| 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 | 35.8 | Very low | 47.1 | Very low | 251 Ų | 251 | 150.8 Ų | 150.8 | 100% | 1.236 | 86% | 0.861 | S | S | * | * | 0 | 113.5 | 0 | -69.9 | -150.9 | -149.7 | 0 | 0 | 108 | |||||
| 2 | A | 39.8 | Very low | 47.4 | Very low | 102 Ų | 102 | 145.8 Ų | 145.8 | 84% | 0.843 | 85% | 0.851 | S | S | * | * | trans | -90.1 | 127.7 | -177.4 | 0 | 0 | 0 | 0 | 0 | 110.1 | ||||
| 3 | G | 43 | Very low | 47.3 | Very low | 75 Ų | 75 | 144.5 Ų | 144.5 | 77% | 0.773 | 85% | 0.846 | S | S | * | * | trans | -68 | 131.2 | -177.7 | 0 | 0 | 0 | 0 | 0 | 112.6 | K5 | G3-K5 PolarHBondContact O-N 3.07Š| ||
| 4 | K | 51.2 | Low | 46.6 | Very low | 213 Ų | 213 | 150.9 Ų | 150.9 | 93% | 0.926 | 85% | 0.851 | S | S | * | * | trans | -74.9 | 111.3 | 172 | -66.7 | 173.3 | 176.5 | -178.8 | 0 | 108.4 | ||||
| 5 | K | 53.7 | Low | 46.5 | Very low | 192 Ų | 192 | 146 Ų | 146 | 84% | 0.835 | 84% | 0.837 | S | S | * | * | trans | -86.3 | 116.7 | 173.3 | 33.3 | 177.7 | 176.6 | 173 | 0 | 108.9 | G3 | G3-K5 PolarHBondContact O-N 3.07Š| ||
| 6 | N | 49.3 | Very low | 46.1 | Very low | 145 Ų | 145 | 148.1 Ų | 148.1 | 78% | 0.775 | 84% | 0.837 | S | S | * | * | trans | -77.3 | 122.4 | -179.2 | -146.9 | 9.9 | 0 | 0 | 0 | 109.1 | ||||
| 7 | V | 51.6 | Low | 45.9 | Very low | 136 Ų | 136 | 148.4 Ų | 148.4 | 82% | 0.824 | 84% | 0.836 | S | S | * | * | trans | -100.5 | 24.1 | -170.5 | -91.2 | 0 | 0 | 0 | 0 | 114.1 | S9 | V7-S9 PolarHBondContact O-N 2.75Š| ||
| 8 | L | 46.8 | Very low | 45.8 | Very low | 152 Ų | 152 | 145.3 Ų | 145.3 | 80% | 0.796 | 83% | 0.825 | S | S | * | * | trans | -92.8 | 25.4 | -174.1 | -76.2 | 169.5 | 0 | 0 | 0 | 115.5 | ||||
| 9 | S | 48.9 | Very low | 45.6 | Very low | 110 Ų | 110 | 147 Ų | 147 | 77% | 0.769 | 83% | 0.826 | S | S | * | * | trans | -106 | 31.9 | -172.7 | 75.9 | 0 | 0 | 0 | 0 | 116 | V7 | V7-S9 PolarHBondContact O-N 2.75Š| ||
| 10 | S | 53.5 | Low | 45.4 | Very low | 118 Ų | 118 | 145.6 Ų | 145.6 | 83% | 0.825 | 82% | 0.823 | S | S | * | * | trans | -131.6 | 47.9 | 178.2 | -58.4 | 0 | 0 | 0 | 0 | 113.4 | ||||
| 11 | L | 44.7 | Very low | 44.9 | Very low | 165 Ų | 165 | 148 Ų | 148 | 86% | 0.864 | 83% | 0.827 | S | S | * | * | trans | -90.5 | 103.5 | 163.4 | -166.8 | 66.4 | 0 | 0 | 0 | 108.2 | V13 | L11-V13 PolarHBondContact O-N 3.37Š| ||
| 12 | A | 50 | Low | 45.1 | Very low | 90 Ų | 90 | 141.4 Ų | 141.4 | 74% | 0.744 | 81% | 0.806 | S | S | * | * | trans | -70.5 | 123.6 | 174.3 | 0 | 0 | 0 | 0 | 0 | 109.6 | ||||
| 13 | V | 46.3 | Very low | 45.1 | Very low | 130 Ų | 130 | 144.7 Ų | 144.7 | 79% | 0.788 | 81% | 0.809 | S | S | * | * | trans | -78.3 | 115.6 | 171.3 | 174.7 | 0 | 0 | 0 | 0 | 107.5 | L11 A15 | L11-V13 PolarHBondContact O-N 3.37Å; V13-A15 PolarHBondContact O-N 2.79Å; V13-A15 VanDerWaalsContact O-N 3.11Å | ||
| 14 | Y | 37.6 | Very low | 44.7 | Very low | 234 Ų | 234 | 144.5 Ų | 144.5 | 92% | 0.918 | 81% | 0.807 | S | S | * | * | trans | -74 | 94.1 | 166.1 | -118.7 | -97.3 | 0 | 0 | 0 | 107.2 | ||||
| 15 | A | 45.5 | Very low | 44 | Very low | 77 Ų | 77 | 143.7 Ų | 143.7 | 64% | 0.636 | 81% | 0.807 | S | S | * | * | trans | -78.8 | 129.4 | 166.3 | 0 | 0 | 0 | 0 | 0 | 107.9 | V13 D17 | V13-A15 PolarHBondContact O-N 2.79Å; V13-A15 VanDerWaalsContact O-N 3.11Å; A15-D17 PolarHBondContact O-N 3.29Å; A15-D17 VanDerWaalsContact O-N 3.14Å | ||
| 16 | E | 40.3 | Very low | 43.1 | Very low | 180 Ų | 180 | 139.1 Ų | 139.1 | 84% | 0.841 | 81% | 0.805 | S | S | * | * | trans | -58.2 | 111.1 | 168 | -76.3 | -147.6 | 151.5 | 0 | 0 | 110.1 | S18 | E16-S18 PolarHBondContact O-N 3.22Š| ||
| 17 | D | 42.9 | Very low | 42.2 | Very low | 153 Ų | 153 | 135.6 Ų | 135.6 | 82% | 0.818 | 80% | 0.803 | S | S | * | * | trans | -95.4 | 87.6 | 167.3 | -153.9 | 19.5 | 0 | 0 | 0 | 107.2 | A15 E19 | A15-D17 PolarHBondContact O-N 3.29Å; A15-D17 VanDerWaalsContact O-N 3.14Å; D17-E19 PolarHBondContact O-N 3.11Å | ||
| 18 | S | 42.8 | Very low | 41.5 | Very low | 92 Ų | 92 | 135.6 Ų | 135.6 | 64% | 0.643 | 80% | 0.803 | S | S | * | * | trans | -73.6 | 107.9 | 168.3 | -76.5 | 0 | 0 | 0 | 0 | 108.3 | E16 P20 | E16-S18 PolarHBondContact O-N 3.22Å; S18-P20 WeakPolarHBondContact O-CD 3.33Å | ||
| 19 | E | 42.7 | Very low | 40.8 | Very low | 178 Ų | 178 | 136.8 Ų | 136.8 | 83% | 0.832 | 80% | 0.804 | S | S | * | * | P | Polyproline II helix | trans | -66.2 | 130.8 | 173 | -61.9 | -154.5 | 160.5 | 0 | 0 | 111.2 | D17 | D17-E19 PolarHBondContact O-N 3.11Š|
| 20 | P | 41.2 | Very low | 40 | Very low | 119 Ų | 119 | 138 Ų | 138 | 77% | 0.773 | 81% | 0.807 | S | S | * | * | P | Polyproline II helix | trans | -86.9 | 120 | 161.8 | 30.7 | -28.4 | 0 | 0 | 0 | 110.4 | S18 S22 | S18-P20 WeakPolarHBondContact O-CD 3.33Å; P20-S22 PolarHBondContact O-N 3.28Å |
| 21 | E | 35.2 | Very low | 39 | Very low | 195 Ų | 195 | 137.2 Ų | 137.2 | 91% | 0.911 | 81% | 0.808 | S | S | * | * | P | Polyproline II helix | trans | -55.9 | 130.5 | 164.6 | -66.2 | -149 | 158.4 | 0 | 0 | 110.6 | ||
| 22 | S | 40.5 | Very low | 38.2 | Very low | 114 Ų | 114 | 133 Ų | 133 | 80% | 0.797 | 80% | 0.804 | S | S | * | * | trans | -130.1 | 96.1 | 171.6 | -179.4 | 0 | 0 | 0 | 0 | 109.2 | P20 | P20-S22 PolarHBondContact O-N 3.28Š| ||
| 23 | D | 38.5 | Very low | 37.3 | Very low | 170 Ų | 170 | 135 Ų | 135 | 91% | 0.909 | 81% | 0.813 | S | S | * | * | trans | -58.7 | 133.3 | 160 | -100.7 | -26 | 0 | 0 | 0 | 110.4 | ||||
| 24 | G | 35 | Very low | 36.7 | Very low | 71 Ų | 71 | 133.8 Ų | 133.8 | 73% | 0.732 | 82% | 0.817 | S | S | * | * | trans | -166.1 | 78 | -178.8 | 0 | 0 | 0 | 0 | 0 | 113 | A26 | G24-A26 PolarHBondContact O-N 3.33Š| ||
| 25 | E | 36 | Very low | 36.6 | Very low | 196 Ų | 196 | 127.5 Ų | 127.5 | 92% | 0.916 | 81% | 0.813 | S | S | * | * | trans | -49.6 | 123.2 | 162.4 | -81.8 | -94.9 | 175.5 | 0 | 0 | 112.5 | ||||
| 26 | A | 36 | Very low | 36.1 | Very low | 97 Ų | 97 | 133.2 Ų | 133.2 | 80% | 0.802 | 83% | 0.827 | S | S | * | * | trans | -163.4 | 108.2 | 150 | 0 | 0 | 0 | 0 | 0 | 110.3 | G24 | G24-A26 PolarHBondContact O-N 3.33Š| ||
| 27 | G | 31 | Very low | 35.9 | Very low | 70 Ų | 70 | 131.7 Ų | 131.7 | 72% | 0.722 | 82% | 0.82 | S | S | * | * | trans | -70.6 | 149.2 | 175.4 | 0 | 0 | 0 | 0 | 0 | 113.8 | ||||
| 28 | V | 35.1 | Very low | 35.9 | Very low | 136 Ų | 136 | 132.3 Ų | 132.3 | 82% | 0.824 | 82% | 0.815 | S | S | * | * | trans | -140.4 | 113.8 | 148.7 | 169.6 | 0 | 0 | 0 | 0 | 108.1 | ||||
| 29 | E | 33.3 | Very low | 35.6 | Very low | 177 Ų | 177 | 132 Ų | 132 | 83% | 0.827 | 83% | 0.826 | S | S | * | * | trans | -73.8 | 137.2 | 169.8 | 53.5 | -148.3 | 122.4 | 0 | 0 | 112.3 | ||||
| 30 | T | 32 | Very low | 35.2 | Very low | 135 Ų | 135 | 126.9 Ų | 126.9 | 83% | 0.828 | 82% | 0.822 | S | S | * | * | trans | -164.1 | 102.8 | 150.4 | 9.9 | 0 | 0 | 0 | 0 | 112.8 | ||||
| 31 | A | 31.4 | Very low | 35 | Very low | 102 Ų | 102 | 129.8 Ų | 129.8 | 84% | 0.843 | 83% | 0.83 | S | S | * | * | trans | 46.1 | 105.1 | 139.6 | 0 | 0 | 0 | 0 | 0 | 122.1 | ||||
| 32 | G | 29 | Very low | 35.2 | Very low | 76 Ų | 76 | 126.3 Ų | 126.3 | 78% | 0.784 | 82% | 0.821 | S | S | * | * | 87 | 108.8 | 103.6 | 0 | 0 | 0 | 0 | 0 | 120.2 | |||||
| 33 | S | 31.4 | Very low | 35.5 | Very low | 132 Ų | 132 | 126.3 Ų | 126.3 | 92% | 0.923 | 82% | 0.821 | S | S | * | * | 179.3 | 137.4 | 118.8 | 43.1 | 0 | 0 | 0 | 0 | 111.2 | |||||
| 34 | A | 32.8 | Very low | 35.6 | Very low | 105 Ų | 105 | 126.5 Ų | 126.5 | 87% | 0.868 | 82% | 0.817 | S | S | * | * | trans | -99 | 144.7 | -174.3 | 0 | 0 | 0 | 0 | 0 | 111.9 | ||||
| 35 | A | 35.2 | Very low | 35.8 | Very low | 103 Ų | 103 | 127.3 Ų | 127.3 | 85% | 0.851 | 82% | 0.816 | S | S | * | * | trans | -167.9 | 119.7 | 145.4 | 0 | 0 | 0 | 0 | 0 | 110.7 | ||||
| 36 | E | 36 | Very low | 36.1 | Very low | 196 Ų | 196 | 128.9 Ų | 128.9 | 92% | 0.916 | 82% | 0.815 | S | S | * | * | trans | -66.6 | 147.1 | 157.9 | -79.1 | 179.3 | 101.5 | 0 | 0 | 110.2 | ||||
| 37 | E | 36.8 | Very low | 36.3 | Very low | 149 Ų | 149 | 127.8 Ų | 127.8 | 70% | 0.696 | 81% | 0.813 | S | S | * | * | 163.3 | 142.4 | 116.8 | -148.7 | -160.7 | 160.1 | 0 | 0 | 112 | |||||
| 38 | K | 41.5 | Very low | 36.8 | Very low | 166 Ų | 166 | 132.2 Ų | 132.2 | 72% | 0.722 | 82% | 0.815 | S | S | * | * | trans | 74.2 | 125 | 162.4 | -42.2 | -166.4 | -158.7 | -88.2 | 0 | 115.8 | ||||
| 39 | G | 36.5 | Very low | 37 | Very low | 85 Ų | 85 | 132.2 Ų | 132.2 | 88% | 0.876 | 81% | 0.811 | S | S | * | * | cis | 87.1 | 94.4 | 44.9 | 0 | 0 | 0 | 0 | 0 | 109.4 | ||||
| 40 | G | 34.9 | Very low | 37.3 | Very low | 71 Ų | 71 | 129.2 Ų | 129.2 | 73% | 0.732 | 80% | 0.8 | S | S | * | * | trans | 164.7 | 109.8 | 172.6 | 0 | 0 | 0 | 0 | 0 | 114.8 | V42 | G40-V42 PolarHBondContact O-N 3.24Š| ||
| 41 | L | 37.6 | Very low | 37.7 | Very low | 180 Ų | 180 | 132.1 Ų | 132.1 | 94% | 0.942 | 80% | 0.802 | S | S | * | * | trans | -58.4 | 116.7 | 166.6 | -73 | 144.6 | 0 | 0 | 0 | 109.8 | S43 | L41-S43 PolarHBondContact O-N 3.07Š| ||
| 42 | V | 39.2 | Very low | 38.4 | Very low | 121 Ų | 121 | 131.9 Ų | 131.9 | 73% | 0.733 | 79% | 0.794 | S | S | * | * | trans | -85.6 | 109.9 | 167.1 | 175.2 | 0 | 0 | 0 | 0 | 107.9 | G40 E44 | G40-V42 PolarHBondContact O-N 3.24Å; V42-E44 HydrophobicContact CG1-CB 4.36Å | ||
| 43 | S | 46.8 | Very low | 39.4 | Very low | 114 Ų | 114 | 139.4 Ų | 139.4 | 80% | 0.797 | 80% | 0.799 | S | S | * | * | trans | -78.9 | 118.3 | 158.7 | -55 | 0 | 0 | 0 | 0 | 106.5 | L41 | L41-S43 PolarHBondContact O-N 3.07Š| ||
| 44 | E | 39.6 | Very low | 39.8 | Very low | 175 Ų | 175 | 141.7 Ų | 141.7 | 82% | 0.818 | 80% | 0.8 | S | S | * | * | trans | -122.6 | 138.2 | 167.6 | -154.5 | 77.9 | -132.8 | 0 | 0 | 108.6 | V42 | V42-E44 HydrophobicContact CG1-CB 4.36Š| ||
| 45 | A | 39.2 | Very low | 40 | Very low | 87 Ų | 87 | 140 Ų | 140 | 72% | 0.719 | 79% | 0.793 | S | S | * | * | trans | -76.7 | 158.5 | -146.6 | 0 | 0 | 0 | 0 | 0 | 115.8 | G47 | A45-G47 PolarHBondContact O-N 2.93Š| ||
| 46 | Y | 42.8 | Very low | 39.9 | Very low | 229 Ų | 229 | 138.2 Ų | 138.2 | 90% | 0.898 | 78% | 0.784 | S | S | * | * | trans | -41 | 117.6 | 160.4 | -97.3 | -117.2 | 0 | 0 | 0 | 112.1 | E48 | Y46-E48 PolarHBondContact O-N 3.17Š| ||
| 47 | G | 39.5 | Very low | 39.9 | Very low | 74 Ų | 74 | 136.8 Ų | 136.8 | 76% | 0.763 | 78% | 0.783 | S | S | * | * | trans | -79 | 90.6 | 155.9 | 0 | 0 | 0 | 0 | 0 | 108.7 | A45 D49 | A45-G47 PolarHBondContact O-N 2.93Å; G47-D49 PolarHBondContact O-N 3.1Å | ||
| 48 | E | 42.4 | Very low | 40.2 | Very low | 163 Ų | 163 | 139.1 Ų | 139.1 | 76% | 0.762 | 79% | 0.794 | S | S | * | * | trans | -72.3 | 103.9 | 162.3 | -174.5 | -168.5 | -150.5 | 0 | 0 | 107.7 | Y46 | Y46-E48 PolarHBondContact O-N 3.17Š| ||
| 49 | D | 40 | Very low | 40 | Very low | 137 Ų | 137 | 138.2 Ų | 138.2 | 73% | 0.733 | 80% | 0.797 | S | S | * | * | trans | -117.7 | 92.8 | 160.5 | -76.4 | -49.1 | 0 | 0 | 0 | 107.9 | G47 F51 | G47-D49 PolarHBondContact O-N 3.1Å; D49-F51 HydrophobicContact CB-CD2 4.29Å; D49-F51 HydrophobicContact CB-CE2 3.91Å; D49-F51 PolarHBondContact O-N 2.86Å | ||
| 50 | D | 39.6 | Very low | 40 | Very low | 113 Ų | 113 | 138 Ų | 138 | 60% | 0.604 | 79% | 0.794 | S | S | * | * | trans | -64.8 | 97.9 | 171.3 | 179.3 | 25.2 | 0 | 0 | 0 | 110.6 | S52 | D50-S52 WeakPolarHBondContact OD1-CB 3.41Å; D50-S52 PolarHBondContact OD1-N 3.43Å; D50-S52 VanDerWaalsContact OD1-N 3.13Å; D50-S52 PolarHBondContact OD1-OG 2.77Å | ||
| 51 | F | 40.5 | Very low | 40.1 | Very low | 196 Ų | 196 | 145.1 Ų | 145.1 | 86% | 0.86 | 80% | 0.801 | S | S | * | * | trans | -100.2 | 52.9 | 164.3 | -69.7 | -82.6 | 0 | 0 | 0 | 110.4 | D49 | D49-F51 HydrophobicContact CB-CD2 4.29Å; D49-F51 HydrophobicContact CB-CE2 3.91Å; D49-F51 PolarHBondContact O-N 2.86Å | ||
| 52 | S | 45.8 | Very low | 40.2 | Very low | 97 Ų | 97 | 144.6 Ų | 144.6 | 68% | 0.678 | 79% | 0.793 | S | S | * | * | trans | -113.4 | 51.1 | 176.8 | -29.9 | 0 | 0 | 0 | 0 | 112 | D50 | D50-S52 WeakPolarHBondContact OD1-CB 3.41Å; D50-S52 PolarHBondContact OD1-N 3.43Å; D50-S52 VanDerWaalsContact OD1-N 3.13Å; D50-S52 PolarHBondContact OD1-OG 2.77Å | ||
| 53 | R | 48.8 | Very low | 40.1 | Very low | 234 Ų | 234 | 147.4 Ų | 147.4 | 88% | 0.883 | 80% | 0.799 | S | S | * | * | trans | -157.1 | 85.8 | 170.4 | -157.8 | 172.3 | -173.4 | 164.7 | 1.4 | 114.8 | ||||
| 54 | L | 41.4 | Very low | 39.6 | Very low | 181 Ų | 181 | 149.4 Ų | 149.4 | 95% | 0.948 | 80% | 0.795 | S | S | * | * | trans | -145 | 112.2 | 136.7 | -92.6 | 178.3 | 0 | 0 | 0 | 107.6 | ||||
| 55 | G | 35.3 | Very low | 39.5 | Very low | 69 Ų | 69 | 149.3 Ų | 149.3 | 71% | 0.711 | 80% | 0.795 | S | S | * | * | trans | -96.9 | 167.2 | 171.8 | 0 | 0 | 0 | 0 | 0 | 111.4 | ||||
| 56 | G | 33.4 | Very low | 39.4 | Very low | 66 Ų | 66 | 152.5 Ų | 152.5 | 68% | 0.68 | 80% | 0.8 | S | S | * | * | trans | 75.9 | 127.6 | 175.5 | 0 | 0 | 0 | 0 | 0 | 111.9 | ||||
