L325-S328 WeakPolarHBondContact CA-O 3.26Å; L325-S328 WeakPolarHBondContact CD2-O 3.15Å; L325-I338 HydrophobicContact CD1-CD1 4.26Å; L325-I338 HydrophobicContact CD1-CG2 4.17Å; L325-I338 HydrophobicContact CD2-CD1 4.25Å; L325-I338 HydrophobicContact CD2-CG2 3.71Å |
| 326 | A | 93.8 | Very high | 95.3 | Very high | 55 Ų | 55 | 61.4 Ų | 61.4 | 46% | 0.455 | 31% | 0.306 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -64 | -21.9 | 168.7 | 0 | 0 | 0 | 0 | 0 | 113.3 | D322 W324 | D322-A326 WeakPolarHBondContact O-CB 3.46Å; D322-A326 PolarHBondContact O-N 3.46Å; W324-A326 VanDerWaalsContact C-N 3.28Å; W324-A326 PolarHBondContact O-N 3.06Å |
| 327 | M | 92.1 | Very high | 95.1 | Very high | 134 Ų | 134 | 63.3 Ų | 63.3 | 66% | 0.66 | 32% | 0.316 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -99.6 | -35.6 | 175.5 | -61.3 | 176.5 | 66.5 | 0 | 0 | 112.9 | R254 G255 W324 L325 | R254-M327 CarbonylContact C-O 3.51Å; R254-M327 PolarHBondContact N-O 3Å; G255-M327 PolarHBondContact N-O 2.76Å; W324-M327 PolarHBondContact O-N 3.09Å; L325-M327 PolarHBondContact O-N 3.15Å |
| 328 | S | 92.9 | Very high | 94.9 | Very high | 33 Ų | 33 | 62.4 Ų | 62.4 | 23% | 0.231 | 31% | 0.312 | C | S | . | . | B | Isolated β-bridge | trans | -149.9 | 120.3 | -173.5 | 175.3 | 0 | 0 | 0 | 0 | 111.8 | R254 W324 L325 K330 | R254-S328 WeakPolarHBondContact O-CA 3.13Å; W324-S328 PolarHBondContact O-N 2.6Å; L325-S328 WeakPolarHBondContact CA-O 3.26Å; L325-S328 WeakPolarHBondContact CD2-O 3.15Å; S328-K330 PolarHBondContact O-N 3.26Å |
| 329 | K | 93.4 | Very high | 94.6 | Very high | 51 Ų | 51 | 63.7 Ų | 63.7 | 22% | 0.222 | 32% | 0.318 | C | S | . | . | S | Bend | trans | -61.9 | 0.3 | 176.6 | -65.3 | -173.8 | -174 | -174 | 0 | 115.9 | R254 G255 A256 D337 I338 E339 | R254-K329 WeakPolarHBondContact O-CG 3.23Å; R254-K329 PolarHBondContact O-N 3.24Å; G255-K329 WeakPolarHBondContact O-CE 3.37Å; A256-K329 HydrophobicContact CB-CG 3.95Å; K329-D337 WeakPolarHBondContact CB-OD1 3.44Å; K329-D337 WeakPolarHBondContact O-CA 3.37Å; K329-I338 HydrophobicContact CB-CG1 4.34Å; K329-I338 PolarHBondContact O-N 2.96Å; K329-E339 HydrophobicContact CD-CG 4.43Å; K329-E339 WeakPolarHBondContact CE-OE1 3.38Å; K329-E339 IonicContact NZ-OE1 3.58Å; K329-E339 PolarHBondContact NZ-OE1 2.59Å; K329-E339 IonicContact NZ-OE2 2.74Å; K329-E339 PolarHBondContact NZ-OE2 3.04Å; K329-E339 VanDerWaalsContact NZ-OE2 3.11Å |
| 330 | K | 94.2 | Very high | 94 | Very high | 102 Ų | 102 | 59.8 Ų | 59.8 | 44% | 0.443 | 30% | 0.301 | S | S | . | . | B | Isolated β-bridge | trans | -102.1 | 138.9 | -171.2 | -62.9 | -173.1 | 172.9 | -155 | 0 | 112.3 | W324 S328 R335 V336 D337 | W324-K330 PolarHBondContact NE1-O 3.21Å; S328-K330 PolarHBondContact O-N 3.26Å; K330-R335 WeakPolarHBondContact CD-O 3.22Å; K330-V336 CarbonylContact C-O 3.57Å; K330-V336 WeakPolarHBondContact CA-O 3.5Å; K330-D337 HydrophobicContact CG-CB 4.46Å |