| 57 | D | 35.7 | Very low | 39.4 | Very low | 166 Ų | 166 | 150.6 Ų | 150.6 | 89% | 0.888 | 80% | 0.799 | S | S | * | * | cis | -151.2 | 157.5 | 32.5 | -69.8 | -47.1 | 0 | 0 | 0 | 112 | ||||
| 58 | E | 43.5 | Very low | 39.2 | Very low | 197 Ų | 197 | 154.7 Ų | 154.7 | 92% | 0.921 | 80% | 0.803 | S | S | * | * | trans | -87.5 | 119.3 | 178.2 | 174.1 | -176 | 178.2 | 0 | 0 | 109 | ||||
| 59 | D | 36.7 | Very low | 39 | Very low | 148 Ų | 148 | 150.8 Ų | 150.8 | 79% | 0.791 | 79% | 0.794 | S | S | * | * | trans | -144.2 | 117.5 | 158.1 | 58.6 | -19.1 | 0 | 0 | 0 | 111.5 | ||||
| 60 | G | 37.6 | Very low | 39 | Very low | 79 Ų | 79 | 153.5 Ų | 153.5 | 81% | 0.814 | 80% | 0.8 | S | S | * | * | trans | -72.9 | 144.8 | 175.1 | 0 | 0 | 0 | 0 | 0 | 111.7 | ||||
| 61 | Y | 36.2 | Very low | 38.7 | Very low | 222 Ų | 222 | 156.9 Ų | 156.9 | 87% | 0.871 | 81% | 0.811 | S | S | * | * | trans | -113.7 | 121.4 | 168.2 | 59.9 | -84 | 0 | 0 | 0 | 107.8 | ||||
| 62 | E | 39 | Very low | 38.5 | Very low | 169 Ų | 169 | 152.4 Ų | 152.4 | 79% | 0.79 | 81% | 0.805 | S | S | * | * | trans | -73.5 | 141.3 | 179.7 | -61.6 | -160.7 | 162.4 | 0 | 0 | 111.1 | ||||
| 63 | E | 37.7 | Very low | 37.8 | Very low | 180 Ų | 180 | 157 Ų | 157 | 84% | 0.841 | 82% | 0.815 | S | S | * | * | trans | -71.4 | 124.6 | 161.6 | -82.6 | 175.3 | 148.3 | 0 | 0 | 108.3 | ||||
| 64 | E | 36.3 | Very low | 37.2 | Very low | 155 Ų | 155 | 153.6 Ų | 153.6 | 72% | 0.724 | 82% | 0.815 | S | S | * | * | trans | -111.5 | 106.2 | 161.8 | -68.1 | -74.2 | -159 | 0 | 0 | 107.8 | ||||
| 65 | E | 39 | Very low | 36.9 | Very low | 173 Ų | 173 | 152 Ų | 152 | 81% | 0.808 | 81% | 0.807 | S | S | * | * | trans | -76.5 | 117.8 | 162.2 | -70.1 | 179.7 | 154.1 | 0 | 0 | 108.1 | ||||
| 66 | D | 36 | Very low | 36.9 | Very low | 155 Ų | 155 | 155 Ų | 155 | 83% | 0.829 | 81% | 0.807 | S | S | * | * | trans | -123 | 89.2 | 164.2 | -89.8 | -41 | 0 | 0 | 0 | 109.5 | ||||
| 67 | E | 43.8 | Very low | 37.3 | Very low | 188 Ų | 188 | 157.1 Ų | 157.1 | 88% | 0.879 | 81% | 0.811 | S | S | * | * | trans | -71.9 | 119.3 | 152.1 | -66.1 | -153.4 | 163.1 | 0 | 0 | 108.7 | ||||
| 68 | N | 34 | Very low | 37.5 | Very low | 160 Ų | 160 | 157.8 Ų | 157.8 | 86% | 0.856 | 81% | 0.809 | S | S | * | * | trans | -137.9 | 130 | 155.4 | -161.5 | 9.3 | 0 | 0 | 0 | 112.8 | ||||
| 69 | S | 39.4 | Very low | 37.1 | Very low | 81 Ų | 81 | 155 Ų | 155 | 57% | 0.566 | 81% | 0.805 | S | S | * | * | trans | -86.7 | 154.7 | -171.4 | -83 | 0 | 0 | 0 | 0 | 113.2 | ||||
| 70 | K | 38.4 | Very low | 37 | Very low | 195 Ų | 195 | 155.2 Ų | 155.2 | 85% | 0.848 | 80% | 0.802 | S | S | * | * | trans | 67.1 | 120 | 142.3 | -72.6 | 165.5 | -179.8 | 153 | 0 | 119.4 | ||||
| 71 | Q | 33.3 | Very low | 37.2 | Very low | 183 Ų | 183 | 159.3 Ų | 159.3 | 86% | 0.855 | 80% | 0.797 | S | S | * | * | trans | -162.4 | 96.6 | 136.5 | -153.6 | 146.2 | -34.6 | 0 | 0 | 109.4 | ||||
| 72 | S | 37.8 | Very low | 37.6 | Very low | 102 Ų | 102 | 153.7 Ų | 153.7 | 71% | 0.713 | 79% | 0.788 | S | S | * | * | 71.8 | 108.3 | 106.9 | 75.3 | 0 | 0 | 0 | 0 | 115.3 | |||||
| 73 | E | 31.4 | Very low | 37.6 | Very low | 194 Ų | 194 | 154.5 Ų | 154.5 | 91% | 0.907 | 79% | 0.792 | S | S | * | * | trans | -108.7 | 115.9 | 165.8 | -62.2 | -178 | 162.8 | 0 | 0 | 108.3 | ||||
| 74 | D | 35.1 | Very low | 37.6 | Very low | 163 Ų | 163 | 150.3 Ų | 150.3 | 87% | 0.872 | 79% | 0.788 | S | S | * | * | trans | -165.3 | 142.4 | 166.2 | -84.6 | -39.2 | 0 | 0 | 0 | 102.1 | ||||
| 75 | D | 34.6 | Very low | 37.7 | Very low | 147 Ų | 147 | 150.5 Ų | 150.5 | 79% | 0.786 | 79% | 0.794 | S | S | * | * | cis | -167 | 144.7 | 4.2 | 177.2 | 40 | 0 | 0 | 0 | 105.4 | ||||
| 76 | D | 37.1 | Very low | 37.5 | Very low | 131 Ų | 131 | 148.4 Ų | 148.4 | 70% | 0.701 | 79% | 0.788 | S | S | * | * | trans | 13.9 | 122.2 | 155.8 | -148 | 3.2 | 0 | 0 | 0 | 121.9 | ||||
| 77 | S | 40.3 | Very low | 38.1 | Very low | 111 Ų | 111 | 146.3 Ų | 146.3 | 78% | 0.776 | 78% | 0.783 | S | S | * | * | -162.9 | 115.9 | 129.8 | 72.6 | 0 | 0 | 0 | 0 | 112.3 | |||||
| 78 | E | 39.5 | Very low | 38.1 | Very low | 180 Ų | 180 | 145.7 Ų | 145.7 | 84% | 0.841 | 78% | 0.778 | S | S | * | * | trans | -53.6 | 139.7 | 164.9 | -66.4 | -172.3 | 141.6 | 0 | 0 | 113.1 | ||||
| 79 | T | 35.8 | Very low | 38.6 | Very low | 138 Ų | 138 | 145.3 Ų | 145.3 | 85% | 0.847 | 78% | 0.776 | S | S | * | * | trans | -148 | 116.6 | 146.2 | -48.5 | 0 | 0 | 0 | 0 | 109.8 | ||||
| 80 | E | 35.8 | Very low | 38.7 | Very low | 154 Ų | 154 | 146.7 Ų | 146.7 | 72% | 0.72 | 78% | 0.777 | S | S | * | * | trans | -78.7 | 142.6 | -179.1 | -123.6 | -156.5 | 174.2 | 0 | 0 | 112.7 | ||||
| 81 | K | 40.7 | Very low | 39.2 | Very low | 164 Ų | 164 | 142.8 Ų | 142.8 | 71% | 0.713 | 77% | 0.771 | S | S | * | * | trans | 85.4 | 155.9 | 147.1 | -73.3 | -178.9 | 174 | 165.4 | 0 | 121.4 | ||||
| 82 | P | 45.6 | Very low | 39.9 | Very low | 104 Ų | 104 | 139.5 Ų | 139.5 | 68% | 0.675 | 76% | 0.756 | S | S | * | * | cis | -138.9 | 174.6 | -44.1 | 38.8 | -21.2 | 0 | 0 | 0 | 113.7 | ||||
| 83 | E | 37.7 | Very low | 40.7 | Very low | 187 Ų | 187 | 138.6 Ų | 138.6 | 87% | 0.874 | 75% | 0.746 | S | S | * | * | trans | 57 | 109.6 | 152.8 | -73.4 | -176.9 | 165 | 0 | 0 | 120.8 | ||||
| 84 | A | 38.5 | Very low | 41.7 | Very low | 92 Ų | 92 | 138.4 Ų | 138.4 | 76% | 0.76 | 75% | 0.745 | S | S | * | * | -174.4 | 129.4 | 116.9 | 0 | 0 | 0 | 0 | 0 | 111.6 | |||||
| 85 | D | 38.8 | Very low | 42.9 | Very low | 158 Ų | 158 | 139.8 Ų | 139.8 | 85% | 0.845 | 74% | 0.743 | S | S | * | * | trans | 63.2 | 87.8 | 157.6 | -62.5 | -40.4 | 0 | 0 | 0 | 119.7 | P87 | D85-P87 WeakPolarHBondContact O-CD 3.48Š| ||
| 86 | D | 34.3 | Very low | 44.2 | Very low | 129 Ų | 129 | 137.5 Ų | 137.5 | 69% | 0.69 | 72% | 0.724 | S | S | * | * | trans | -67.5 | 114.7 | 160.8 | 171.9 | 33.1 | 0 | 0 | 0 | 111.8 | K88 | D86-K88 WeakPolarHBondContact OD1-CA 3.06Å; D86-K88 PolarHBondContact OD1-N 2.82Å; D86-K88 VanDerWaalsContact OD1-N 3.07Å | ||
| 87 | P | 49 | Very low | 46.4 | Very low | 112 Ų | 112 | 135.1 Ų | 135.1 | 73% | 0.727 | 71% | 0.711 | S | S | * | * | trans | -87.5 | 100 | 150.3 | 31.8 | -19.6 | 0 | 0 | 0 | 106.9 | D85 D89 | D85-P87 WeakPolarHBondContact O-CD 3.48Å; P87-D89 PolarHBondContact O-N 2.97Å | ||
| 88 | K | 43.9 | Very low | 48.4 | Very low | 175 Ų | 175 | 133.8 Ų | 133.8 | 76% | 0.761 | 70% | 0.699 | S | S | * | * | trans | -26.7 | 92.4 | 174.1 | -69.3 | 178 | -179.5 | 177.3 | 0 | 112.9 | D86 N90 | D86-K88 WeakPolarHBondContact OD1-CA 3.06Å; D86-K88 PolarHBondContact OD1-N 2.82Å; D86-K88 VanDerWaalsContact OD1-N 3.07Å; K88-N90 PolarHBondContact O-N 2.99Å | ||
| 89 | D | 43.1 | Very low | 50.3 | Low | 152 Ų | 152 | 129.4 Ų | 129.4 | 81% | 0.813 | 68% | 0.679 | S | S | * | * | trans | -72.8 | 109.1 | 164 | -117.5 | -27.5 | 0 | 0 | 0 | 104.9 | P87 P91 | P87-D89 PolarHBondContact O-N 2.97Å; D89-P91 WeakPolarHBondContact O-CD 3.39Å | ||
| 90 | N | 42.8 | Very low | 52.6 | Low | 110 Ų | 110 | 128.4 Ų | 128.4 | 59% | 0.588 | 67% | 0.665 | S | S | * | * | trans | -68.7 | 106.2 | 173.9 | -101 | 15.5 | 0 | 0 | 0 | 107.7 | K88 E92 V93 | K88-N90 PolarHBondContact O-N 2.99Å; N90-E92 PolarHBondContact O-N 3.38Å; N90-V93 HydrophobicContact CB-CG2 4.42Å | ||
| 91 | P | 48.3 | Very low | 55 | Low | 113 Ų | 113 | 124 Ų | 124 | 73% | 0.734 | 65% | 0.646 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -76.4 | 11.4 | 178.4 | 36.1 | -35.3 | 0 | 0 | 0 | 112.2 | D89 | D89-P91 WeakPolarHBondContact O-CD 3.39Š|
| 92 | E | 48.8 | Very low | 57.2 | Low | 113 Ų | 113 | 119.9 Ų | 119.9 | 53% | 0.528 | 63% | 0.634 | S | S | . | * | T | Hydrogen-bonded Turn | trans | -97.8 | -7.4 | -172.3 | -144.6 | -173.9 | 146.1 | 0 | 0 | 113.4 | N90 R96 | N90-E92 PolarHBondContact O-N 3.38Å; E92-R96 IonicContact OE1-CZ 2.77Å; E92-R96 IonicContact OE1-NH2 3.68Å; E92-R96 PolarHBondContact OE1-NH2 3.3Å; E92-R96 IonicContact OE2-NH2 3.79Å |
| 93 | V | 54.1 | Low | 59.1 | Low | 84 Ų | 84 | 115.7 Ų | 115.7 | 51% | 0.509 | 61% | 0.608 | S | S | . | * | S | Bend | trans | -81.5 | -24.4 | -178.9 | -177.6 | 0 | 0 | 0 | 0 | 112 | N90 K95 | N90-V93 HydrophobicContact CB-CG2 4.42Å; V93-K95 PolarHBondContact O-N 2.93Å |
| 94 | E | 52.8 | Low | 61.4 | Low | 190 Ų | 190 | 109.2 Ų | 109.2 | 89% | 0.888 | 58% | 0.584 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -78 | -11.4 | -175.9 | -85.9 | -169.5 | 148.5 | 0 | 0 | 115.4 | ||
| 95 | K | 58.8 | Low | 63.7 | Low | 192 Ų | 192 | 111.1 Ų | 111.1 | 84% | 0.835 | 58% | 0.575 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -113.2 | -4.3 | -174 | -64.1 | -174.4 | -176.1 | 177.2 | 0 | 115.2 | V93 | V93-K95 PolarHBondContact O-N 2.93Š|
| 96 | R | 62.2 | Low | 65.9 | Low | 99 Ų | 99 | 105 Ų | 105 | 37% | 0.374 | 54% | 0.544 | S | S | . | . | S | Bend | trans | -83 | 135.6 | 179.6 | -66.3 | -159.6 | -165 | 121.3 | 4.5 | 110.1 | E92 L101 | E92-R96 IonicContact OE1-CZ 2.77Å; E92-R96 IonicContact OE1-NH2 3.68Å; E92-R96 PolarHBondContact OE1-NH2 3.3Å; E92-R96 IonicContact OE2-NH2 3.79Å; R96-L101 HydrophobicContact CB-CD2 3.89Å; R96-L101 HydrophobicContact CB-CG 3.98Å |
| 97 | D | 82.8 | Confident | 68.5 | Low | 81 Ų | 81 | 104 Ų | 104 | 43% | 0.433 | 54% | 0.536 | S | S | . | . | trans | -56.2 | 135.9 | 174.3 | 178.8 | 73.7 | 0 | 0 | 0 | 109.4 | Q99 E100 L101 | D97-Q99 PolarHBondContact O-N 3.31Å; D97-Q99 VanDerWaalsContact O-N 3.09Å; D97-Q99 VanDerWaalsContact OD2-CB 3.25Å; D97-Q99 WeakPolarHBondContact OD2-CB 3.29Å; D97-Q99 PolarHBondContact OD2-N 3.02Å; D97-Q99 VanDerWaalsContact OD2-N 3.1Å; D97-Q99 PolarHBondContact OD2-OE1 3.48Å; D97-Q99 VanDerWaalsContact OD2-OE1 3.08Å; D97-E100 HydrophobicContact CB-CB 4.43Å; D97-E100 HydrophobicContact CB-CG 4.14Å; D97-E100 WeakPolarHBondContact O-CB 3.29Å; D97-E100 PolarHBondContact O-N 3.41Å; D97-L101 PolarHBondContact O-N 3.4Å; D97-L101 VanDerWaalsContact O-N 3.13Å | ||
| 98 | P | 82.4 | Confident | 70.3 | Confident | 82 Ų | 82 | 107 Ų | 107 | 53% | 0.532 | 53% | 0.533 | S | S | . | . | H | α-helix | trans | -53.1 | -33.1 | -178.4 | -29 | 36.1 | 0 | 0 | 0 | 113.4 | L101 V102 | P98-L101 PolarHBondContact O-N 3.18Å; P98-V102 WeakPolarHBondContact O-CG2 3.31Å; P98-V102 PolarHBondContact O-N 3.39Å; P98-V102 VanDerWaalsContact O-N 3.13Å |
| 99 | Q | 80.9 | Confident | 72.3 | Confident | 89 Ų | 89 | 100.8 Ų | 100.8 | 42% | 0.416 | 51% | 0.509 | S | S | . | . | H | α-helix | trans | -72.8 | -33 | 178.3 | -71.7 | 69.2 | 10.3 | 0 | 0 | 112 | D97 V102 A103 K183 | D97-Q99 PolarHBondContact O-N 3.31Å; D97-Q99 VanDerWaalsContact O-N 3.09Å; D97-Q99 VanDerWaalsContact OD2-CB 3.25Å; D97-Q99 WeakPolarHBondContact OD2-CB 3.29Å; D97-Q99 PolarHBondContact OD2-N 3.02Å; D97-Q99 VanDerWaalsContact OD2-N 3.1Å; D97-Q99 PolarHBondContact OD2-OE1 3.48Å; D97-Q99 VanDerWaalsContact OD2-OE1 3.08Å; Q99-V102 PolarHBondContact O-N 3.26Å; Q99-A103 WeakPolarHBondContact O-CB 3.5Å; Q99-A103 PolarHBondContact O-N 3.44Å; Q99-K183 HydrophobicContact CG-CD 4.39Å |
| 100 | E | 84.1 | Confident | 74.2 | Confident | 117 Ų | 117 | 99.7 Ų | 99.7 | 55% | 0.547 | 49% | 0.494 | S | S | . | . | H | α-helix | trans | -66.4 | -37.8 | 172 | -70.7 | -173.4 | 166.8 | 0 | 0 | 111.9 | D97 A103 S104 | D97-E100 HydrophobicContact CB-CB 4.43Å; D97-E100 HydrophobicContact CB-CG 4.14Å; D97-E100 WeakPolarHBondContact O-CB 3.29Å; D97-E100 PolarHBondContact O-N 3.41Å; E100-A103 PolarHBondContact O-N 3.06Å; E100-S104 WeakPolarHBondContact O-CB 3.31Å; E100-S104 PolarHBondContact O-N 3.47Å; E100-S104 PolarHBondContact O-OG 3.03Å |
| 101 | L | 86.1 | Confident | 76.3 | Confident | 61 Ų | 61 | 100.5 Ų | 100.5 | 32% | 0.319 | 50% | 0.498 | S | S | . | . | H | α-helix | trans | -62.2 | -45.4 | 174.9 | -68.9 | 175.6 | 0 | 0 | 0 | 111.2 | R96 D97 P98 S104 F105 | R96-L101 HydrophobicContact CB-CD2 3.89Å; R96-L101 HydrophobicContact CB-CG 3.98Å; D97-L101 PolarHBondContact O-N 3.4Å; D97-L101 VanDerWaalsContact O-N 3.13Å; P98-L101 PolarHBondContact O-N 3.18Å; L101-S104 PolarHBondContact O-N 3.29Å; L101-S104 PolarHBondContact O-OG 3.18Å; L101-F105 WeakPolarHBondContact O-CB 3.35Å; L101-F105 PolarHBondContact O-N 2.76Å |
| 102 | V | 85.6 | Confident | 78.2 | Confident | 77 Ų | 77 | 98.6 Ų | 98.6 | 47% | 0.467 | 48% | 0.48 | S | S | . | . | H | α-helix | trans | -62.5 | -45.4 | 176.1 | 176.3 | 0 | 0 | 0 | 0 | 111 | P98 Q99 S104 F105 S106 P182 | P98-V102 WeakPolarHBondContact O-CG2 3.31Å; P98-V102 PolarHBondContact O-N 3.39Å; P98-V102 VanDerWaalsContact O-N 3.13Å; Q99-V102 PolarHBondContact O-N 3.26Å; V102-S104 PolarHBondContact O-N 2.82Å; V102-F105 PolarHBondContact O-N 3.42Å; V102-S106 WeakPolarHBondContact O-CB 3.29Å; V102-S106 PolarHBondContact O-N 2.85Å; V102-S106 PolarHBondContact O-OG 3.27Å; V102-P182 HydrophobicContact CG1-CB 4.31Å |
| 103 | A | 86.3 | Confident | 80 | Confident | 16 Ų | 16 | 95.3 Ų | 95.3 | 13% | 0.132 | 47% | 0.47 | C | S | . | . | H | α-helix | trans | -60.4 | -46.3 | 177.8 | 0 | 0 | 0 | 0 | 0 | 112 | Q99 E100 F105 S106 E107 P182 | Q99-A103 WeakPolarHBondContact O-CB 3.5Å; Q99-A103 PolarHBondContact O-N 3.44Å; E100-A103 PolarHBondContact O-N 3.06Å; A103-F105 VanDerWaalsContact C-N 3.34Å; A103-F105 PolarHBondContact O-N 3.08Å; A103-S106 PolarHBondContact O-N 2.84Å; A103-E107 WeakPolarHBondContact O-CB 3.27Å; A103-E107 PolarHBondContact O-N 3.38Å; A103-P182 HydrophobicContact CB-CB 4.18Å |
| 104 | S | 85.7 | Confident | 81.4 | Confident | 52 Ų | 52 | 96.5 Ų | 96.5 | 36% | 0.364 | 48% | 0.479 | S | S | . | . | H | α-helix | trans | -63.6 | -37.8 | 178.6 | 72 | 0 | 0 | 0 | 0 | 112.7 | E100 L101 V102 R108 | E100-S104 WeakPolarHBondContact O-CB 3.31Å; E100-S104 PolarHBondContact O-N 3.47Å; E100-S104 PolarHBondContact O-OG 3.03Å; L101-S104 PolarHBondContact O-N 3.29Å; L101-S104 PolarHBondContact O-OG 3.18Å; V102-S104 PolarHBondContact O-N 2.82Å; S104-R108 WeakPolarHBondContact O-CB 3.44Å; S104-R108 PolarHBondContact O-N 2.92Å |
| 105 | F | 86.1 | Confident | 82.9 | Confident | 131 Ų | 131 | 94.7 Ų | 94.7 | 58% | 0.575 | 48% | 0.476 | S | S | * | . | H | α-helix | trans | -66 | -48.6 | 174 | 176.3 | -100.3 | 0 | 0 | 0 | 111 | L101 V102 A103 E107 R108 V109 | L101-F105 WeakPolarHBondContact O-CB 3.35Å; L101-F105 PolarHBondContact O-N 2.76Å; V102-F105 PolarHBondContact O-N 3.42Å; A103-F105 VanDerWaalsContact C-N 3.34Å; A103-F105 PolarHBondContact O-N 3.08Å; F105-E107 VanDerWaalsContact C-N 3.31Å; F105-E107 PolarHBondContact O-N 2.82Å; F105-R108 PolarHBondContact O-N 3.13Å; F105-V109 HydrophobicContact CD1-CG2 4.25Å; F105-V109 HydrophobicContact CD2-CG2 4.38Å; F105-V109 HydrophobicContact CE1-CG2 3.79Å; F105-V109 HydrophobicContact CE2-CG2 3.93Å; F105-V109 HydrophobicContact CZ-CG2 3.61Å; F105-V109 WeakPolarHBondContact O-CG2 3.41Å; F105-V109 PolarHBondContact O-N 3.39Å |
| 106 | S | 86.8 | Confident | 84.1 | Confident | 29 Ų | 29 | 91 Ų | 91 | 20% | 0.203 | 46% | 0.462 | C | S | . | . | H | α-helix | trans | -60.2 | -39 | 176.6 | -67.5 | 0 | 0 | 0 | 0 | 112.3 | V102 A103 R110 | V102-S106 WeakPolarHBondContact O-CB 3.29Å; V102-S106 PolarHBondContact O-N 2.85Å; V102-S106 PolarHBondContact O-OG 3.27Å; A103-S106 PolarHBondContact O-N 2.84Å; S106-R110 WeakPolarHBondContact O-CB 3.49Å; S106-R110 WeakPolarHBondContact O-CG 3.32Å; S106-R110 PolarHBondContact O-N 2.96Å; S106-R110 PolarHBondContact O-NE 2.83Å |
| 107 | E | 87 | Confident | 85.3 | Confident | 109 Ų | 109 | 90.7 Ų | 90.7 | 51% | 0.509 | 47% | 0.466 | S | S | . | . | H | α-helix | trans | -62.8 | -47.6 | 172.9 | -174.2 | 177.5 | -169.6 | 0 | 0 | 112 | A103 F105 V109 R110 N111 | A103-E107 WeakPolarHBondContact O-CB 3.27Å; A103-E107 PolarHBondContact O-N 3.38Å; F105-E107 VanDerWaalsContact C-N 3.31Å; F105-E107 PolarHBondContact O-N 2.82Å; E107-V109 PolarHBondContact O-N 3.09Å; E107-R110 PolarHBondContact O-N 3.28Å; E107-N111 VanDerWaalsContact O-CG 3.29Å; E107-N111 PolarHBondContact O-N 2.87Å; E107-N111 VanDerWaalsContact O-N 3.11Å; E107-N111 PolarHBondContact O-ND2 3.42Å; E107-N111 VanDerWaalsContact O-ND2 3.11Å |
| 108 | R | 87 | Confident | 85.3 | Confident | 175 Ų | 175 | 95 Ų | 95 | 66% | 0.66 | 48% | 0.481 | S | S | * | . | H | α-helix | trans | -59.7 | -43.9 | 177 | 172.1 | 162.8 | -98 | -172.1 | -6.3 | 112.3 | S104 F105 N111 M112 | S104-R108 WeakPolarHBondContact O-CB 3.44Å; S104-R108 PolarHBondContact O-N 2.92Å; F105-R108 PolarHBondContact O-N 3.13Å; R108-N111 PolarHBondContact O-N 3.4Å; R108-M112 HydrophobicContact CG-CE 3.85Å; R108-M112 PolarHBondContact O-N 2.94Å |
| 109 | V | 85.9 | Confident | 85.5 | Confident | 45 Ų | 45 | 98.9 Ų | 98.9 | 27% | 0.273 | 50% | 0.495 | S | S | . | . | H | α-helix | trans | -64.9 | -40.9 | 177.7 | 173.7 | 0 | 0 | 0 | 0 | 111.3 | F105 E107 N111 M112 I117 | F105-V109 HydrophobicContact CD1-CG2 4.25Å; F105-V109 HydrophobicContact CD2-CG2 4.38Å; F105-V109 HydrophobicContact CE1-CG2 3.79Å; F105-V109 HydrophobicContact CE2-CG2 3.93Å; F105-V109 HydrophobicContact CZ-CG2 3.61Å; F105-V109 WeakPolarHBondContact O-CG2 3.41Å; F105-V109 PolarHBondContact O-N 3.39Å; E107-V109 PolarHBondContact O-N 3.09Å; V109-N111 PolarHBondContact O-N 3.48Å; V109-M112 PolarHBondContact O-N 3.13Å; V109-I117 HydrophobicContact CG1-CD1 4.2Å |
| 110 | R | 84.3 | Confident | 85.6 | Confident | 129 Ų | 129 | 99.3 Ų | 99.3 | 49% | 0.487 | 51% | 0.506 | S | S | . | . | H | α-helix | trans | -62.4 | -28.2 | 176.6 | -76.7 | -178.7 | -65 | 178 | 1.1 | 113.3 | S106 E107 D184 | S106-R110 WeakPolarHBondContact O-CB 3.49Å; S106-R110 WeakPolarHBondContact O-CG 3.32Å; S106-R110 PolarHBondContact O-N 2.96Å; S106-R110 PolarHBondContact O-NE 2.83Å; E107-R110 PolarHBondContact O-N 3.28Å; R110-D184 IonicContact NH2-OD2 2.81Å |
| 111 | N | 87.4 | Confident | 85.6 | Confident | 127 Ų | 127 | 99.4 Ų | 99.4 | 68% | 0.679 | 52% | 0.517 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -91 | -5.6 | -179.5 | -66.3 | -31.2 | 0 | 0 | 0 | 113.6 | E107 R108 V109 | E107-N111 VanDerWaalsContact O-CG 3.29Å; E107-N111 PolarHBondContact O-N 2.87Å; E107-N111 VanDerWaalsContact O-N 3.11Å; E107-N111 PolarHBondContact O-ND2 3.42Å; E107-N111 VanDerWaalsContact O-ND2 3.11Å; R108-N111 PolarHBondContact O-N 3.4Å; V109-N111 PolarHBondContact O-N 3.48Å |
| 112 | M | 87.3 | Confident | 85.4 | Confident | 73 Ų | 73 | 105.3 Ų | 105.3 | 36% | 0.36 | 54% | 0.543 | S | S | . | . | S | Bend | trans | -85.2 | 152 | 174.7 | -78.9 | 179.7 | 177.6 | 0 | 0 | 111.5 | R108 V109 E116 I117 | R108-M112 HydrophobicContact CG-CE 3.85Å; R108-M112 PolarHBondContact O-N 2.94Å; V109-M112 PolarHBondContact O-N 3.13Å; M112-E116 HydrophobicContact CB-CB 4.32Å; M112-I117 HydrophobicContact CB-CG1 4.43Å |
| 113 | S | 85.8 | Confident | 85.3 | Confident | 44 Ų | 44 | 107.1 Ų | 107.1 | 31% | 0.308 | 56% | 0.556 | S | S | . | * | trans | -69.8 | 149.6 | 168.8 | 70.3 | 0 | 0 | 0 | 0 | 110.1 | D115 E116 I117 | S113-D115 PolarHBondContact O-N 3.37Å; S113-D115 VanDerWaalsContact O-N 3.1Å; S113-E116 WeakPolarHBondContact O-CB 3.42Å; S113-E116 PolarHBondContact O-N 2.99Å; S113-E116 VanDerWaalsContact OG-CG 3.27Å; S113-E116 WeakPolarHBondContact OG-CG 3.27Å; S113-E116 PolarHBondContact OG-OE1 3.2Å; S113-I117 PolarHBondContact O-N 2.97Å | ||
| 114 | P | 83.9 | Confident | 85 | Confident | 109 Ų | 109 | 112.9 Ų | 112.9 | 71% | 0.708 | 59% | 0.593 | S | S | * | * | G | 310 helix | trans | -54.9 | -32.1 | -179.3 | -27.5 | 35.3 | 0 | 0 | 0 | 114 | E116 I117 | P114-E116 VanDerWaalsContact C-N 3.29Å; P114-E116 PolarHBondContact O-N 3.32Å; P114-I117 PolarHBondContact O-N 3.39Å |
| 115 | D | 85.3 | Confident | 84.8 | Confident | 152 Ų | 152 | 113.9 Ų | 113.9 | 81% | 0.813 | 61% | 0.611 | S | S | * | * | G | 310 helix | trans | -73.4 | -20.2 | 180 | -62.6 | -28 | 0 | 0 | 0 | 113.2 | S113 | S113-D115 PolarHBondContact O-N 3.37Å; S113-D115 VanDerWaalsContact O-N 3.1Å |
| 116 | E | 84.1 | Confident | 84.5 | Confident | 115 Ų | 115 | 119.2 Ų | 119.2 | 54% | 0.537 | 63% | 0.627 | S | S | . | * | G | 310 helix | trans | -86.2 | -15.9 | 176 | -72.7 | 163.5 | -143.3 | 0 | 0 | 112.6 | M112 S113 P114 K118 | M112-E116 HydrophobicContact CB-CB 4.32Å; S113-E116 WeakPolarHBondContact O-CB 3.42Å; S113-E116 PolarHBondContact O-N 2.99Å; S113-E116 VanDerWaalsContact OG-CG 3.27Å; S113-E116 WeakPolarHBondContact OG-CG 3.27Å; S113-E116 PolarHBondContact OG-OE1 3.2Å; P114-E116 VanDerWaalsContact C-N 3.29Å; P114-E116 PolarHBondContact O-N 3.32Å; E116-K118 PolarHBondContact O-N 3.42Å; E116-K118 VanDerWaalsContact O-N 3.08Å |
| 117 | I | 86.1 | Confident | 84.4 | Confident | 91 Ų | 91 | 122 Ų | 122 | 47% | 0.467 | 65% | 0.645 | S | S | . | * | trans | -73 | 104 | 178.5 | -56.6 | 176.2 | 0 | 0 | 0 | 108.9 | V109 M112 S113 P114 | V109-I117 HydrophobicContact CG1-CD1 4.2Å; M112-I117 HydrophobicContact CB-CG1 4.43Å; S113-I117 PolarHBondContact O-N 2.97Å; P114-I117 PolarHBondContact O-N 3.39Å | ||
| 118 | K | 84.4 | Confident | 84.5 | Confident | 173 Ų | 173 | 120.3 Ų | 120.3 | 75% | 0.752 | 65% | 0.646 | S | S | * | * | trans | -109.7 | 146.4 | 176.9 | -67.1 | 177.3 | -176.7 | 172.4 | 0 | 110.5 | E116 | E116-K118 PolarHBondContact O-N 3.42Å; E116-K118 VanDerWaalsContact O-N 3.08Å | ||
| 119 | I | 86 | Confident | 84.8 | Confident | 162 Ų | 162 | 117.6 Ų | 117.6 | 83% | 0.831 | 64% | 0.644 | S | S | * | * | P | Polyproline II helix | trans | -59.4 | 133.9 | 168.5 | -58.1 | 177 | 0 | 0 | 0 | 107.5 | ||
| 120 | P | 82.6 | Confident | 85.1 | Confident | 99 Ų | 99 | 121.4 Ų | 121.4 | 64% | 0.643 | 66% | 0.659 | S | S | * | * | P | Polyproline II helix | trans | -52.3 | 146.1 | 175.3 | -26 | 33.7 | 0 | 0 | 0 | 111.7 | ||
| 121 | P | 83.8 | Confident | 85.5 | Confident | 119 Ų | 119 | 119.5 Ų | 119.5 | 77% | 0.773 | 66% | 0.658 | S | S | * | * | P | Polyproline II helix | trans | -60.3 | 155.6 | 173.2 | 28.2 | -34.6 | 0 | 0 | 0 | 110.4 | ||
| 122 | E | 81.9 | Confident | 85.8 | Confident | 184 Ų | 184 | 117.6 Ų | 117.6 | 86% | 0.86 | 65% | 0.645 | S | S | * | * | P | Polyproline II helix | trans | -54.5 | 134.7 | 178.2 | -68 | -179.9 | -177.7 | 0 | 0 | 110.5 | ||
| 123 | P | 83.4 | Confident | 86.1 | Confident | 115 Ų | 115 | 119 Ų | 119 | 75% | 0.747 | 65% | 0.654 | S | S | * | * | P | Polyproline II helix | trans | -61.1 | 136.3 | -177.9 | 24.3 | -32.8 | 0 | 0 | 0 | 110.1 | G125 | P123-G125 PolarHBondContact O-N 2.92Š|
| 124 | P | 80 | Confident | 86.6 | Confident | 138 Ų | 138 | 122 Ų | 122 | 90% | 0.896 | 66% | 0.661 | S | S | * | * | S | Bend | trans | -68.7 | 122.3 | 177.6 | 27.6 | -32.7 | 0 | 0 | 0 | 109.9 | ||
| 125 | G | 81.6 | Confident | 87 | Confident | 72 Ų | 72 | 121.5 Ų | 121.5 | 74% | 0.742 | 65% | 0.652 | S | S | * | * | S | Bend | trans | 146.5 | 160 | 175 | 0 | 0 | 0 | 0 | 0 | 113.3 | P123 | P123-G125 PolarHBondContact O-N 2.92Š|
| 126 | R | 81.1 | Confident | 87.4 | Confident | 243 Ų | 243 | 119.4 Ų | 119.4 | 92% | 0.917 | 64% | 0.637 | S | S | * | * | P | Polyproline II helix | trans | -88.7 | 134.5 | 167.5 | -67.9 | -178.2 | -179 | -106.6 | 0.6 | 108.3 | ||
| 127 | C | 83.1 | Confident | 87.9 | Confident | 88 Ų | 88 | 121.4 Ų | 121.4 | 60% | 0.595 | 64% | 0.644 | S | S | * | * | P | Polyproline II helix | trans | -58.4 | 151 | 171.6 | -59.5 | 0 | 0 | 0 | 0 | 110.2 | N129 Q132 | C127-N129 PolarHBondContact O-N 3.29Å; C127-Q132 HydrophobicContact CB-CG 3.84Å; C127-Q132 PolarHBondContact O-NE2 3.1Å |
| 128 | S | 90.4 | Very high | 88.1 | Confident | 73 Ų | 73 | 120.7 Ų | 120.7 | 51% | 0.51 | 64% | 0.641 | S | S | . | * | P | Polyproline II helix | trans | -53.3 | 126.9 | 174 | 170.8 | 0 | 0 | 0 | 0 | 111.1 | H130 L131 Q132 | S128-H130 VanDerWaalsContact C-N 3.28Å; S128-H130 PolarHBondContact O-N 3.28Å; S128-L131 PolarHBondContact O-N 2.97Å; S128-L131 VanDerWaalsContact O-N 3.11Å; S128-Q132 WeakPolarHBondContact O-CG 3.47Å; S128-Q132 PolarHBondContact O-N 3.42Å |
| 129 | N | 92 | Very high | 88.4 | Confident | 118 Ų | 118 | 119.7 Ų | 119.7 | 63% | 0.631 | 63% | 0.633 | S | S | * | * | H | α-helix | trans | -57.4 | -42.4 | -178.9 | -68.1 | -52.3 | 0 | 0 | 0 | 111.3 | C127 L131 Q132 D133 | C127-N129 PolarHBondContact O-N 3.29Å; N129-L131 VanDerWaalsContact C-N 3.28Å; N129-L131 PolarHBondContact O-N 3.45Å; N129-Q132 PolarHBondContact O-N 3.1Å; N129-D133 PolarHBondContact O-N 3.48Å |
| 130 | H | 93.1 | Very high | 88.8 | Confident | 125 Ų | 125 | 115.3 Ų | 115.3 | 58% | 0.579 | 61% | 0.609 | S | S | * | * | H | α-helix | trans | -59.3 | -38.1 | 178 | -178.9 | 69.5 | 0 | 0 | 0 | 112.9 | S128 K134 | S128-H130 VanDerWaalsContact C-N 3.28Å; S128-H130 PolarHBondContact O-N 3.28Å; H130-K134 PolarHBondContact NE2-NZ 3.49Å; H130-K134 WeakPolarHBondContact O-CB 3.3Å; H130-K134 PolarHBondContact O-N 3.33Å; H130-K134 VanDerWaalsContact O-N 3.1Å |
| 131 | L | 92.6 | Very high | 89.2 | Confident | 90 Ų | 90 | 114.5 Ų | 114.5 | 47% | 0.471 | 59% | 0.593 | S | S | . | * | H | α-helix | trans | -71.9 | -41.4 | 178.2 | -173.2 | 66.5 | 0 | 0 | 0 | 111.2 | S128 N129 K134 I135 | S128-L131 PolarHBondContact O-N 2.97Å; S128-L131 VanDerWaalsContact O-N 3.11Å; N129-L131 VanDerWaalsContact C-N 3.28Å; N129-L131 PolarHBondContact O-N 3.45Å; L131-K134 PolarHBondContact O-N 2.93Å; L131-I135 HydrophobicContact CD1-CD1 4.36Å; L131-I135 HydrophobicContact CD2-CD1 4.5Å; L131-I135 HydrophobicContact CG-CD1 3.93Å; L131-I135 VanDerWaalsContact O-CG1 3.29Å; L131-I135 WeakPolarHBondContact O-CG1 3.25Å; L131-I135 PolarHBondContact O-N 3.19Å |
| 132 | Q | 93 | Very high | 89.5 | Confident | 87 Ų | 87 | 114.5 Ų | 114.5 | 41% | 0.407 | 58% | 0.581 | S | S | . | * | H | α-helix | trans | -59.1 | -47.6 | 175.6 | -67.8 | -176.9 | 55.4 | 0 | 0 | 111.1 | C127 S128 N129 K134 I135 Q136 | C127-Q132 HydrophobicContact CB-CG 3.84Å; C127-Q132 PolarHBondContact O-NE2 3.1Å; S128-Q132 WeakPolarHBondContact O-CG 3.47Å; S128-Q132 PolarHBondContact O-N 3.42Å; N129-Q132 PolarHBondContact O-N 3.1Å; Q132-K134 VanDerWaalsContact C-N 3.33Å; Q132-K134 PolarHBondContact O-N 3.42Å; Q132-I135 PolarHBondContact O-N 2.89Å; Q132-Q136 VanDerWaalsContact O-CB 3.31Å; Q132-Q136 WeakPolarHBondContact O-CB 3.33Å; Q132-Q136 PolarHBondContact O-N 3.08Å |