| 331 | C | 95.6 | Very high | 92.4 | Very high | 1 Ų | 1 | 67.1 Ų | 67.1 | 1% | 0.007 | 33% | 0.332 | C | S | . | . | trans | -55.1 | 132.4 | 174.7 | 179.1 | 0 | 0 | 0 | 0 | 111.7 | L310 C312 I333 C334 R335 V336 | L310-C331 HydrophobicContact CD2-CB 3.77Å; C312-C331 PolarHBondContact SG-SG 2.9Å; C331-I333 PolarHBondContact O-N 3.37Å; C331-I333 PolarHBondContact SG-N 2.91Å; C331-C334 VanDerWaalsContact SG-SG 3.68Å; C331-R335 WeakPolarHBondContact O-CA 3.41Å; C331-R335 PolarHBondContact O-N 3.35Å; C331-V336 PolarHBondContact N-O 3.45Å | ||
| 332 | P | 95 | Very high | 90.6 | Very high | 34 Ų | 34 | 71.5 Ų | 71.5 | 22% | 0.221 | 36% | 0.355 | C | S | . | . | T | Hydrogen-bonded Turn | trans | -55.8 | -33.1 | 176.6 | -24.8 | 30.8 | 0 | 0 | 0 | 114.4 | I296 F316 W324 | I296-P332 HydrophobicContact CD1-CG 4.07Å; I296-P332 HydrophobicContact CG1-CG 4.25Å; F316-P332 HydrophobicContact CE1-CB 4.29Å; F316-P332 HydrophobicContact CE1-CG 4.06Å; F316-P332 HydrophobicContact CZ-CB 4.39Å; F316-P332 HydrophobicContact CZ-CG 4.04Å; W324-P332 HydrophobicContact CD2-CG 4Å; W324-P332 HydrophobicContact CG-CG 3.94Å; W324-P332 HydrophobicContact CZ2-CB 4.44Å; W324-P332 HydrophobicContact CZ2-CG 4.48Å |
| 333 | I | 94.3 | Very high | 88.5 | Confident | 79 Ų | 79 | 72.7 Ų | 72.7 | 41% | 0.405 | 37% | 0.372 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -88.4 | -60.5 | -173 | -60.4 | 170.4 | 0 | 0 | 0 | 111 | T295 H314 F316 C331 | T295-I333 HydrophobicContact CG2-CD1 3.92Å; T295-I333 HydrophobicContact CG2-CG1 4.48Å; H314-I333 HydrophobicContact CB-CD1 4.21Å; H314-I333 VanDerWaalsContact CD2-CD1 3.44Å; H314-I333 WeakPolarHBondContact CD2-CD1 3.4Å; H314-I333 WeakPolarHBondContact NE2-CG2 3.41Å; F316-I333 HydrophobicContact CE1-CD1 3.69Å; F316-I333 HydrophobicContact CE1-CG1 4.02Å; F316-I333 HydrophobicContact CZ-CD1 3.64Å; F316-I333 HydrophobicContact CZ-CG1 3.93Å; C331-I333 PolarHBondContact O-N 3.37Å; C331-I333 PolarHBondContact SG-N 2.91Å |
| 334 | C | 95 | Very high | 86.5 | Confident | 50 Ų | 50 | 71.1 Ų | 71.1 | 34% | 0.338 | 38% | 0.383 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -98.6 | -3.7 | -173.7 | 66 | 0 | 0 | 0 | 0 | 115.3 | C312 C331 V336 | C312-C334 WeakPolarHBondContact CB-SG 3.36Å; C331-C334 VanDerWaalsContact SG-SG 3.68Å; C334-V336 HydrophobicContact CB-CG2 4.23Å; C334-V336 PolarHBondContact O-N 3.04Å; C334-V336 VanDerWaalsContact SG-CG2 3.58Å |
| 335 | R | 93.2 | Very high | 84.1 | Confident | 198 Ų | 198 | 72.8 Ų | 72.8 | 75% | 0.747 | 40% | 0.4 | S | S | * | . | trans | 59 | 10.1 | -178.8 | -54.6 | 179 | 179.6 | -120.4 | -2.4 | 116 | K330 C331 | K330-R335 WeakPolarHBondContact CD-O 3.22Å; C331-R335 WeakPolarHBondContact O-CA 3.41Å; C331-R335 PolarHBondContact O-N 3.35Å | ||