| 133 | D | 95.1 | Very high | 90 | Very high | 101 Ų | 101 | 110.9 Ų | 110.9 | 54% | 0.54 | 57% | 0.567 | S | S | . | * | H | α-helix | trans | -62.1 | -40.7 | 178.1 | -66.6 | -24.5 | 0 | 0 | 0 | 111.8 | N129 Q136 K137 | N129-D133 PolarHBondContact O-N 3.48Å; D133-Q136 PolarHBondContact O-N 3Å; D133-K137 VanDerWaalsContact O-CB 3.29Å; D133-K137 WeakPolarHBondContact O-CB 3.29Å; D133-K137 PolarHBondContact O-N 3.28Å |
| 134 | K | 94.6 | Very high | 90.4 | Very high | 107 Ų | 107 | 112.9 Ų | 112.9 | 47% | 0.465 | 56% | 0.564 | S | S | . | * | H | α-helix | trans | -62.9 | -47.5 | 176.7 | -174.3 | 176.5 | -66.3 | 174.8 | 0 | 111.4 | H130 L131 Q132 K137 L138 | H130-K134 PolarHBondContact NE2-NZ 3.49Å; H130-K134 WeakPolarHBondContact O-CB 3.3Å; H130-K134 PolarHBondContact O-N 3.33Å; H130-K134 VanDerWaalsContact O-N 3.1Å; L131-K134 PolarHBondContact O-N 2.93Å; Q132-K134 VanDerWaalsContact C-N 3.33Å; Q132-K134 PolarHBondContact O-N 3.42Å; K134-K137 PolarHBondContact O-N 3.28Å; K134-L138 HydrophobicContact CG-CD1 4.49Å; K134-L138 VanDerWaalsContact O-CG 3.29Å; K134-L138 WeakPolarHBondContact O-CG 3.42Å; K134-L138 PolarHBondContact O-N 3.11Å |
| 135 | I | 93.7 | Very high | 90.7 | Very high | 100 Ų | 100 | 112.8 Ų | 112.8 | 51% | 0.513 | 55% | 0.551 | S | S | . | * | H | α-helix | trans | -63.5 | -44.8 | 177.8 | -68.2 | 168.6 | 0 | 0 | 0 | 110.1 | L131 Q132 K137 L138 Y139 | L131-I135 HydrophobicContact CD1-CD1 4.36Å; L131-I135 HydrophobicContact CD2-CD1 4.5Å; L131-I135 HydrophobicContact CG-CD1 3.93Å; L131-I135 VanDerWaalsContact O-CG1 3.29Å; L131-I135 WeakPolarHBondContact O-CG1 3.25Å; L131-I135 PolarHBondContact O-N 3.19Å; Q132-I135 PolarHBondContact O-N 2.89Å; I135-K137 PolarHBondContact O-N 3Å; I135-L138 PolarHBondContact O-N 3.29Å; I135-Y139 WeakPolarHBondContact O-CB 3.38Å; I135-Y139 PolarHBondContact O-N 3.21Å |
| 136 | Q | 93.6 | Very high | 90.9 | Very high | 107 Ų | 107 | 112.2 Ų | 112.2 | 50% | 0.5 | 55% | 0.546 | S | S | . | . | H | α-helix | trans | -60 | -47.5 | 177.8 | -179 | 174.3 | -15.2 | 0 | 0 | 111.3 | Q132 D133 L138 Y139 E140 | Q132-Q136 VanDerWaalsContact O-CB 3.31Å; Q132-Q136 WeakPolarHBondContact O-CB 3.33Å; Q132-Q136 PolarHBondContact O-N 3.08Å; D133-Q136 PolarHBondContact O-N 3Å; Q136-L138 VanDerWaalsContact C-N 3.33Å; Q136-L138 PolarHBondContact O-N 3.25Å; Q136-Y139 PolarHBondContact O-N 3.45Å; Q136-E140 HydrophobicContact CG-CG 4.39Å; Q136-E140 WeakPolarHBondContact CG-OE1 3.45Å; Q136-E140 PolarHBondContact NE2-OE1 3.26Å; Q136-E140 WeakPolarHBondContact O-CB 3.38Å; Q136-E140 WeakPolarHBondContact O-CG 3.36Å; Q136-E140 PolarHBondContact O-N 2.82Å |
| 137 | K | 93.4 | Very high | 91 | Very high | 158 Ų | 158 | 103.6 Ų | 103.6 | 69% | 0.687 | 52% | 0.517 | S | S | * | . | H | α-helix | trans | -59.4 | -42.4 | 176.9 | -174.1 | 174.9 | -178.1 | 175 | 0 | 112.1 | D133 K134 I135 R141 | D133-K137 VanDerWaalsContact O-CB 3.29Å; D133-K137 WeakPolarHBondContact O-CB 3.29Å; D133-K137 PolarHBondContact O-N 3.28Å; K134-K137 PolarHBondContact O-N 3.28Å; I135-K137 PolarHBondContact O-N 3Å; K137-R141 VanDerWaalsContact O-CB 3.31Å; K137-R141 WeakPolarHBondContact O-CB 3.45Å; K137-R141 PolarHBondContact O-N 3.11Å |
| 138 | L | 90.5 | Very high | 91.3 | Very high | 76 Ų | 76 | 102.8 Ų | 102.8 | 40% | 0.398 | 51% | 0.506 | S | S | . | . | H | α-helix | trans | -65.4 | -41.2 | 176 | -71.1 | 176.8 | 0 | 0 | 0 | 112.2 | K134 I135 Q136 R141 K142 M149 | K134-L138 HydrophobicContact CG-CD1 4.49Å; K134-L138 VanDerWaalsContact O-CG 3.29Å; K134-L138 WeakPolarHBondContact O-CG 3.42Å; K134-L138 PolarHBondContact O-N 3.11Å; I135-L138 PolarHBondContact O-N 3.29Å; Q136-L138 VanDerWaalsContact C-N 3.33Å; Q136-L138 PolarHBondContact O-N 3.25Å; L138-R141 PolarHBondContact O-N 3.49Å; L138-K142 PolarHBondContact O-N 3.25Å; L138-M149 HydrophobicContact CD2-CE 4.25Å |
| 139 | Y | 91.7 | Very high | 91.1 | Very high | 151 Ų | 151 | 103.1 Ų | 103.1 | 59% | 0.592 | 50% | 0.501 | S | S | * | . | H | α-helix | trans | -65.9 | -47.4 | 178.3 | -178.6 | -98.2 | 0 | 0 | 0 | 111.8 | I135 Q136 R141 K142 I143 | I135-Y139 WeakPolarHBondContact O-CB 3.38Å; I135-Y139 PolarHBondContact O-N 3.21Å; Q136-Y139 PolarHBondContact O-N 3.45Å; Y139-R141 VanDerWaalsContact C-N 3.29Å; Y139-R141 PolarHBondContact O-N 2.86Å; Y139-K142 WeakPolarHBondContact O-CB 3.25Å; Y139-K142 PolarHBondContact O-N 3.13Å; Y139-I143 HydrophobicContact CD1-CG1 4.35Å; Y139-I143 HydrophobicContact CE1-CG1 3.94Å; Y139-I143 HydrophobicContact CE2-CD1 4.5Å; Y139-I143 HydrophobicContact CE2-CG1 4.34Å; Y139-I143 WeakPolarHBondContact O-CG1 3.41Å; Y139-I143 PolarHBondContact O-N 3.19Å |
| 140 | E | 93.7 | Very high | 91.1 | Very high | 70 Ų | 70 | 102 Ų | 102 | 33% | 0.327 | 50% | 0.495 | S | S | . | . | H | α-helix | trans | -59.3 | -42.5 | 176.2 | -74.6 | -173.3 | -153.7 | 0 | 0 | 111.7 | Q136 I143 K144 | Q136-E140 HydrophobicContact CG-CG 4.39Å; Q136-E140 WeakPolarHBondContact CG-OE1 3.45Å; Q136-E140 PolarHBondContact NE2-OE1 3.26Å; Q136-E140 WeakPolarHBondContact O-CB 3.38Å; Q136-E140 WeakPolarHBondContact O-CG 3.36Å; Q136-E140 PolarHBondContact O-N 2.82Å; E140-I143 PolarHBondContact O-N 3.27Å; E140-K144 HydrophobicContact CB-CD 4.46Å; E140-K144 VanDerWaalsContact O-CB 3.27Å; E140-K144 WeakPolarHBondContact O-CB 3.47Å; E140-K144 VanDerWaalsContact O-CG 3.32Å; E140-K144 WeakPolarHBondContact O-CG 3.43Å; E140-K144 PolarHBondContact O-N 2.93Å; E140-K144 IonicContact OE2-NZ 3.76Å; E140-K144 PolarHBondContact OE2-NZ 3.03Å |
| 141 | R | 90.7 | Very high | 91 | Very high | 83 Ų | 83 | 101.5 Ų | 101.5 | 31% | 0.313 | 49% | 0.489 | S | S | . | . | H | α-helix | trans | -62.4 | -43 | 175.4 | 178.7 | 158.2 | 63.5 | 162.1 | 3.2 | 112.3 | K137 L138 Y139 I143 E145 M147 | K137-R141 VanDerWaalsContact O-CB 3.31Å; K137-R141 WeakPolarHBondContact O-CB 3.45Å; K137-R141 PolarHBondContact O-N 3.11Å; L138-R141 PolarHBondContact O-N 3.49Å; Y139-R141 VanDerWaalsContact C-N 3.29Å; Y139-R141 PolarHBondContact O-N 2.86Å; R141-I143 VanDerWaalsContact C-N 3.3Å; R141-I143 PolarHBondContact O-N 2.92Å; R141-E145 VanDerWaalsContact CD-OE2 3.3Å; R141-E145 WeakPolarHBondContact CD-OE2 3.4Å; R141-E145 HydrophobicContact CG-CB 4.35Å; R141-E145 HydrophobicContact CG-CG 4.31Å; R141-E145 VanDerWaalsContact CG-OE2 3.25Å; R141-E145 WeakPolarHBondContact CG-OE2 3.2Å; R141-E145 WeakPolarHBondContact O-CB 3.18Å; R141-E145 PolarHBondContact O-N 2.81Å; R141-M147 VanDerWaalsContact CD-SD 3.58Å; R141-M147 HydrophobicContact CG-CB 4Å; R141-M147 HydrophobicContact CG-SD 3.9Å |
| 142 | K | 91.6 | Very high | 91 | Very high | 119 Ų | 119 | 99.7 Ų | 99.7 | 52% | 0.517 | 48% | 0.479 | S | S | . | . | H | α-helix | trans | -57.4 | -43.9 | 174.6 | 179.1 | -177.9 | 175 | 176.9 | 0 | 111.6 | L138 Y139 G146 | L138-K142 PolarHBondContact O-N 3.25Å; Y139-K142 WeakPolarHBondContact O-CB 3.25Å; Y139-K142 PolarHBondContact O-N 3.13Å; K142-G146 VanDerWaalsContact O-CA 3.29Å; K142-G146 WeakPolarHBondContact O-CA 3.12Å; K142-G146 PolarHBondContact O-N 2.95Å |
| 143 | I | 92.1 | Very high | 90.9 | Very high | 108 Ų | 108 | 98.8 Ų | 98.8 | 55% | 0.554 | 48% | 0.476 | S | S | * | . | H | α-helix | trans | -76.6 | -43 | -177 | -62.4 | -62.2 | 0 | 0 | 0 | 112.4 | Y139 E140 R141 | Y139-I143 HydrophobicContact CD1-CG1 4.35Å; Y139-I143 HydrophobicContact CE1-CG1 3.94Å; Y139-I143 HydrophobicContact CE2-CD1 4.5Å; Y139-I143 HydrophobicContact CE2-CG1 4.34Å; Y139-I143 WeakPolarHBondContact O-CG1 3.41Å; Y139-I143 PolarHBondContact O-N 3.19Å; E140-I143 PolarHBondContact O-N 3.27Å; R141-I143 VanDerWaalsContact C-N 3.3Å; R141-I143 PolarHBondContact O-N 2.92Å |
| 144 | K | 90.9 | Very high | 90.7 | Very high | 157 Ų | 157 | 98.5 Ų | 98.5 | 68% | 0.683 | 47% | 0.471 | S | S | * | . | H | α-helix | trans | -80.1 | -45 | -174.7 | -69.1 | 171.5 | 179.3 | 166.8 | 0 | 112.8 | E140 | E140-K144 HydrophobicContact CB-CD 4.46Å; E140-K144 VanDerWaalsContact O-CB 3.27Å; E140-K144 WeakPolarHBondContact O-CB 3.47Å; E140-K144 VanDerWaalsContact O-CG 3.32Å; E140-K144 WeakPolarHBondContact O-CG 3.43Å; E140-K144 PolarHBondContact O-N 2.93Å; E140-K144 IonicContact OE2-NZ 3.76Å; E140-K144 PolarHBondContact OE2-NZ 3.03Å |
| 145 | E | 86.6 | Confident | 90.5 | Very high | 135 Ų | 135 | 100.3 Ų | 100.3 | 63% | 0.631 | 48% | 0.475 | S | S | * | . | H | α-helix | trans | -96.3 | -5.3 | -174.5 | -60.9 | 170.4 | -154 | 0 | 0 | 112.3 | R141 M147 | R141-E145 VanDerWaalsContact CD-OE2 3.3Å; R141-E145 WeakPolarHBondContact CD-OE2 3.4Å; R141-E145 HydrophobicContact CG-CB 4.35Å; R141-E145 HydrophobicContact CG-CG 4.31Å; R141-E145 VanDerWaalsContact CG-OE2 3.25Å; R141-E145 WeakPolarHBondContact CG-OE2 3.2Å; R141-E145 WeakPolarHBondContact O-CB 3.18Å; R141-E145 PolarHBondContact O-N 2.81Å; E145-M147 HydrophobicContact CB-CB 4.41Å; E145-M147 PolarHBondContact O-N 3.44Å |
| 146 | G | 85.9 | Confident | 90.6 | Very high | 61 Ų | 61 | 101 Ų | 101 | 63% | 0.629 | 47% | 0.474 | S | S | * | . | trans | 64.6 | 21.6 | -173.1 | 0 | 0 | 0 | 0 | 0 | 113 | K142 D148 | K142-G146 VanDerWaalsContact O-CA 3.29Å; K142-G146 WeakPolarHBondContact O-CA 3.12Å; K142-G146 PolarHBondContact O-N 2.95Å; G146-D148 PolarHBondContact O-N 2.95Å | ||
| 147 | M | 83.3 | Confident | 90.6 | Very high | 62 Ų | 62 | 103.3 Ų | 103.3 | 31% | 0.305 | 48% | 0.483 | S | S | . | . | trans | -73.6 | 95.2 | -175.3 | -161.7 | 176.1 | -150.3 | 0 | 0 | 110.8 | R141 E145 M149 I152 | R141-M147 VanDerWaalsContact CD-SD 3.58Å; R141-M147 HydrophobicContact CG-CB 4Å; R141-M147 HydrophobicContact CG-SD 3.9Å; E145-M147 HydrophobicContact CB-CB 4.41Å; E145-M147 PolarHBondContact O-N 3.44Å; M147-M149 HydrophobicContact CE-CE 4.47Å; M147-M149 HydrophobicContact CG-CE 4.13Å; M147-M149 PolarHBondContact O-N 3.39Å; M147-M149 HydrophobicContact SD-CE 3.67Å; M147-I152 HydrophobicContact CE-CD1 3.63Å; M147-I152 HydrophobicContact CG-CD1 3.46Å; M147-I152 VanDerWaalsContact CG-CD1 3.46Å; M147-I152 HydrophobicContact SD-CD1 4.29Å | ||
| 148 | D | 88.4 | Confident | 90.5 | Very high | 71 Ų | 71 | 100.5 Ų | 100.5 | 38% | 0.38 | 47% | 0.472 | S | S | . | . | trans | -86.2 | 106.9 | 172.5 | -177.2 | 3.7 | 0 | 0 | 0 | 110.9 | G146 N150 Y151 I152 | G146-D148 PolarHBondContact O-N 2.95Å; D148-N150 VanDerWaalsContact C-N 3.3Å; D148-N150 PolarHBondContact O-N 2.96Å; D148-N150 WeakPolarHBondContact OD1-CB 3.44Å; D148-N150 PolarHBondContact OD1-N 3.31Å; D148-Y151 WeakPolarHBondContact O-CB 3.43Å; D148-Y151 PolarHBondContact O-N 3.1Å; D148-Y151 WeakPolarHBondContact OD2-CB 3.19Å; D148-I152 VanDerWaalsContact O-CG1 3.28Å; D148-I152 WeakPolarHBondContact O-CG1 3.44Å; D148-I152 PolarHBondContact O-N 3.23Å | ||
| 149 | M | 87.9 | Confident | 90.6 | Very high | 80 Ų | 80 | 100.5 Ų | 100.5 | 39% | 0.394 | 47% | 0.469 | S | S | . | . | H | α-helix | trans | -60.6 | -37.3 | 178.2 | -68.6 | -64.3 | 168 | 0 | 0 | 112.6 | L138 M147 Y151 I152 I153 | L138-M149 HydrophobicContact CD2-CE 4.25Å; M147-M149 HydrophobicContact CE-CE 4.47Å; M147-M149 HydrophobicContact CG-CE 4.13Å; M147-M149 PolarHBondContact O-N 3.39Å; M147-M149 HydrophobicContact SD-CE 3.67Å; M149-Y151 VanDerWaalsContact C-N 3.35Å; M149-I152 PolarHBondContact O-N 3.35Å; M149-I153 WeakPolarHBondContact O-CB 3.28Å; M149-I153 WeakPolarHBondContact O-CD1 3.44Å; M149-I153 WeakPolarHBondContact O-CG1 3.33Å; M149-I153 PolarHBondContact O-N 3.11Å |
| 150 | N | 90.4 | Very high | 90.6 | Very high | 94 Ų | 94 | 101 Ų | 101 | 50% | 0.503 | 47% | 0.47 | S | S | . | . | H | α-helix | trans | -64.6 | -46.2 | 179.7 | -172.1 | 9.2 | 0 | 0 | 0 | 109.9 | D148 I152 I153 Q154 | D148-N150 VanDerWaalsContact C-N 3.3Å; D148-N150 PolarHBondContact O-N 2.96Å; D148-N150 WeakPolarHBondContact OD1-CB 3.44Å; D148-N150 PolarHBondContact OD1-N 3.31Å; N150-I152 PolarHBondContact O-N 3.46Å; N150-I153 PolarHBondContact O-N 2.63Å; N150-Q154 VanDerWaalsContact CG-NE2 3.32Å; N150-Q154 PolarHBondContact ND2-NE2 2.98Å; N150-Q154 WeakPolarHBondContact O-CG 3.22Å; N150-Q154 PolarHBondContact O-N 3.43Å; N150-Q154 PolarHBondContact OD1-NE2 3.19Å |
| 151 | Y | 91.6 | Very high | 90.6 | Very high | 115 Ų | 115 | 101.4 Ų | 101.4 | 45% | 0.451 | 47% | 0.474 | S | S | . | . | H | α-helix | trans | -61.1 | -42.8 | 176.1 | -174.1 | -119.7 | 0 | 0 | 0 | 113.1 | D148 M149 Q154 R155 | D148-Y151 WeakPolarHBondContact O-CB 3.43Å; D148-Y151 PolarHBondContact O-N 3.1Å; D148-Y151 WeakPolarHBondContact OD2-CB 3.19Å; M149-Y151 VanDerWaalsContact C-N 3.35Å; Y151-Q154 PolarHBondContact O-N 3.31Å; Y151-R155 VanDerWaalsContact CZ-CZ 3.4Å; Y151-R155 WeakPolarHBondContact O-CB 3.5Å; Y151-R155 WeakPolarHBondContact O-CG 3.48Å; Y151-R155 PolarHBondContact O-N 3.47Å; Y151-R155 VanDerWaalsContact OH-CZ 3.27Å; Y151-R155 PolarHBondContact OH-NE 2.82Å; Y151-R155 VanDerWaalsContact OH-NE 3.08Å; Y151-R155 PolarHBondContact OH-NH2 2.93Å |