| 336 | V | 92.9 | Very high | 81.4 | Confident | 47 Ų | 47 | 81.6 Ų | 81.6 | 29% | 0.285 | 46% | 0.461 | S | S | . | . | trans | -66.8 | 139.6 | 169.4 | 178.7 | 0 | 0 | 0 | 0 | 109.5 | C312 K330 C331 C334 T340 L342 | C312-V336 HydrophobicContact CB-CB 4.33Å; K330-V336 CarbonylContact C-O 3.57Å; K330-V336 WeakPolarHBondContact CA-O 3.5Å; C331-V336 PolarHBondContact N-O 3.45Å; C334-V336 HydrophobicContact CB-CG2 4.23Å; C334-V336 PolarHBondContact O-N 3.04Å; C334-V336 VanDerWaalsContact SG-CG2 3.58Å; V336-T340 WeakPolarHBondContact CG1-OG1 3.29Å; V336-L342 HydrophobicContact CG1-CD1 4.05Å; V336-L342 HydrophobicContact CG1-CG 4.38Å | ||
| 337 | D | 93.1 | Very high | 80.8 | Confident | 40 Ų | 40 | 83 Ų | 83 | 21% | 0.214 | 46% | 0.462 | C | S | . | . | B | Isolated β-bridge | trans | -78.7 | 138.5 | -179.1 | -160.4 | -61.3 | 0 | 0 | 0 | 111 | K329 K330 E339 T340 | K329-D337 WeakPolarHBondContact CB-OD1 3.44Å; K329-D337 WeakPolarHBondContact O-CA 3.37Å; K330-D337 HydrophobicContact CG-CB 4.46Å; D337-E339 PolarHBondContact O-N 2.95Å; D337-E339 PolarHBondContact OD1-N 3.11Å; D337-T340 HydrophobicContact CB-CG2 4.14Å; D337-T340 PolarHBondContact O-N 2.89Å; D337-T340 PolarHBondContact O-OG1 2.89Å |
| 338 | I | 94.1 | Very high | 80.2 | Confident | 2 Ų | 2 | 80.3 Ų | 80.3 | 1% | 0.01 | 45% | 0.451 | C | S | . | . | T | Hydrogen-bonded Turn | trans | -62.6 | -25.8 | 178.3 | 64.6 | 173.5 | 0 | 0 | 0 | 112.7 | A256 I261 F264 T265 L310 L325 K329 T340 | A256-I338 HydrophobicContact CB-CD1 3.91Å; I261-I338 HydrophobicContact CG1-CD1 4.44Å; F264-I338 HydrophobicContact CB-CB 4.27Å; F264-I338 HydrophobicContact CB-CD1 4.45Å; F264-I338 HydrophobicContact CB-CG1 4.35Å; F264-I338 WeakPolarHBondContact CB-O 3.4Å; F264-I338 WeakPolarHBondContact CD1-O 3.22Å; T265-I338 HydrophobicContact CG2-CB 4.36Å; T265-I338 HydrophobicContact CG2-CG2 4.1Å; L310-I338 HydrophobicContact CD2-CG2 3.82Å; L310-I338 HydrophobicContact CG-CG2 3.87Å; L325-I338 HydrophobicContact CD1-CD1 4.26Å; L325-I338 HydrophobicContact CD1-CG2 4.17Å; L325-I338 HydrophobicContact CD2-CD1 4.25Å; L325-I338 HydrophobicContact CD2-CG2 3.71Å; K329-I338 HydrophobicContact CB-CG1 4.34Å; K329-I338 PolarHBondContact O-N 2.96Å; I338-T340 VanDerWaalsContact C-N 3.25Å; I338-T340 PolarHBondContact O-N 3.25Å |
| 339 | E | 90.9 | Very high | 79.5 | Confident | 75 Ų | 75 | 82.9 Ų | 82.9 | 35% | 0.35 | 46% | 0.464 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -78.1 | -11 | 177.2 | -64.7 | -178.9 | 180 | 0 | 0 | 112.5 | T260 F264 K329 D337 Q341 | T260-E339 HydrophobicContact CG2-CG 4.27Å; T260-E339 WeakPolarHBondContact CG2-OE1 3.23Å; F264-E339 HydrophobicContact CD2-CG 4Å; F264-E339 HydrophobicContact CE1-CB 4.48Å; F264-E339 HydrophobicContact CE2-CG 3.93Å; F264-E339 HydrophobicContact CG-CG 4.36Å; F264-E339 