| 152 | I | 91.6 | Very high | 90.7 | Very high | 52 Ų | 52 | 102.2 Ų | 102.2 | 27% | 0.267 | 49% | 0.49 | S | S | . | . | H | α-helix | trans | -62.5 | -43.9 | 176.1 | -68.7 | 165.2 | 0 | 0 | 0 | 111 | M147 D148 M149 N150 R155 K156 | M147-I152 HydrophobicContact CE-CD1 3.63Å; M147-I152 HydrophobicContact CG-CD1 3.46Å; M147-I152 VanDerWaalsContact CG-CD1 3.46Å; M147-I152 HydrophobicContact SD-CD1 4.29Å; D148-I152 VanDerWaalsContact O-CG1 3.28Å; D148-I152 WeakPolarHBondContact O-CG1 3.44Å; D148-I152 PolarHBondContact O-N 3.23Å; M149-I152 PolarHBondContact O-N 3.35Å; N150-I152 PolarHBondContact O-N 3.46Å; I152-R155 PolarHBondContact O-N 3.16Å; I152-K156 PolarHBondContact O-N 3.07Å |
| 153 | I | 91.1 | Very high | 90.8 | Very high | 68 Ų | 68 | 99.2 Ų | 99.2 | 35% | 0.349 | 49% | 0.485 | S | S | . | . | H | α-helix | trans | -62.1 | -48.6 | 178.7 | -70.5 | 164.3 | 0 | 0 | 0 | 110.3 | M149 N150 R155 K156 F159 | M149-I153 WeakPolarHBondContact O-CB 3.28Å; M149-I153 WeakPolarHBondContact O-CD1 3.44Å; M149-I153 WeakPolarHBondContact O-CG1 3.33Å; M149-I153 PolarHBondContact O-N 3.11Å; N150-I153 PolarHBondContact O-N 2.63Å; I153-R155 PolarHBondContact O-N 3.38Å; I153-K156 WeakPolarHBondContact O-CB 3.09Å; I153-K156 PolarHBondContact O-N 3.04Å; I153-F159 HydrophobicContact CG2-CB 4.3Å; I153-F159 HydrophobicContact CG2-CD1 3.85Å; I153-F159 HydrophobicContact CG2-CD2 3.46Å; I153-F159 VanDerWaalsContact CG2-CD2 3.46Å; I153-F159 HydrophobicContact CG2-CE1 3.98Å; I153-F159 HydrophobicContact CG2-CE2 3.61Å; I153-F159 HydrophobicContact CG2-CG 3.58Å; I153-F159 HydrophobicContact CG2-CZ 3.87Å; I153-F159 VanDerWaalsContact O-CB 3.25Å; I153-F159 WeakPolarHBondContact O-CB 3.01Å |
| 154 | Q | 91.1 | Very high | 90.9 | Very high | 94 Ų | 94 | 95.6 Ų | 95.6 | 44% | 0.439 | 47% | 0.466 | S | S | . | . | H | α-helix | trans | -61.6 | -30.6 | 178.2 | -69.4 | 176.3 | 30.8 | 0 | 0 | 113.1 | N150 Y151 K156 R160 | N150-Q154 VanDerWaalsContact CG-NE2 3.32Å; N150-Q154 PolarHBondContact ND2-NE2 2.98Å; N150-Q154 WeakPolarHBondContact O-CG 3.22Å; N150-Q154 PolarHBondContact O-N 3.43Å; N150-Q154 PolarHBondContact OD1-NE2 3.19Å; Y151-Q154 PolarHBondContact O-N 3.31Å; Q154-K156 VanDerWaalsContact C-N 3.34Å; Q154-R160 PolarHBondContact O-NE 2.83Å; Q154-R160 PolarHBondContact O-NH2 3.41Å |
| 155 | R | 91.9 | Very high | 90.9 | Very high | 145 Ų | 145 | 94.6 Ų | 94.6 | 55% | 0.547 | 46% | 0.459 | S | S | . | . | H | α-helix | trans | -76.7 | -13.5 | 175.8 | -77.6 | -162.2 | -167 | 164.9 | -8.5 | 114.5 | Y151 I152 I153 R160 | Y151-R155 VanDerWaalsContact CZ-CZ 3.4Å; Y151-R155 WeakPolarHBondContact O-CB 3.5Å; Y151-R155 WeakPolarHBondContact O-CG 3.48Å; Y151-R155 PolarHBondContact O-N 3.47Å; Y151-R155 VanDerWaalsContact OH-CZ 3.27Å; Y151-R155 PolarHBondContact OH-NE 2.82Å; Y151-R155 VanDerWaalsContact OH-NE 3.08Å; Y151-R155 PolarHBondContact OH-NH2 2.93Å; I152-R155 PolarHBondContact O-N 3.16Å; I153-R155 PolarHBondContact O-N 3.38Å; R155-R160 PolarHBondContact O-NH1 3.48Å |
| 156 | K | 94.3 | Very high | 91.3 | Very high | 114 Ų | 114 | 93.9 Ų | 93.9 | 50% | 0.496 | 46% | 0.456 | S | S | . | . | S | Bend | trans | -72.1 | 137.4 | 176.7 | -72.5 | 178.1 | 177.9 | -176.8 | 0 | 110.4 | I152 I153 Q154 E158 F159 R160 | I152-K156 PolarHBondContact O-N 3.07Å; I153-K156 WeakPolarHBondContact O-CB 3.09Å; I153-K156 PolarHBondContact O-N 3.04Å; Q154-K156 VanDerWaalsContact C-N 3.34Å; K156-E158 VanDerWaalsContact C-N 3.27Å; K156-E158 PolarHBondContact O-N 2.68Å; K156-F159 HydrophobicContact CB-CB 4.3Å; K156-F159 PolarHBondContact O-N 3.04Å; K156-R160 PolarHBondContact O-N 3.08Å |
| 157 | K | 93.4 | Very high | 91.6 | Very high | 157 Ų | 157 | 97.5 Ų | 97.5 | 68% | 0.683 | 45% | 0.454 | S | S | * | . | H | α-helix | trans | -67.1 | -32.6 | 179.7 | 66.4 | -177.7 | -178.9 | -176.7 | 0 | 111.6 | F159 R160 N161 | K157-F159 VanDerWaalsContact C-N 3.34Å; K157-R160 PolarHBondContact O-N 3.31Å; K157-N161 PolarHBondContact O-N 3.25Å |
| 158 | E | 91.4 | Very high | 92.1 | Very high | 98 Ų | 98 | 97.5 Ų | 97.5 | 46% | 0.458 | 46% | 0.455 | S | S | . | . | H | α-helix | trans | -65.6 | -39.2 | 178 | -64.2 | 69.6 | -150.8 | 0 | 0 | 111.1 | K156 R160 N161 I164 | K156-E158 VanDerWaalsContact C-N 3.27Å; K156-E158 PolarHBondContact O-N 2.68Å; E158-R160 VanDerWaalsContact C-N 3.29Å; E158-R160 PolarHBondContact O-N 3.3Å; E158-N161 WeakPolarHBondContact O-CB 3.29Å; E158-N161 PolarHBondContact O-N 3.13Å; E158-I164 WeakPolarHBondContact O-CB 3.22Å |
| 159 | F | 92.8 | Very high | 92.3 | Very high | 77 Ų | 77 | 96 Ų | 96 | 34% | 0.338 | 45% | 0.447 | S | S | . | . | H | α-helix | trans | -71.9 | -25.7 | 179 | -166 | -99.3 | 0 | 0 | 0 | 112.6 | I153 K156 K157 N161 | I153-F159 HydrophobicContact CG2-CB 4.3Å; I153-F159 HydrophobicContact CG2-CD1 3.85Å; I153-F159 HydrophobicContact CG2-CD2 3.46Å; I153-F159 VanDerWaalsContact CG2-CD2 3.46Å; I153-F159 HydrophobicContact CG2-CE1 3.98Å; I153-F159 HydrophobicContact CG2-CE2 3.61Å; I153-F159 HydrophobicContact CG2-CG 3.58Å; I153-F159 HydrophobicContact CG2-CZ 3.87Å; I153-F159 VanDerWaalsContact O-CB 3.25Å; I153-F159 WeakPolarHBondContact O-CB 3.01Å; K156-F159 HydrophobicContact CB-CB 4.3Å; K156-F159 PolarHBondContact O-N 3.04Å; K157-F159 VanDerWaalsContact C-N 3.34Å; F159-N161 VanDerWaalsContact C-N 3.28Å |
| 160 | R | 92.1 | Very high | 92.6 | Very high | 162 Ų | 162 | 98.6 Ų | 98.6 | 61% | 0.611 | 46% | 0.457 | S | S | * | . | H | α-helix | trans | -75.9 | -15.7 | 172.3 | -68 | -176.4 | 177.8 | 104.9 | -7.1 | 113.5 | Q154 R155 K156 K157 E158 P162 | Q154-R160 PolarHBondContact O-NE 2.83Å; Q154-R160 PolarHBondContact O-NH2 3.41Å; R155-R160 PolarHBondContact O-NH1 3.48Å; K156-R160 PolarHBondContact O-N 3.08Å; K157-R160 PolarHBondContact O-N 3.31Å; E158-R160 VanDerWaalsContact C-N 3.29Å; E158-R160 PolarHBondContact O-N 3.3Å; R160-P162 WeakPolarHBondContact O-CD 3.34Å |
| 161 | N | 93.7 | Very high | 92.8 | Very high | 78 Ų | 78 | 102.6 Ų | 102.6 | 42% | 0.417 | 47% | 0.471 | S | S | . | . | S | Bend | trans | -82.6 | 117.1 | 177.5 | -177.7 | -6.4 | 0 | 0 | 0 | 109.1 | K157 E158 F159 S163 I164 | K157-N161 PolarHBondContact O-N 3.25Å; E158-N161 WeakPolarHBondContact O-CB 3.29Å; E158-N161 PolarHBondContact O-N 3.13Å; F159-N161 VanDerWaalsContact C-N 3.28Å; N161-S163 VanDerWaalsContact CG-OG 3.26Å; N161-S163 PolarHBondContact ND2-OG 3Å; N161-S163 PolarHBondContact O-N 3.32Å; N161-S163 PolarHBondContact OD1-N 3.44Å; N161-S163 PolarHBondContact OD1-OG 3.13Å; N161-S163 VanDerWaalsContact OD1-OG 3.09Å; N161-I164 VanDerWaalsContact O-CB 3.3Å; N161-I164 WeakPolarHBondContact O-CB 3.46Å; N161-I164 WeakPolarHBondContact O-CG2 3.37Å; N161-I164 PolarHBondContact O-N 3.35Å |
| 162 | P | 92.8 | Very high | 92.8 | Very high | 99 Ų | 99 | 100.6 Ų | 100.6 | 64% | 0.643 | 47% | 0.473 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -58.4 | -22.3 | -180 | 23.7 | -34.1 | 0 | 0 | 0 | 113.6 | R160 I164 Y165 | R160-P162 WeakPolarHBondContact O-CD 3.34Å; P162-I164 PolarHBondContact O-N 3.45Å; P162-Y165 VanDerWaalsContact O-CD2 3.3Å; P162-Y165 WeakPolarHBondContact O-CD2 3.48Å; P162-Y165 PolarHBondContact O-N 2.73Å |
| 163 | S | 93.7 | Very high | 92.9 | Very high | 57 Ų | 57 | 102.4 Ų | 102.4 | 40% | 0.399 | 50% | 0.496 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -69.7 | -6.8 | 174.7 | 76.9 | 0 | 0 | 0 | 0 | 114.2 | N161 Y165 | N161-S163 VanDerWaalsContact CG-OG 3.26Å; N161-S163 PolarHBondContact ND2-OG 3Å; N161-S163 PolarHBondContact O-N 3.32Å; N161-S163 PolarHBondContact OD1-N 3.44Å; N161-S163 PolarHBondContact OD1-OG 3.13Å; N161-S163 VanDerWaalsContact OD1-OG 3.09Å; S163-Y165 VanDerWaalsContact C-N 3.25Å; S163-Y165 PolarHBondContact O-N 3.17Å |
| 164 | I | 94.3 | Very high | 92.9 | Very high | 32 Ų | 32 | 103.6 Ų | 103.6 | 16% | 0.164 | 50% | 0.502 | C | S | . | . | H | α-helix | trans | -65.1 | -30.1 | 173.1 | -163.8 | 56.8 | 0 | 0 | 0 | 112.1 | E158 N161 P162 E166 K167 L168 | E158-I164 WeakPolarHBondContact O-CB 3.22Å; N161-I164 VanDerWaalsContact O-CB 3.3Å; N161-I164 WeakPolarHBondContact O-CB 3.46Å; N161-I164 WeakPolarHBondContact O-CG2 3.37Å; N161-I164 PolarHBondContact O-N 3.35Å; P162-I164 PolarHBondContact O-N 3.45Å; I164-E166 VanDerWaalsContact C-N 3.32Å; I164-E166 PolarHBondContact O-N 3.49Å; I164-K167 HydrophobicContact CD1-CB 4.47Å; I164-K167 HydrophobicContact CD1-CD 4.37Å; I164-K167 WeakPolarHBondContact O-CB 3.25Å; I164-K167 PolarHBondContact O-N 3.14Å; I164-K167 VanDerWaalsContact O-N 3.12Å; I164-L168 HydrophobicContact CG1-CD1 4.26Å; I164-L168 HydrophobicContact CG1-CG 4.26Å; I164-L168 HydrophobicContact CG2-CD1 4.43Å; I164-L168 WeakPolarHBondContact O-CG 3.44Å; I164-L168 PolarHBondContact O-N 3.3Å |
| 165 | Y | 91.6 | Very high | 92.9 | Very high | 136 Ų | 136 | 103.1 Ų | 103.1 | 53% | 0.533 | 50% | 0.502 | S | S | . | . | H | α-helix | trans | -61.9 | -40.6 | -178.6 | -68.3 | -58.6 | 0 | 0 | 0 | 111.9 | P162 S163 K167 L168 I169 | P162-Y165 VanDerWaalsContact O-CD2 3.3Å; P162-Y165 WeakPolarHBondContact O-CD2 3.48Å; P162-Y165 PolarHBondContact O-N 2.73Å; S163-Y165 VanDerWaalsContact C-N 3.25Å; S163-Y165 PolarHBondContact O-N 3.17Å; Y165-K167 VanDerWaalsContact C-N 3.26Å; Y165-K167 PolarHBondContact O-N 3.26Å; Y165-L168 HydrophobicContact CD1-CD1 4.25Å; Y165-L168 PolarHBondContact O-N 3.31Å; Y165-I169 WeakPolarHBondContact O-CB 3.41Å; Y165-I169 WeakPolarHBondContact O-CD1 3.26Å; Y165-I169 WeakPolarHBondContact O-CG1 3.5Å; Y165-I169 PolarHBondContact O-N 3.12Å |
| 166 | E | 93.2 | Very high | 92.7 | Very high | 120 Ų | 120 | 103.2 Ų | 103.2 | 56% | 0.561 | 51% | 0.509 | S | S | * | . | H | α-helix | trans | -57.3 | -41.3 | 175.5 | -171.9 | 178.3 | 176.9 | 0 | 0 | 111.5 | I164 Q170 | I164-E166 VanDerWaalsContact C-N 3.32Å; I164-E166 PolarHBondContact O-N 3.49Å; E166-Q170 VanDerWaalsContact O-CG 3.29Å; E166-Q170 WeakPolarHBondContact O-CG 2.98Å; E166-Q170 PolarHBondContact O-N 3.43Å; E166-Q170 VanDerWaalsContact O-N 3.16Å |
| 167 | K | 94 | Very high | 92.4 | Very high | 137 Ų | 137 | 103.3 Ų | 103.3 | 60% | 0.596 | 51% | 0.514 | S | S | * | . | H | α-helix | trans | -70.2 | -37.5 | 175.5 | -63.9 | -175.1 | 179.5 | -178.9 | 0 | 112.6 | I164 Y165 Q170 F171 | I164-K167 HydrophobicContact CD1-CB 4.47Å; I164-K167 HydrophobicContact CD1-CD 4.37Å; I164-K167 WeakPolarHBondContact O-CB 3.25Å; I164-K167 PolarHBondContact O-N 3.14Å; I164-K167 VanDerWaalsContact O-N 3.12Å; Y165-K167 VanDerWaalsContact C-N 3.26Å; Y165-K167 PolarHBondContact O-N 3.26Å; K167-Q170 PolarHBondContact O-N 3.44Å; K167-F171 WeakPolarHBondContact O-CB 3.02Å; K167-F171 PolarHBondContact O-N 3.33Å |
| 168 | L | 92.9 | Very high | 92.1 | Very high | 62 Ų | 62 | 97.7 Ų | 97.7 | 33% | 0.325 | 50% | 0.501 | S | S | . | . | H | α-helix | trans | -68.2 | -39.9 | 178.5 | -69.7 | 173.7 | 0 | 0 | 0 | 111.4 | I164 Y165 F171 C172 | I164-L168 HydrophobicContact CG1-CD1 4.26Å; I164-L168 HydrophobicContact CG1-CG 4.26Å; I164-L168 HydrophobicContact CG2-CD1 4.43Å; I164-L168 WeakPolarHBondContact O-CG 3.44Å; I164-L168 PolarHBondContact O-N 3.3Å; Y165-L168 HydrophobicContact CD1-CD1 4.25Å; Y165-L168 PolarHBondContact O-N 3.31Å; L168-F171 PolarHBondContact O-N 3.41Å; L168-C172 WeakPolarHBondContact O-CB 3.24Å; L168-C172 PolarHBondContact O-N 3.34Å; L168-C172 PolarHBondContact O-SG 3.18Å |
| 169 | I | 93.1 | Very high | 92 | Very high | 40 Ų | 40 | 95.4 Ų | 95.4 | 21% | 0.205 | 49% | 0.494 | C | S | . | . | H | α-helix | trans | -58.5 | -50.3 | 174 | -70.2 | 159.7 | 0 | 0 | 0 | 109.5 | Y165 A173 I174 E176 | Y165-I169 WeakPolarHBondContact O-CB 3.41Å; Y165-I169 WeakPolarHBondContact O-CD1 3.26Å; Y165-I169 WeakPolarHBondContact O-CG1 3.5Å; Y165-I169 PolarHBondContact O-N 3.12Å; I169-A173 WeakPolarHBondContact O-CA 3.4Å; I169-A173 PolarHBondContact O-N 2.93Å; I169-I174 HydrophobicContact CG2-CB 4.37Å; I169-I174 WeakPolarHBondContact CG2-O 3.06Å; I169-I174 PolarHBondContact O-N 3.04Å; I169-E176 HydrophobicContact CD1-CG 3.92Å; I169-E176 HydrophobicContact CG1-CG 4.38Å; I169-E176 HydrophobicContact CG2-CG 3.63Å |
| 170 | Q | 93.5 | Very high | 91.8 | Very high | 133 Ų | 133 | 100 Ų | 100 | 62% | 0.621 | 52% | 0.522 | S | S | * | . | H | α-helix | trans | -62.7 | -46.2 | 177.2 | -69.5 | 170.2 | 17.1 | 0 | 0 | 112.7 | E166 K167 A173 | E166-Q170 VanDerWaalsContact O-CG 3.29Å; E166-Q170 WeakPolarHBondContact O-CG 2.98Å; E166-Q170 PolarHBondContact O-N 3.43Å; E166-Q170 VanDerWaalsContact O-N 3.16Å; K167-Q170 PolarHBondContact O-N 3.44Å; Q170-A173 PolarHBondContact O-N 3.29Å |
| 171 | F | 94.3 | Very high | 91.5 | Very high | 178 Ų | 178 | 99 Ų | 99 | 78% | 0.781 | 52% | 0.519 | S | S | * | . | H | α-helix | trans | -67 | -40 | -177.3 | 178.3 | -98.3 | 0 | 0 | 0 | 112.7 | K167 L168 A173 | K167-F171 WeakPolarHBondContact O-CB 3.02Å; K167-F171 PolarHBondContact O-N 3.33Å; L168-F171 PolarHBondContact O-N 3.41Å; F171-A173 VanDerWaalsContact C-N 3.29Å |
| 172 | C | 92.8 | Very high | 91.2 | Very high | 73 Ų | 73 | 95.8 Ų | 95.8 | 49% | 0.493 | 50% | 0.502 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -87.2 | 1.7 | 178.6 | -65.4 | 0 | 0 | 0 | 0 | 112.9 | L168 I174 | L168-C172 WeakPolarHBondContact O-CB 3.24Å; L168-C172 PolarHBondContact O-N 3.34Å; L168-C172 PolarHBondContact O-SG 3.18Å; C172-I174 HydrophobicContact CB-CD1 3.62Å; C172-I174 HydrophobicContact CB-CG1 3.62Å; C172-I174 PolarHBondContact O-N 3.18Å |
| 173 | A | 92.8 | Very high | 90.9 | Very high | 91 Ų | 91 | 97 Ų | 97 | 75% | 0.752 | 50% | 0.497 | S | S | * | . | T | Hydrogen-bonded Turn | trans | 48.6 | 45.4 | -174.6 | 0 | 0 | 0 | 0 | 0 | 112.4 | I169 Q170 F171 | I169-A173 WeakPolarHBondContact O-CA 3.4Å; I169-A173 PolarHBondContact O-N 2.93Å; Q170-A173 PolarHBondContact O-N 3.29Å; F171-A173 VanDerWaalsContact C-N 3.29Å |
| 174 | I | 91.4 | Very high | 90.4 | Very high | 93 Ų | 93 | 99 Ų | 99 | 48% | 0.477 | 50% | 0.504 | S | S | . | . | trans | -81.9 | 131.6 | -179.5 | -63.8 | 168.2 | 0 | 0 | 0 | 108.8 | I169 C172 E176 | I169-I174 HydrophobicContact CG2-CB 4.37Å; I169-I174 WeakPolarHBondContact CG2-O 3.06Å; I169-I174 PolarHBondContact O-N 3.04Å; C172-I174 HydrophobicContact CB-CD1 3.62Å; C172-I174 HydrophobicContact CB-CG1 3.62Å; C172-I174 PolarHBondContact O-N 3.18Å; I174-E176 PolarHBondContact O-N 3.35Å | ||
| 175 | D | 91.2 | Very high | 90 | Very high | 84 Ų | 84 | 101.5 Ų | 101.5 | 45% | 0.449 | 52% | 0.516 | S | S | . | . | trans | -79.3 | 112.2 | 166.7 | 179.3 | 3 | 0 | 0 | 0 | 109.4 | L177 G178 H189 | D175-L177 PolarHBondContact O-N 3.46Å; D175-L177 PolarHBondContact OD1-N 3.35Å; D175-L177 VanDerWaalsContact OD1-N 3.13Å; D175-G178 VanDerWaalsContact CG-CA 3.43Å; D175-G178 PolarHBondContact O-N 3.44Å; D175-G178 PolarHBondContact OD1-N 3.38Å; D175-G178 VanDerWaalsContact OD2-CA 3.26Å; D175-G178 WeakPolarHBondContact OD2-CA 3.35Å; D175-G178 PolarHBondContact OD2-N 3.2Å; D175-H189 IonicContact OD1-CE1 2.76Å; D175-H189 PolarHBondContact OD1-CE1 3.17Å; D175-H189 IonicContact OD1-NE2 2.71Å; D175-H189 IonicContact OD2-CE1 3.78Å; D175-H189 PolarHBondContact OD2-CE1 3.04Å; D175-H189 IonicContact OD2-ND1 4Å | ||
| 176 | E | 88.4 | Confident | 89.7 | Confident | 146 Ų | 146 | 100.4 Ų | 100.4 | 68% | 0.682 | 51% | 0.514 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -62.8 | -31.9 | -177.5 | -65.3 | -175.5 | -142.8 | 0 | 0 | 113.2 | I169 I174 | I169-E176 HydrophobicContact CD1-CG 3.92Å; I169-E176 HydrophobicContact CG1-CG 4.38Å; I169-E176 HydrophobicContact CG2-CG 3.63Å; I174-E176 PolarHBondContact O-N 3.35Å |
| 177 | L | 87.4 | Confident | 89.5 | Confident | 116 Ų | 116 | 97.5 Ų | 97.5 | 61% | 0.607 | 50% | 0.502 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -97.1 | 1.1 | 176.3 | -60 | 178.1 | 0 | 0 | 0 | 111.1 | D175 P188 | D175-L177 PolarHBondContact O-N 3.46Å; D175-L177 PolarHBondContact OD1-N 3.35Å; D175-L177 VanDerWaalsContact OD1-N 3.13Å; L177-P188 HydrophobicContact CB-CB 4.18Å; L177-P188 WeakPolarHBondContact O-CB 3.3Å; L177-P188 WeakPolarHBondContact O-CG 3.05Å |
| 178 | G | 87.9 | Confident | 89.2 | Confident | 39 Ų | 39 | 92 Ų | 92 | 40% | 0.402 | 48% | 0.481 | S | S | . | . | trans | -60 | 148.4 | -176.5 | 0 | 0 | 0 | 0 | 0 | 112.6 | D175 | D175-G178 VanDerWaalsContact CG-CA 3.43Å; D175-G178 PolarHBondContact O-N 3.44Å; D175-G178 PolarHBondContact OD1-N 3.38Å; D175-G178 VanDerWaalsContact OD2-CA 3.26Å; D175-G178 WeakPolarHBondContact OD2-CA 3.35Å; D175-G178 PolarHBondContact OD2-N 3.2Å | ||
| 179 | T | 88.4 | Confident | 88.8 | Confident | 51 Ų | 51 | 93.3 Ų | 93.3 | 31% | 0.313 | 49% | 0.485 | S | S | . | . | trans | -128.5 | 151 | 178.7 | -170.8 | 0 | 0 | 0 | 0 | 111.2 | Y181 F186 P188 | T179-Y181 VanDerWaalsContact OG1-CD2 3.24Å; T179-Y181 WeakPolarHBondContact OG1-CD2 3.4Å; T179-Y181 PolarHBondContact OG1-N 3.15Å; T179-F186 HydrophobicContact CG2-CD1 3.96Å; T179-P188 HydrophobicContact CG2-CG 3.65Å | ||
| 180 | N | 88.2 | Confident | 88.3 | Confident | 173 Ų | 173 | 94 Ų | 94 | 93% | 0.925 | 50% | 0.501 | S | S | * | . | S | Bend | trans | -83.1 | -5.2 | 170.5 | -64.2 | -68.5 | 0 | 0 | 0 | 112.1 | ||
| 181 | Y | 86.9 | Confident | 88 | Confident | 142 Ų | 142 | 96 Ų | 96 | 56% | 0.557 | 50% | 0.504 | S | S | * | . | S | Bend | trans | -73.6 | 143.2 | 173 | -67.9 | -63.7 | 0 | 0 | 0 | 110.5 | T179 M185 | T179-Y181 VanDerWaalsContact OG1-CD2 3.24Å; T179-Y181 WeakPolarHBondContact OG1-CD2 3.4Å; T179-Y181 PolarHBondContact OG1-N 3.15Å; Y181-M185 HydrophobicContact CD1-CE 3.58Å; Y181-M185 HydrophobicContact CD1-SD 4.32Å; Y181-M185 HydrophobicContact CE1-CE 4.37Å; Y181-M185 HydrophobicContact CG-CE 4.32Å |
| 182 | P | 86.9 | Confident | 87.5 | Confident | 9 Ų | 9 | 90.7 Ų | 90.7 | 6% | 0.058 | 49% | 0.488 | C | S | . | . | trans | -62.1 | 145.4 | 169.7 | 31.3 | -39.1 | 0 | 0 | 0 | 110 | V102 A103 D184 M185 F186 | V102-P182 HydrophobicContact CG1-CB 4.31Å; A103-P182 HydrophobicContact CB-CB 4.18Å; P182-D184 VanDerWaalsContact C-OD1 3.31Å; P182-D184 WeakPolarHBondContact CB-OD1 3.45Å; P182-D184 WeakPolarHBondContact CG-OD1 3.43Å; P182-D184 PolarHBondContact O-N 3.07Å; P182-M185 HydrophobicContact CG-CB 4.3Å; P182-M185 HydrophobicContact CG-CE 3.7Å; P182-M185 PolarHBondContact O-N 3.37Å; P182-F186 PolarHBondContact O-N 2.93Å; P182-F186 VanDerWaalsContact O-N 3.1Å | ||
| 183 | K | 86.1 | Confident | 87 | Confident | 125 Ų | 125 | 93.6 Ų | 93.6 | 54% | 0.543 | 50% | 0.495 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -63.7 | -22.7 | -172.8 | -64.8 | -175.4 | 179.8 | -175.4 | 0 | 113.3 | Q99 M185 D187 | Q99-K183 HydrophobicContact CG-CD 4.39Å; K183-M185 PolarHBondContact O-N 3.09Å; K183-D187 HydrophobicContact CB-CB 4.47Å |
| 184 | D | 83.8 | Confident | 86.5 | Confident | 100 Ų | 100 | 95.1 Ų | 95.1 | 54% | 0.535 | 49% | 0.49 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -62.9 | -31.4 | 172.9 | 69.4 | -40.3 | 0 | 0 | 0 | 112.3 | R110 P182 | R110-D184 IonicContact NH2-OD2 2.81Å; P182-D184 VanDerWaalsContact C-OD1 3.31Å; P182-D184 WeakPolarHBondContact CB-OD1 3.45Å; P182-D184 WeakPolarHBondContact CG-OD1 3.43Å; P182-D184 PolarHBondContact O-N 3.07Å |
| 185 | M | 85.9 | Confident | 86.3 | Confident | 84 Ų | 84 | 93.3 Ų | 93.3 | 41% | 0.414 | 49% | 0.486 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -95.1 | -43.6 | -178.4 | 176.9 | 163.4 | 36.2 | 0 | 0 | 112.1 | Y181 P182 K183 | Y181-M185 HydrophobicContact CD1-CE 3.58Å; Y181-M185 HydrophobicContact CD1-SD 4.32Å; Y181-M185 HydrophobicContact CE1-CE 4.37Å; Y181-M185 HydrophobicContact CG-CE 4.32Å; P182-M185 HydrophobicContact CG-CB 4.3Å; P182-M185 HydrophobicContact CG-CE 3.7Å; P182-M185 PolarHBondContact O-N 3.37Å; K183-M185 PolarHBondContact O-N 3.09Å |
| 186 | F | 85.3 | Confident | 86.2 | Confident | 112 Ų | 112 | 93.9 Ų | 93.9 | 49% | 0.491 | 48% | 0.482 | S | S | . | . | trans | -151.1 | 116.2 | 177.8 | -175.8 | -114.4 | 0 | 0 | 0 | 110.3 | T179 P182 P188 | T179-F186 HydrophobicContact CG2-CD1 3.96Å; P182-F186 PolarHBondContact O-N 2.93Å; P182-F186 VanDerWaalsContact O-N 3.1Å; F186-P188 HydrophobicContact CD1-CG 4.05Å; F186-P188 HydrophobicContact CE1-CB 4.37Å; F186-P188 HydrophobicContact CE1-CG 3.72Å; F186-P188 HydrophobicContact CZ-CG 4.5Å | ||
| 187 | D | 87.8 | Confident | 86.3 | Confident | 59 Ų | 59 | 95.5 Ų | 95.5 | 32% | 0.316 | 48% | 0.483 | S | S | . | . | trans | -111.3 | 104.6 | 171.4 | -169.8 | -3.7 | 0 | 0 | 0 | 110.1 | K183 H189 G190 | K183-D187 HydrophobicContact CB-CB 4.47Å; D187-H189 PolarHBondContact O-N 3.05Å; D187-H189 VanDerWaalsContact O-N 3.15Å; D187-H189 PolarHBondContact OD1-N 3.05Å; D187-G190 PolarHBondContact O-N 3.31Å | ||
| 188 | P | 87.6 | Confident | 86.3 | Confident | 23 Ų | 23 | 96.5 Ų | 96.5 | 15% | 0.149 | 49% | 0.485 | C | S | . | . | T | Hydrogen-bonded Turn | trans | -55.3 | -27.6 | 173.7 | -21.9 | 30.3 | 0 | 0 | 0 | 113.4 | L177 T179 F186 | L177-P188 HydrophobicContact CB-CB 4.18Å; L177-P188 WeakPolarHBondContact O-CB 3.3Å; L177-P188 WeakPolarHBondContact O-CG 3.05Å; T179-P188 HydrophobicContact CG2-CG 3.65Å; F186-P188 HydrophobicContact CD1-CG 4.05Å; F186-P188 HydrophobicContact CE1-CB 4.37Å; F186-P188 HydrophobicContact CE1-CG 3.72Å; F186-P188 HydrophobicContact CZ-CG 4.5Å |
| 189 | H | 85.1 | Confident | 86.3 | Confident | 89 Ų | 89 | 95.4 Ų | 95.4 | 41% | 0.412 | 47% | 0.472 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -101.6 | 9.4 | -178.2 | -62.5 | 91.5 | 0 | 0 | 0 | 112.9 | D175 D187 W191 | D175-H189 IonicContact OD1-CE1 2.76Å; D175-H189 PolarHBondContact OD1-CE1 3.17Å; D175-H189 IonicContact OD1-NE2 2.71Å; D175-H189 IonicContact OD2-CE1 3.78Å; D175-H189 PolarHBondContact OD2-CE1 3.04Å; D175-H189 IonicContact OD2-ND1 4Å; D187-H189 PolarHBondContact O-N 3.05Å; D187-H189 VanDerWaalsContact O-N 3.15Å; D187-H189 PolarHBondContact OD1-N 3.05Å; H189-W191 PolarHBondContact O-N 3.06Å |
| 190 | G | 83.7 | Confident | 86.4 | Confident | 53 Ų | 53 | 97.8 Ų | 97.8 | 55% | 0.546 | 48% | 0.482 | S | S | . | . | trans | -72.8 | -5.7 | -176.9 | 0 | 0 | 0 | 0 | 0 | 114.9 | D187 | D187-G190 PolarHBondContact O-N 3.31Š| ||
| 191 | W | 85.4 | Confident | 86.6 | Confident | 177 Ų | 177 | 91.1 Ų | 91.1 | 67% | 0.67 | 45% | 0.452 | S | S | * | . | trans | -76.6 | 130.2 | 178 | -61.7 | 97.9 | 0 | 0 | 0 | 110.8 | H189 Y196 | H189-W191 PolarHBondContact O-N 3.06Å; W191-Y196 HydrophobicContact CB-CE2 3.95Å; W191-Y196 WeakPolarHBondContact O-CE2 3.3Å | ||
| 192 | S | 84.6 | Confident | 86.7 | Confident | 66 Ų | 66 | 91.3 Ų | 91.3 | 46% | 0.462 | 46% | 0.455 | S | S | . | . | trans | -71.2 | 154.3 | 172.3 | 60.6 | 0 | 0 | 0 | 0 | 111.4 | D194 S195 Y196 | S192-D194 PolarHBondContact O-N 3.21Å; S192-S195 VanDerWaalsContact O-CB 3.31Å; S192-S195 WeakPolarHBondContact O-CB 3.31Å; S192-S195 PolarHBondContact O-N 2.85Å; S192-S195 PolarHBondContact OG-OG 3.42Å; S192-Y196 VanDerWaalsContact O-CD2 3.23Å; S192-Y196 WeakPolarHBondContact O-CD2 3.31Å; S192-Y196 WeakPolarHBondContact O-CE2 3.44Å | ||
| 193 | E | 82.5 | Confident | 86.8 | Confident | 134 Ų | 134 | 93.5 Ų | 93.5 | 63% | 0.626 | 47% | 0.474 | S | S | * | . | G | 310 helix | trans | -47.8 | -38.1 | 176.6 | -169.9 | 62.5 | -150.3 | 0 | 0 | 112.8 | S195 Y196 A199 | E193-S195 PolarHBondContact O-N 3.49Å; E193-Y196 PolarHBondContact O-N 3.18Å; E193-A199 WeakPolarHBondContact O-CB 3.45Å |
| 194 | D | 83 | Confident | 87.1 | Confident | 123 Ų | 123 | 93.5 Ų | 93.5 | 66% | 0.658 | 48% | 0.476 | S | S | * | . | G | 310 helix | trans | -65.5 | -18 | -179.9 | -66 | -25.7 | 0 | 0 | 0 | 114.3 | S192 L200 | S192-D194 PolarHBondContact O-N 3.21Å; D194-L200 VanDerWaalsContact O-CD2 3.31Å; D194-L200 WeakPolarHBondContact O-CD2 3.23Å; D194-L200 WeakPolarHBondContact O-CG 3.41Å |
| 195 | S | 87.3 | Confident | 87.4 | Confident | 55 Ų | 55 | 95.3 Ų | 95.3 | 39% | 0.385 | 48% | 0.48 | S | S | . | . | G | 310 helix | trans | -84.4 | -15.3 | 176.3 | -58.9 | 0 | 0 | 0 | 0 | 112.8 | S192 E193 | S192-S195 VanDerWaalsContact O-CB 3.31Å; S192-S195 WeakPolarHBondContact O-CB 3.31Å; S192-S195 PolarHBondContact O-N 2.85Å; S192-S195 PolarHBondContact OG-OG 3.42Å; E193-S195 PolarHBondContact O-N 3.49Å |
| 196 | Y | 87.4 | Confident | 87.6 | Confident | 96 Ų | 96 | 96 Ų | 96 | 38% | 0.376 | 48% | 0.484 | S | S | . | . | S | Bend | trans | -81.6 | 152.9 | -179.1 | -65.2 | -90.3 | 0 | 0 | 0 | 111.6 | W191 S192 E193 E198 A199 L200 | W191-Y196 HydrophobicContact CB-CE2 3.95Å; W191-Y196 WeakPolarHBondContact O-CE2 3.3Å; S192-Y196 VanDerWaalsContact O-CD2 3.23Å; S192-Y196 WeakPolarHBondContact O-CD2 3.31Å; S192-Y196 WeakPolarHBondContact O-CE2 3.44Å; E193-Y196 PolarHBondContact O-N 3.18Å; Y196-E198 VanDerWaalsContact C-N 3.29Å; Y196-E198 PolarHBondContact O-N 3.48Å; Y196-A199 PolarHBondContact O-N 3.33Å; Y196-L200 PolarHBondContact O-N 3.33Å; Y196-L200 VanDerWaalsContact O-N 3.12Å |
| 197 | Y | 90.1 | Very high | 87.7 | Confident | 179 Ų | 179 | 96.8 Ų | 96.8 | 70% | 0.702 | 49% | 0.489 | S | S | * | . | H | α-helix | trans | -51.6 | -45 | -175.1 | 175.1 | -98.2 | 0 | 0 | 0 | 113.3 | A199 L200 A201 | Y197-A199 PolarHBondContact O-N 2.86Å; Y197-L200 PolarHBondContact O-N 3.35Å; Y197-A201 WeakPolarHBondContact O-CB 3.4Å; Y197-A201 PolarHBondContact O-N 2.97Å |
| 198 | E | 88.7 | Confident | 87.7 | Confident | 137 Ų | 137 | 99.6 Ų | 99.6 | 64% | 0.64 | 50% | 0.501 | S | S | * | . | H | α-helix | trans | -63.2 | -42.9 | -177.2 | -68.4 | -62.2 | 150.2 | 0 | 0 | 112.4 | Y196 K202 | Y196-E198 VanDerWaalsContact C-N 3.29Å; Y196-E198 PolarHBondContact O-N 3.48Å; E198-K202 WeakPolarHBondContact O-CB 3.33Å; E198-K202 PolarHBondContact O-N 3.3Å |
| 199 | A | 88.4 | Confident | 87.7 | Confident | 17 Ų | 17 | 102.5 Ų | 102.5 | 14% | 0.14 | 52% | 0.516 | C | S | . | . | H | α-helix | trans | -68.5 | -42.8 | 178.8 | 0 | 0 | 0 | 0 | 0 | 111.6 | E193 Y196 Y197 K202 A203 | E193-A199 WeakPolarHBondContact O-CB 3.45Å; Y196-A199 PolarHBondContact O-N 3.33Å; Y197-A199 PolarHBondContact O-N 2.86Å; A199-K202 PolarHBondContact O-N 3.45Å; A199-A203 WeakPolarHBondContact O-CB 3.34Å; A199-A203 PolarHBondContact O-N 2.92Å |