HydrophobicContact CZ-CB 4.46Å; F264-E339 HydrophobicContact CZ-CG 4.22Å; K329-E339 HydrophobicContact CD-CG 4.43Å; K329-E339 WeakPolarHBondContact CE-OE1 3.38Å; K329-E339 IonicContact NZ-OE1 3.58Å; K329-E339 PolarHBondContact NZ-OE1 2.59Å; K329-E339 IonicContact NZ-OE2 2.74Å; K329-E339 PolarHBondContact NZ-OE2 3.04Å; K329-E339 VanDerWaalsContact NZ-OE2 3.11Å; D337-E339 PolarHBondContact O-N 2.95Å; D337-E339 PolarHBondContact OD1-N 3.11Å; E339-Q341 PolarHBondContact O-N 2.88Å |
| 340 | T | 83.6 | Confident | 78.6 | Confident | 63 Ų | 63 | 84.8 Ų | 84.8 | 39% | 0.387 | 48% | 0.478 | S | S | . | . | S | Bend | trans | -74.3 | 115.4 | 171.4 | 57.9 | 0 | 0 | 0 | 0 | 110.5 | V336 D337 I338 L342 | V336-T340 WeakPolarHBondContact CG1-OG1 3.29Å; D337-T340 HydrophobicContact CB-CG2 4.14Å; D337-T340 PolarHBondContact O-N 2.89Å; D337-T340 PolarHBondContact O-OG1 2.89Å; I338-T340 VanDerWaalsContact C-N 3.25Å; I338-T340 PolarHBondContact O-N 3.25Å; T340-L342 VanDerWaalsContact C-N 3.35Å; T340-L342 PolarHBondContact O-N 3.05Å |
| 341 | Q | 65 | Low | 77.7 | Confident | 180 Ų | 180 | 83.7 Ų | 83.7 | 84% | 0.841 | 48% | 0.48 | S | S | * | . | trans | -67.8 | 96.1 | 168.8 | -63.2 | -178.9 | 18 | 0 | 0 | 108.1 | E339 G343 | E339-Q341 PolarHBondContact O-N 2.88Å; Q341-G343 PolarHBondContact O-N 3.07Å | ||
| 342 | L | 60.1 | Low | 76.5 | Confident | 92 Ų | 92 | 89.2 Ų | 89.2 | 48% | 0.482 | 51% | 0.512 | S | S | . | . | trans | -71.1 | 86.4 | 164.8 | -74.7 | 172.3 | 0 | 0 | 0 | 108 | P311 C312 V336 T340 | P311-L342 HydrophobicContact CB-CD1 4.38Å; C312-L342 HydrophobicContact CB-CD1 3.69Å; V336-L342 HydrophobicContact CG1-CD1 4.05Å; V336-L342 HydrophobicContact CG1-CG 4.38Å; T340-L342 VanDerWaalsContact C-N 3.35Å; T340-L342 PolarHBondContact O-N 3.05Å | ||
| 343 | G | 50.6 | Low | 75.1 | Confident | 42 Ų | 42 | 93.1 Ų | 93.1 | 43% | 0.433 | 53% | 0.532 | S | S | . | . | trans | -55.3 | 140.1 | 162.4 | 0 | 0 | 0 | 0 | 0 | 109.4 | Q341 D345 | Q341-G343 PolarHBondContact O-N 3.07Å; G343-D345 WeakPolarHBondContact CA-OD1 3.39Å; G343-D345 PolarHBondContact O-N 3.45Å | ||
| 344 | A | 54.8 | Low | 73.7 | Confident | 111 Ų | 111 | 94.2 Ų | 94.2 | 92% | 0.917 | 54% | 0.542 | S | S | * | . | S | Bend | trans | -79.9 | 29.2 | -178.1 | 0 | 0 | 0 | 0 | 0 | 112.5 | ||
| 345 | D | 45.8 | Very low | 71.9 | Confident | 139 Ų | 139 | 97.9 Ų | 97.9 | 74% | 0.743 | 56% | 0.559 | S | S | * | * | trans | -131.8 | 29.5 | -164 | 56.5 | -60.1 | 0 | 0 | 0 | 113.3 | G343 | G343-D345 WeakPolarHBondContact CA-OD1 3.39Å; G343-D345 PolarHBondContact O-N 3.45Å | ||
| 346 | S | 38.8 | Very low | 70 | Confident | 186 Ų | 186 | 88.8 Ų | 88.8 | 100% | 1.301 | 54% | 0.542 | S | S | * | . | trans | -132.8 | 0 | 162.7 | -67.2 | 0 | 0 | 0 | 0 | 111.1 |
Retrieved 346 of 346 residues in 292.5 ms
(Link to these results)