| 200 | L | 90.6 | Very high | 87.9 | Confident | 100 Ų | 100 | 105.9 Ų | 105.9 | 52% | 0.524 | 53% | 0.529 | S | S | . | . | H | α-helix | trans | -61.4 | -45.4 | 175.8 | -69.4 | 174.5 | 0 | 0 | 0 | 111.8 | D194 Y196 Y197 K202 A203 Q204 | D194-L200 VanDerWaalsContact O-CD2 3.31Å; D194-L200 WeakPolarHBondContact O-CD2 3.23Å; D194-L200 WeakPolarHBondContact O-CG 3.41Å; Y196-L200 PolarHBondContact O-N 3.33Å; Y196-L200 VanDerWaalsContact O-N 3.12Å; Y197-L200 PolarHBondContact O-N 3.35Å; L200-K202 VanDerWaalsContact C-N 3.33Å; L200-K202 PolarHBondContact O-N 3Å; L200-A203 PolarHBondContact O-N 3.49Å; L200-Q204 WeakPolarHBondContact O-CB 3.26Å; L200-Q204 PolarHBondContact O-N 2.96Å |
| 201 | A | 90.4 | Very high | 87.8 | Confident | 34 Ų | 34 | 107.6 Ų | 107.6 | 28% | 0.281 | 53% | 0.525 | S | S | . | . | H | α-helix | trans | -62.4 | -41.2 | 177.5 | 0 | 0 | 0 | 0 | 0 | 111.6 | Y197 K205 | Y197-A201 WeakPolarHBondContact O-CB 3.4Å; Y197-A201 PolarHBondContact O-N 2.97Å; A201-K205 WeakPolarHBondContact O-CB 3.48Å; A201-K205 PolarHBondContact O-N 3.43Å |
| 202 | K | 91 | Very high | 87.8 | Confident | 145 Ų | 145 | 103.8 Ų | 103.8 | 63% | 0.63 | 52% | 0.515 | S | S | * | . | H | α-helix | trans | -64.9 | -45.1 | 176 | -174.3 | 179.9 | 178.8 | -176.5 | 0 | 111.8 | E198 A199 L200 K205 I206 | E198-K202 WeakPolarHBondContact O-CB 3.33Å; E198-K202 PolarHBondContact O-N 3.3Å; A199-K202 PolarHBondContact O-N 3.45Å; L200-K202 VanDerWaalsContact C-N 3.33Å; L200-K202 PolarHBondContact O-N 3Å; K202-K205 PolarHBondContact O-N 3.12Å; K202-I206 HydrophobicContact CG-CD1 3.98Å; K202-I206 VanDerWaalsContact O-CG1 3.26Å; K202-I206 WeakPolarHBondContact O-CG1 3.48Å; K202-I206 PolarHBondContact O-N 3.41Å |
| 203 | A | 88.8 | Confident | 87.7 | Confident | 56 Ų | 56 | 106.8 Ų | 106.8 | 46% | 0.463 | 52% | 0.52 | S | S | . | . | H | α-helix | trans | -61.2 | -46.6 | 177.4 | 0 | 0 | 0 | 0 | 0 | 111.4 | A199 L200 K205 I206 E207 | A199-A203 WeakPolarHBondContact O-CB 3.34Å; A199-A203 PolarHBondContact O-N 2.92Å; L200-A203 PolarHBondContact O-N 3.49Å; A203-K205 VanDerWaalsContact C-N 3.34Å; A203-K205 PolarHBondContact O-N 3.31Å; A203-I206 PolarHBondContact O-N 2.96Å; A203-E207 PolarHBondContact O-N 3.26Å |
| 204 | Q | 90.9 | Very high | 87.6 | Confident | 124 Ų | 124 | 103 Ų | 103 | 58% | 0.579 | 51% | 0.512 | S | S | * | . | H | α-helix | trans | -60.9 | -42.2 | 177.2 | -172.9 | -178.6 | 37.9 | 0 | 0 | 112 | L200 E207 M208 | L200-Q204 WeakPolarHBondContact O-CB 3.26Å; L200-Q204 PolarHBondContact O-N 2.96Å; Q204-E207 PolarHBondContact O-N 2.87Å; Q204-M208 WeakPolarHBondContact O-CB 3.38Å; Q204-M208 WeakPolarHBondContact O-CG 3.28Å; Q204-M208 PolarHBondContact O-N 2.98Å |
| 205 | K | 91.1 | Very high | 87.3 | Confident | 139 Ų | 139 | 104 Ų | 104 | 60% | 0.604 | 51% | 0.51 | S | S | * | . | H | α-helix | trans | -63 | -45.6 | 176.6 | -176.1 | -179.7 | 177 | -176.2 | 0 | 111.7 | A201 K202 A203 E207 M208 D209 | A201-K205 WeakPolarHBondContact O-CB 3.48Å; A201-K205 PolarHBondContact O-N 3.43Å; K202-K205 PolarHBondContact O-N 3.12Å; A203-K205 VanDerWaalsContact C-N 3.34Å; A203-K205 PolarHBondContact O-N 3.31Å; K205-E207 VanDerWaalsContact C-N 3.3Å; K205-E207 PolarHBondContact O-N 3.42Å; K205-M208 PolarHBondContact O-N 2.92Å; K205-D209 WeakPolarHBondContact O-CB 3.36Å; K205-D209 VanDerWaalsContact O-CG 3.29Å; K205-D209 PolarHBondContact O-N 3.38Å |
| 206 | I | 90.8 | Very high | 86.7 | Confident | 99 Ų | 99 | 107 Ų | 107 | 51% | 0.508 | 52% | 0.516 | S | S | . | . | H | α-helix | trans | -60.6 | -42.1 | 177.7 | -70.3 | 165.9 | 0 | 0 | 0 | 110.7 | K202 A203 D209 K210 | K202-I206 HydrophobicContact CG-CD1 3.98Å; K202-I206 VanDerWaalsContact O-CG1 3.26Å; K202-I206 WeakPolarHBondContact O-CG1 3.48Å; K202-I206 PolarHBondContact O-N 3.41Å; A203-I206 PolarHBondContact O-N 2.96Å; I206-D209 PolarHBondContact O-N 3.48Å; I206-K210 VanDerWaalsContact O-CB 3.28Å; I206-K210 WeakPolarHBondContact O-CB 3.15Å; I206-K210 PolarHBondContact O-N 2.93Å |
| 207 | E | 87.1 | Confident | 85.9 | Confident | 127 Ų | 127 | 107.6 Ų | 107.6 | 59% | 0.593 | 52% | 0.522 | S | S | * | . | H | α-helix | trans | -64.4 | -44.9 | 177.5 | -172.4 | 178.2 | -158.3 | 0 | 0 | 112.1 | A203 Q204 K205 K210 L211 | A203-E207 PolarHBondContact O-N 3.26Å; Q204-E207 PolarHBondContact O-N 2.87Å; K205-E207 VanDerWaalsContact C-N 3.3Å; K205-E207 PolarHBondContact O-N 3.42Å; E207-K210 PolarHBondContact O-N 2.87Å; E207-L211 HydrophobicContact CG-CD1 4.45Å; E207-L211 PolarHBondContact O-N 3.31Å |
| 208 | M | 87.2 | Confident | 84.6 | Confident | 118 Ų | 118 | 107.9 Ų | 107.9 | 58% | 0.581 | 52% | 0.522 | S | S | * | . | H | α-helix | trans | -62 | -44.6 | 175.5 | -80.1 | -68.1 | -165 | 0 | 0 | 112.2 | Q204 K205 K210 L211 E212 | Q204-M208 WeakPolarHBondContact O-CB 3.38Å; Q204-M208 WeakPolarHBondContact O-CG 3.28Å; Q204-M208 PolarHBondContact O-N 2.98Å; K205-M208 PolarHBondContact O-N 2.92Å; M208-K210 VanDerWaalsContact C-N 3.31Å; M208-K210 PolarHBondContact O-N 3.45Å; M208-L211 PolarHBondContact O-N 2.91Å; M208-E212 WeakPolarHBondContact O-CB 3.27Å; M208-E212 PolarHBondContact O-N 3.42Å |
| 209 | D | 88.1 | Confident | 83.5 | Confident | 84 Ų | 84 | 105.4 Ų | 105.4 | 45% | 0.449 | 52% | 0.517 | S | S | . | . | H | α-helix | trans | -64.5 | -37.6 | 177.8 | -73.5 | -13.6 | 0 | 0 | 0 | 111.1 | K205 I206 E212 K213 | K205-D209 WeakPolarHBondContact O-CB 3.36Å; K205-D209 VanDerWaalsContact O-CG 3.29Å; K205-D209 PolarHBondContact O-N 3.38Å; I206-D209 PolarHBondContact O-N 3.48Å; D209-E212 PolarHBondContact O-N 3.48Å; D209-K213 VanDerWaalsContact O-CB 3.27Å; D209-K213 WeakPolarHBondContact O-CB 3.39Å; D209-K213 PolarHBondContact O-N 3.26Å |
| 210 | K | 89.4 | Confident | 82.2 | Confident | 161 Ų | 161 | 112.8 Ų | 112.8 | 70% | 0.7 | 55% | 0.545 | S | S | * | . | H | α-helix | trans | -65.3 | -42.8 | 174.9 | -171 | 178.1 | -178.8 | -178.2 | 0 | 111.5 | I206 E207 M208 A214 | I206-K210 VanDerWaalsContact O-CB 3.28Å; I206-K210 WeakPolarHBondContact O-CB 3.15Å; I206-K210 PolarHBondContact O-N 2.93Å; E207-K210 PolarHBondContact O-N 2.87Å; M208-K210 VanDerWaalsContact C-N 3.31Å; M208-K210 PolarHBondContact O-N 3.45Å; K210-A214 WeakPolarHBondContact O-CB 3.32Å; K210-A214 PolarHBondContact O-N 3.33Å |
| 211 | L | 81.9 | Confident | 80.6 | Confident | 88 Ų | 88 | 114.7 Ų | 114.7 | 46% | 0.461 | 56% | 0.555 | S | S | . | * | H | α-helix | trans | -65.5 | -41 | 174.8 | -78.9 | 168.3 | 0 | 0 | 0 | 112.1 | E207 M208 A214 K215 | E207-L211 HydrophobicContact CG-CD1 4.45Å; E207-L211 PolarHBondContact O-N 3.31Å; M208-L211 PolarHBondContact O-N 2.91Å; L211-A214 PolarHBondContact O-N 3.47Å; L211-K215 WeakPolarHBondContact O-CB 3.41Å; L211-K215 VanDerWaalsContact O-CG 3.27Å; L211-K215 WeakPolarHBondContact O-CG 3.47Å; L211-K215 PolarHBondContact O-N 2.88Å |
| 212 | E | 83.7 | Confident | 78.9 | Confident | 98 Ų | 98 | 119.9 Ų | 119.9 | 46% | 0.458 | 57% | 0.573 | S | S | . | * | H | α-helix | trans | -67.7 | -41.1 | 178.4 | -155.5 | -158.4 | 178.7 | 0 | 0 | 111.2 | M208 D209 K215 K216 | M208-E212 WeakPolarHBondContact O-CB 3.27Å; M208-E212 PolarHBondContact O-N 3.42Å; D209-E212 PolarHBondContact O-N 3.48Å; E212-K215 PolarHBondContact O-N 2.85Å; E212-K216 VanDerWaalsContact CD-CE 3.45Å; E212-K216 HydrophobicContact CG-CD 4.41Å; E212-K216 WeakPolarHBondContact O-CB 3.27Å; E212-K216 VanDerWaalsContact O-CG 3.27Å; E212-K216 WeakPolarHBondContact O-CG 3.41Å; E212-K216 PolarHBondContact O-N 3.32Å; E212-K216 WeakPolarHBondContact OE1-CE 3.11Å; E212-K216 IonicContact OE1-NZ 3.32Å; E212-K216 PolarHBondContact OE1-NZ 3.09Å; E212-K216 IonicContact OE2-NZ 3.13Å; E212-K216 PolarHBondContact OE2-NZ 3.44Å |
| 213 | K | 83.6 | Confident | 77.1 | Confident | 129 Ų | 129 | 122 Ų | 122 | 56% | 0.561 | 58% | 0.583 | S | S | * | * | H | α-helix | trans | -63.9 | -44.8 | 174.6 | -170.9 | 177.4 | 178.1 | -176.2 | 0 | 111.5 | D209 K215 K216 E217 | D209-K213 VanDerWaalsContact O-CB 3.27Å; D209-K213 WeakPolarHBondContact O-CB 3.39Å; D209-K213 PolarHBondContact O-N 3.26Å; K213-K215 VanDerWaalsContact C-N 3.34Å; K213-K215 PolarHBondContact O-N 2.93Å; K213-K216 PolarHBondContact O-N 3.4Å; K213-E217 WeakPolarHBondContact CE-OE1 3.27Å; K213-E217 WeakPolarHBondContact O-CB 3.45Å; K213-E217 WeakPolarHBondContact O-CG 3.3Å; K213-E217 PolarHBondContact O-N 3.26Å |
| 214 | A | 79.7 | Confident | 75.6 | Confident | 55 Ų | 55 | 125.5 Ų | 125.5 | 46% | 0.455 | 60% | 0.598 | S | S | . | * | H | α-helix | trans | -63.1 | -38.5 | 175.6 | 0 | 0 | 0 | 0 | 0 | 112.2 | K210 L211 E217 R218 | K210-A214 WeakPolarHBondContact O-CB 3.32Å; K210-A214 PolarHBondContact O-N 3.33Å; L211-A214 PolarHBondContact O-N 3.47Å; A214-E217 PolarHBondContact O-N 2.88Å; A214-R218 VanDerWaalsContact O-CB 3.3Å; A214-R218 WeakPolarHBondContact O-CB 3.39Å; A214-R218 PolarHBondContact O-N 2.81Å |
| 215 | K | 76.9 | Confident | 73.8 | Confident | 144 Ų | 144 | 126 Ų | 126 | 63% | 0.626 | 61% | 0.61 | S | S | * | * | H | α-helix | trans | -64.7 | -43.9 | 173.5 | -76.8 | 173.7 | 179.8 | 176.6 | 0 | 112 | L211 E212 K213 R218 T219 | L211-K215 WeakPolarHBondContact O-CB 3.41Å; L211-K215 VanDerWaalsContact O-CG 3.27Å; L211-K215 WeakPolarHBondContact O-CG 3.47Å; L211-K215 PolarHBondContact O-N 2.88Å; E212-K215 PolarHBondContact O-N 2.85Å; K213-K215 VanDerWaalsContact C-N 3.34Å; K213-K215 PolarHBondContact O-N 2.93Å; K215-R218 PolarHBondContact O-N 2.71Å; K215-T219 WeakPolarHBondContact O-CG2 3.43Å; K215-T219 PolarHBondContact O-N 2.84Å; K215-T219 VanDerWaalsContact O-N 3.09Å; K215-T219 PolarHBondContact O-OG1 3.47Å |
| 216 | K | 75.6 | Confident | 71.8 | Confident | 117 Ų | 117 | 123 Ų | 123 | 51% | 0.509 | 62% | 0.618 | S | S | . | * | H | α-helix | trans | -64.9 | -37 | 176.3 | -73.8 | 167.6 | -179.2 | 165.9 | 0 | 112.2 | E212 K213 T219 K220 | E212-K216 VanDerWaalsContact CD-CE 3.45Å; E212-K216 HydrophobicContact CG-CD 4.41Å; E212-K216 WeakPolarHBondContact O-CB 3.27Å; E212-K216 VanDerWaalsContact O-CG 3.27Å; E212-K216 WeakPolarHBondContact O-CG 3.41Å; E212-K216 PolarHBondContact O-N 3.32Å; E212-K216 WeakPolarHBondContact OE1-CE 3.11Å; E212-K216 IonicContact OE1-NZ 3.32Å; E212-K216 PolarHBondContact OE1-NZ 3.09Å; E212-K216 IonicContact OE2-NZ 3.13Å; E212-K216 PolarHBondContact OE2-NZ 3.44Å; K213-K216 PolarHBondContact O-N 3.4Å; K216-T219 PolarHBondContact O-OG1 3.27Å; K216-K220 WeakPolarHBondContact O-CB 3.5Å; K216-K220 PolarHBondContact O-N 3.04Å |
| 217 | E | 69.3 | Low | 69.6 | Low | 108 Ų | 108 | 125.5 Ų | 125.5 | 51% | 0.505 | 64% | 0.638 | S | S | . | * | H | α-helix | trans | -74.5 | -38.6 | 176.8 | -73.9 | -178.6 | -177.2 | 0 | 0 | 112 | K213 A214 K220 | K213-E217 WeakPolarHBondContact CE-OE1 3.27Å; K213-E217 WeakPolarHBondContact O-CB 3.45Å; K213-E217 WeakPolarHBondContact O-CG 3.3Å; K213-E217 PolarHBondContact O-N 3.26Å; A214-E217 PolarHBondContact O-N 2.88Å; E217-K220 PolarHBondContact O-N 3.35Å |
| 218 | R | 64.1 | Low | 67.3 | Low | 186 Ų | 186 | 129.5 Ų | 129.5 | 70% | 0.702 | 65% | 0.654 | S | S | * | * | H | α-helix | trans | -61.5 | -44 | 174.3 | -173.5 | -168 | 172.6 | -160.8 | -2.4 | 112.1 | A214 K215 K220 | A214-R218 VanDerWaalsContact O-CB 3.3Å; A214-R218 WeakPolarHBondContact O-CB 3.39Å; A214-R218 PolarHBondContact O-N 2.81Å; K215-R218 PolarHBondContact O-N 2.71Å; R218-K220 VanDerWaalsContact C-N 3.3Å; R218-K220 PolarHBondContact O-N 2.91Å |
| 219 | T | 63.9 | Low | 65.1 | Low | 85 Ų | 85 | 133.3 Ų | 133.3 | 52% | 0.521 | 67% | 0.667 | S | S | . | * | H | α-helix | trans | -74.9 | -18.4 | -179.1 | 52.5 | 0 | 0 | 0 | 0 | 113.5 | K215 K216 I221 F223 | K215-T219 WeakPolarHBondContact O-CG2 3.43Å; K215-T219 PolarHBondContact O-N 2.84Å; K215-T219 VanDerWaalsContact O-N 3.09Å; K215-T219 PolarHBondContact O-OG1 3.47Å; K216-T219 PolarHBondContact O-OG1 3.27Å; T219-I221 VanDerWaalsContact C-N 3.34Å; T219-F223 WeakPolarHBondContact O-CD2 3.45Å |
| 220 | K | 62.3 | Low | 62.6 | Low | 171 Ų | 171 | 132.7 Ų | 132.7 | 74% | 0.743 | 68% | 0.68 | S | S | * | * | H | α-helix | trans | -74 | -21.2 | 177.4 | -171.2 | 172.8 | 179.5 | -177.1 | 0 | 113.6 | K216 E217 R218 | K216-K220 WeakPolarHBondContact O-CB 3.5Å; K216-K220 PolarHBondContact O-N 3.04Å; E217-K220 PolarHBondContact O-N 3.35Å; R218-K220 VanDerWaalsContact C-N 3.3Å; R218-K220 PolarHBondContact O-N 2.91Å |
| 221 | I | 56.5 | Low | 60 | Low | 141 Ų | 141 | 131 Ų | 131 | 72% | 0.723 | 68% | 0.683 | S | S | * | * | H | α-helix | trans | -86.8 | -20.4 | -174.9 | -62.3 | 169.8 | 0 | 0 | 0 | 112.5 | T219 | T219-I221 VanDerWaalsContact C-N 3.34Å |
| 222 | E | 54.2 | Low | 57.7 | Low | 143 Ų | 143 | 132 Ų | 132 | 67% | 0.668 | 69% | 0.694 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -87 | -1.4 | -176.7 | -71.5 | -171.4 | 175.1 | 0 | 0 | 115.2 | ||
| 223 | F | 53.3 | Low | 55.4 | Low | 188 Ų | 188 | 134 Ų | 134 | 83% | 0.825 | 71% | 0.713 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -95.5 | 9.7 | -175.4 | -87.2 | -80.9 | 0 | 0 | 0 | 116.4 | T219 | T219-F223 WeakPolarHBondContact O-CD2 3.45Š|
| 224 | V | 57.3 | Low | 53.1 | Low | 131 Ų | 131 | 135.1 Ų | 135.1 | 79% | 0.794 | 73% | 0.725 | S | S | * | * | S | Bend | trans | -111.5 | -4.7 | -177.6 | 179.5 | 0 | 0 | 0 | 0 | 115 | ||
| 225 | T | 54.4 | Low | 51 | Low | 133 Ų | 133 | 137.6 Ų | 137.6 | 82% | 0.816 | 75% | 0.745 | S | S | * | * | trans | -119.1 | 100.7 | 178.7 | 56 | 0 | 0 | 0 | 0 | 112.2 | ||||
| 226 | G | 48.1 | Very low | 48.9 | Very low | 76 Ų | 76 | 137.1 Ų | 137.1 | 78% | 0.784 | 75% | 0.754 | S | S | * | * | trans | 169.8 | 61.9 | 172 | 0 | 0 | 0 | 0 | 0 | 115.9 | ||||
| 227 | T | 45.2 | Very low | 47.1 | Very low | 152 Ų | 152 | 135.8 Ų | 135.8 | 93% | 0.933 | 77% | 0.766 | S | S | * | * | trans | -84.6 | 105.4 | 165.6 | -46 | 0 | 0 | 0 | 0 | 109.9 | ||||
| 228 | K | 38.6 | Very low | 45.5 | Very low | 211 Ų | 211 | 136.8 Ų | 136.8 | 92% | 0.917 | 78% | 0.779 | S | S | * | * | trans | -163 | 143.6 | 147.4 | -152.6 | 169.9 | 178.1 | -179.6 | 0 | 113.6 | ||||
| 229 | K | 40.6 | Very low | 44.1 | Very low | 199 Ų | 199 | 133.3 Ų | 133.3 | 87% | 0.865 | 78% | 0.779 | S | S | * | * | trans | -89.9 | 151.6 | -168.9 | 166.8 | 179.8 | 178.4 | 179.2 | 0 | 114.4 | ||||
| 230 | G | 36.3 | Very low | 42.7 | Very low | 70 Ų | 70 | 135.6 Ų | 135.6 | 72% | 0.722 | 79% | 0.793 | S | S | * | * | trans | 118.3 | 147.8 | 149.8 | 0 | 0 | 0 | 0 | 0 | 115.9 | ||||
| 231 | T | 33.7 | Very low | 41.6 | Very low | 125 Ų | 125 | 133 Ų | 133 | 77% | 0.767 | 79% | 0.792 | S | S | * | * | cis | -175.8 | 129.3 | -27.7 | -92.3 | 0 | 0 | 0 | 0 | 106 | ||||
| 232 | T | 34 | Very low | 40.4 | Very low | 111 Ų | 111 | 132.9 Ų | 132.9 | 68% | 0.681 | 80% | 0.797 | S | S | * | * | trans | 55.4 | 126.2 | 146.9 | -50.9 | 0 | 0 | 0 | 0 | 123.2 | ||||
| 233 | T | 34.9 | Very low | 39.5 | Very low | 140 Ų | 140 | 130 Ų | 130 | 86% | 0.859 | 80% | 0.798 | S | S | * | * | 179.5 | 146.3 | 105 | 37.9 | 0 | 0 | 0 | 0 | 113.6 | |||||
| 234 | N | 36.7 | Very low | 38.6 | Very low | 152 Ų | 152 | 126.2 Ų | 126.2 | 81% | 0.813 | 80% | 0.795 | S | S | * | * | trans | -61.4 | 157.2 | -173.6 | -63.3 | -4.2 | 0 | 0 | 0 | 117.7 | ||||
| 235 | A | 35.7 | Very low | 37.4 | Very low | 106 Ų | 106 | 126.3 Ų | 126.3 | 88% | 0.876 | 80% | 0.796 | S | S | * | * | -157.4 | 140.1 | 128.4 | 0 | 0 | 0 | 0 | 0 | 112.1 | |||||
| 236 | T | 32.2 | Very low | 36.5 | Very low | 134 Ų | 134 | 124.6 Ų | 124.6 | 82% | 0.822 | 80% | 0.795 | S | S | * | * | trans | -88.9 | 146.7 | -166.8 | -45.5 | 0 | 0 | 0 | 0 | 112.6 | ||||
| 237 | A | 36.8 | Very low | 36.1 | Very low | 90 Ų | 90 | 128.1 Ų | 128.1 | 74% | 0.744 | 80% | 0.801 | S | S | * | * | trans | -172.9 | 107.5 | 138.8 | 0 | 0 | 0 | 0 | 0 | 113.4 | ||||
| 238 | T | 35.9 | Very low | 35.8 | Very low | 129 Ų | 129 | 125.3 Ų | 125.3 | 79% | 0.791 | 79% | 0.793 | S | S | * | * | 74.7 | 101.6 | 128.6 | -39.7 | 0 | 0 | 0 | 0 | 121.2 | |||||
| 239 | T | 35.7 | Very low | 35.7 | Very low | 112 Ų | 112 | 122.6 Ų | 122.6 | 69% | 0.687 | 79% | 0.789 | S | S | * | * | trans | -44.7 | 137.2 | 150.9 | -22.6 | 0 | 0 | 0 | 0 | 114.7 | ||||
| 240 | T | 34.9 | Very low | 36 | Very low | 133 Ų | 133 | 117.4 Ų | 117.4 | 82% | 0.816 | 78% | 0.783 | S | S | * | * | trans | -147.5 | 116.9 | 131 | -53.7 | 0 | 0 | 0 | 0 | 109 | ||||
| 241 | T | 38.4 | Very low | 36.5 | Very low | 118 Ų | 118 | 122.9 Ų | 122.9 | 72% | 0.724 | 79% | 0.79 | S | S | * | * | trans | -108.7 | 129.8 | 172.4 | -35.2 | 0 | 0 | 0 | 0 | 106.9 | ||||
| 242 | T | 31.7 | Very low | 37.2 | Very low | 137 Ų | 137 | 126.8 Ų | 126.8 | 84% | 0.84 | 80% | 0.796 | S | S | * | * | trans | -145.6 | 115.9 | 152.7 | -24.8 | 0 | 0 | 0 | 0 | 109.7 | ||||
| 243 | A | 35.2 | Very low | 38.3 | Very low | 83 Ų | 83 | 133.3 Ų | 133.3 | 69% | 0.686 | 81% | 0.808 | S | S | * | * | trans | -104 | 144.9 | 169.7 | 0 | 0 | 0 | 0 | 0 | 108.6 | ||||
| 244 | S | 34.3 | Very low | 39.2 | Very low | 108 Ų | 108 | 134.5 Ų | 134.5 | 76% | 0.755 | 80% | 0.802 | S | S | * | * | trans | -174.1 | 101.4 | 154.6 | -68.2 | 0 | 0 | 0 | 0 | 108.2 | ||||
| 245 | T | 32.7 | Very low | 40.4 | Very low | 133 Ų | 133 | 130.9 Ų | 130.9 | 82% | 0.816 | 79% | 0.788 | S | S | * | * | 74.5 | 111.8 | 104.1 | 52.9 | 0 | 0 | 0 | 0 | 117.5 | |||||
| 246 | A | 35.1 | Very low | 41.3 | Very low | 97 Ų | 97 | 135.7 Ų | 135.7 | 80% | 0.802 | 79% | 0.789 | S | S | * | * | trans | 44.6 | 122.9 | 135.2 | 0 | 0 | 0 | 0 | 0 | 121.5 | ||||
| 247 | V | 38.6 | Very low | 42.4 | Very low | 151 Ų | 151 | 140.6 Ų | 140.6 | 92% | 0.915 | 79% | 0.793 | S | S | * | * | trans | -154.3 | 139.8 | 130.6 | -89.8 | 0 | 0 | 0 | 0 | 110 | ||||
| 248 | A | 39.2 | Very low | 43 | Very low | 92 Ų | 92 | 142.6 Ų | 142.6 | 76% | 0.76 | 79% | 0.791 | S | S | * | * | trans | -66.4 | 148.7 | 175 | 0 | 0 | 0 | 0 | 0 | 111.7 | ||||
| 249 | D | 36.7 | Very low | 43.5 | Very low | 155 Ų | 155 | 140.8 Ų | 140.8 | 83% | 0.829 | 78% | 0.784 | S | S | * | * | -162.3 | 141.7 | 126.5 | -131.7 | -57.6 | 0 | 0 | 0 | 112.1 | |||||
| 250 | A | 46.4 | Very low | 43.7 | Very low | 90 Ų | 90 | 140 Ų | 140 | 74% | 0.744 | 79% | 0.788 | S | S | * | * | trans | -86.2 | 110.9 | -177.5 | 0 | 0 | 0 | 0 | 0 | 109.1 | ||||
| 251 | Q | 46.9 | Very low | 44 | Very low | 185 Ų | 185 | 141 Ų | 141 | 86% | 0.864 | 79% | 0.787 | S | S | * | * | trans | -126.2 | 121.3 | 163.4 | -71.1 | -168.2 | -69 | 0 | 0 | 111.8 | ||||
| 252 | K | 50 | Low | 44 | Very low | 207 Ų | 207 | 140.6 Ų | 140.6 | 90% | 0.9 | 79% | 0.787 | S | S | * | * | trans | -54 | 133.6 | -175.4 | -62.9 | 177.9 | 176.9 | -176 | 0 | 110.6 | K254 | K252-K254 PolarHBondContact O-N 3.49Š| ||
| 253 | R | 57.2 | Low | 44.5 | Very low | 247 Ų | 247 | 140.7 Ų | 140.7 | 93% | 0.932 | 79% | 0.787 | S | S | * | * | trans | -60.4 | 100.7 | 169.3 | -60.3 | 168.6 | 70.4 | -174.4 | 1.6 | 108.1 | S255 | R253-S255 PolarHBondContact O-N 3.36Š| ||
| 254 | K | 53.5 | Low | 44.7 | Very low | 166 Ų | 166 | 142.5 Ų | 142.5 | 72% | 0.722 | 79% | 0.789 | S | S | * | * | trans | -69.2 | 118.4 | 163.5 | 62.3 | 137.9 | 75.3 | -166.6 | 0 | 108 | K252 | K252-K254 PolarHBondContact O-N 3.49Š| ||
| 255 | S | 61.8 | Low | 45 | Very low | 76 Ų | 76 | 143.6 Ų | 143.6 | 53% | 0.531 | 79% | 0.792 | S | S | . | * | trans | -72 | 150.1 | 176.6 | 66.6 | 0 | 0 | 0 | 0 | 109.1 | R253 W257 D258 | R253-S255 PolarHBondContact O-N 3.36Å; S255-W257 PolarHBondContact O-N 3.3Å; S255-D258 PolarHBondContact O-N 3.34Å | ||
| 256 | K | 53.6 | Low | 45.4 | Very low | 206 Ų | 206 | 145.2 Ų | 145.2 | 90% | 0.896 | 79% | 0.794 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -75.4 | 33.2 | -173.9 | -158 | 167.8 | 170.9 | 170.3 | 0 | 112.8 | ||
| 257 | W | 55.9 | Low | 45.7 | Very low | 238 Ų | 238 | 145 Ų | 145 | 90% | 0.902 | 79% | 0.792 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -127.5 | -4.4 | -177.6 | -74.7 | 96.3 | 0 | 0 | 0 | 113.1 | S255 | S255-W257 PolarHBondContact O-N 3.3Š|
| 258 | D | 49.3 | Very low | 46.1 | Very low | 132 Ų | 132 | 146.4 Ų | 146.4 | 71% | 0.706 | 79% | 0.789 | S | S | * | * | trans | -126.9 | 84.5 | 179.3 | -153.3 | 7 | 0 | 0 | 0 | 110.5 | S255 | S255-D258 PolarHBondContact O-N 3.34Š| ||
| 259 | S | 47.1 | Very low | 46.1 | Very low | 90 Ų | 90 | 147.9 Ų | 147.9 | 63% | 0.629 | 79% | 0.79 | S | S | * | * | trans | -145 | 103.8 | 159.7 | -71 | 0 | 0 | 0 | 0 | 107.2 | ||||
| 260 | A | 40.2 | Very low | 46.2 | Very low | 95 Ų | 95 | 146.7 Ų | 146.7 | 79% | 0.785 | 79% | 0.789 | S | S | * | * | P | Polyproline II helix | trans | -52 | 138.1 | 171.6 | 0 | 0 | 0 | 0 | 0 | 111.3 | P262 | A260-P262 WeakPolarHBondContact O-CD 3.43Š|
| 261 | I | 40.3 | Very low | 45.7 | Very low | 155 Ų | 155 | 149.9 Ų | 149.9 | 80% | 0.795 | 79% | 0.792 | S | S | * | * | P | Polyproline II helix | trans | -86.4 | 119.2 | -178.3 | -52.4 | 168.6 | 0 | 0 | 0 | 107.9 | ||
| 262 | P | 37.9 | Very low | 45.2 | Very low | 110 Ų | 110 | 148.7 Ų | 148.7 | 71% | 0.714 | 79% | 0.791 | S | S | * | * | P | Polyproline II helix | trans | -79.6 | 129.6 | 159.7 | 29.3 | -29 | 0 | 0 | 0 | 109.9 | A260 T264 | A260-P262 WeakPolarHBondContact O-CD 3.43Å; P262-T264 PolarHBondContact O-N 3.45Å |
| 263 | V | 43.5 | Very low | 44.4 | Very low | 139 Ų | 139 | 145.1 Ų | 145.1 | 84% | 0.842 | 79% | 0.786 | S | S | * | * | P | Polyproline II helix | trans | -59.4 | 121.2 | 174.2 | 171.2 | 0 | 0 | 0 | 0 | 110.5 | ||
| 264 | T | 39.4 | Very low | 43.6 | Very low | 120 Ų | 120 | 139.9 Ų | 139.9 | 74% | 0.736 | 78% | 0.782 | S | S | * | * | trans | -140.7 | 106.8 | 161.2 | 27 | 0 | 0 | 0 | 0 | 110.4 | P262 | P262-T264 PolarHBondContact O-N 3.45Š| ||
| 265 | T | 39.9 | Very low | 42.8 | Very low | 131 Ų | 131 | 137.9 Ų | 137.9 | 80% | 0.804 | 78% | 0.784 | S | S | * | * | trans | 29.9 | 103.6 | 142.3 | 54.1 | 0 | 0 | 0 | 0 | 118 | A267 | T265-A267 PolarHBondContact O-N 3.48Š| ||
| 266 | I | 40.1 | Very low | 41.5 | Very low | 168 Ų | 168 | 138.8 Ų | 138.8 | 86% | 0.862 | 80% | 0.796 | S | S | * | * | P | Polyproline II helix | trans | -71.9 | 117.5 | 169.8 | -66 | 166.6 | 0 | 0 | 0 | 109.4 | ||
| 267 | A | 41.6 | Very low | 40.7 | Very low | 93 Ų | 93 | 135 Ų | 135 | 77% | 0.769 | 79% | 0.79 | S | S | * | * | P | Polyproline II helix | trans | -94.3 | 128.8 | 155.8 | 0 | 0 | 0 | 0 | 0 | 108 | T265 | T265-A267 PolarHBondContact O-N 3.48Š|
| 268 | Q | 47.6 | Very low | 39.9 | Very low | 180 Ų | 180 | 131.6 Ų | 131.6 | 84% | 0.841 | 79% | 0.789 | S | S | * | * | P | Polyproline II helix | trans | -65.7 | 142.1 | -178.9 | -69.8 | 175.5 | -21.9 | 0 | 0 | 111.9 | ||
| 269 | P | 39.1 | Very low | 39.8 | Very low | 122 Ų | 122 | 131.2 Ų | 131.2 | 79% | 0.792 | 79% | 0.793 | S | S | * | * | P | Polyproline II helix | trans | -88.4 | 129.2 | 164.9 | 32.4 | -28.6 | 0 | 0 | 0 | 111.5 | ||
| 270 | T | 38.4 | Very low | 39.3 | Very low | 130 Ų | 130 | 131.3 Ų | 131.3 | 80% | 0.798 | 80% | 0.8 | S | S | * | * | P | Polyproline II helix | trans | -64 | 130.7 | 171.8 | -54 | 0 | 0 | 0 | 0 | 111.5 | ||
| 271 | I | 36.2 | Very low | 39.2 | Very low | 158 Ų | 158 | 132.8 Ų | 132.8 | 81% | 0.81 | 80% | 0.798 | S | S | * | * | P | Polyproline II helix | trans | -79.2 | 124.6 | 173 | 0.8 | 176.5 | 0 | 0 | 0 | 109.2 | ||
| 272 | L | 36.7 | Very low | 39.3 | Very low | 160 Ų | 160 | 132.1 Ų | 132.1 | 84% | 0.838 | 80% | 0.801 | S | S | * | * | trans | -97 | 109.2 | 170.2 | -71.1 | 172.5 | 0 | 0 | 0 | 109.5 | ||||
| 273 | T | 33.3 | Very low | 39.3 | Very low | 131 Ų | 131 | 132.1 Ų | 132.1 | 80% | 0.804 | 80% | 0.799 | S | S | * | * | trans | -72.9 | 123.5 | 168.3 | -61.1 | 0 | 0 | 0 | 0 | 109.6 | ||||
| 274 | T | 39.1 | Very low | 39 | Very low | 137 Ų | 137 | 131.9 Ų | 131.9 | 84% | 0.84 | 80% | 0.798 | S | S | * | * | trans | -124.2 | 110.1 | 165.7 | 29.6 | 0 | 0 | 0 | 0 | 110.2 | ||||
| 275 | T | 37.5 | Very low | 39 | Very low | 125 Ų | 125 | 131.4 Ų | 131.4 | 77% | 0.767 | 80% | 0.795 | S | S | * | * | trans | -70.1 | 130.5 | 166.6 | -77.6 | 0 | 0 | 0 | 0 | 109.3 | ||||
| 276 | A | 35 | Very low | 39.5 | Very low | 95 Ų | 95 | 131.4 Ų | 131.4 | 79% | 0.785 | 80% | 0.795 | S | S | * | * | trans | -90.1 | 126.7 | 179 | 0 | 0 | 0 | 0 | 0 | 111.9 | ||||
| 277 | T | 36.7 | Very low | 39.5 | Very low | 125 Ų | 125 | 128.6 Ų | 128.6 | 77% | 0.767 | 79% | 0.79 | S | S | * | * | trans | -143.3 | 109.9 | 157.3 | 36.1 | 0 | 0 | 0 | 0 | 111 | ||||
| 278 | L | 39.4 | Very low | 39.5 | Very low | 168 Ų | 168 | 129.2 Ų | 129.2 | 88% | 0.88 | 80% | 0.795 | S | S | * | * | trans | 64.8 | 148.2 | 154.6 | -56.2 | 177.3 | 0 | 0 | 0 | 121 | ||||
| 279 | P | 47.3 | Very low | 39 | Very low | 124 Ų | 124 | 126.6 Ų | 126.6 | 81% | 0.805 | 80% | 0.797 | S | S | * | * | trans | -99.1 | 130.9 | -162.4 | 36.3 | -28.6 | 0 | 0 | 0 | 113.2 | ||||
| 280 | A | 35.9 | Very low | 39.2 | Very low | 92 Ų | 92 | 124.1 Ų | 124.1 | 76% | 0.76 | 79% | 0.794 | S | S | * | * | trans | -148.7 | 118 | 167.1 | 0 | 0 | 0 | 0 | 0 | 112.4 | ||||
| 281 | V | 38.5 | Very low | 39.4 | Very low | 125 Ų | 125 | 123.7 Ų | 123.7 | 76% | 0.758 | 80% | 0.796 | S | S | * | * | trans | 50 | 102.3 | 148.4 | -170.7 | 0 | 0 | 0 | 0 | 117.4 | T283 | V281-T283 HydrophobicContact CG1-CG2 4.25Å; V281-T283 PolarHBondContact O-N 2.84Å | ||
| 282 | V | 41.3 | Very low | 39.9 | Very low | 141 Ų | 141 | 125.8 Ų | 125.8 | 86% | 0.855 | 80% | 0.799 | S | S | * | * | trans | -84.7 | 102.5 | 164.7 | -176.1 | 0 | 0 | 0 | 0 | 109.3 | ||||
| 283 | T | 38.8 | Very low | 40.1 | Very low | 110 Ų | 110 | 124.1 Ų | 124.1 | 68% | 0.675 | 80% | 0.796 | S | S | * | * | trans | -79.3 | 127.3 | 164.1 | 42.1 | 0 | 0 | 0 | 0 | 110.4 | V281 T285 | V281-T283 HydrophobicContact CG1-CG2 4.25Å; V281-T283 PolarHBondContact O-N 2.84Å; T283-T285 PolarHBondContact O-N 3.49Å | ||
| 284 | V | 37.7 | Very low | 40.9 | Very low | 134 Ų | 134 | 123.8 Ų | 123.8 | 81% | 0.812 | 79% | 0.794 | S | S | * | * | trans | -78 | 107.7 | 174.2 | -175.5 | 0 | 0 | 0 | 0 | 108.8 | ||||
| 285 | T | 38.7 | Very low | 41.3 | Very low | 110 Ų | 110 | 123 Ų | 123 | 68% | 0.675 | 79% | 0.789 | S | S | * | * | trans | -110.1 | 109.8 | 169.3 | -56.8 | 0 | 0 | 0 | 0 | 109.7 | T283 S287 | T283-T285 PolarHBondContact O-N 3.49Å; T285-S287 PolarHBondContact O-N 3.03Å | ||
| 286 | T | 50.6 | Low | 41.7 | Very low | 132 Ų | 132 | 124.2 Ų | 124.2 | 81% | 0.81 | 79% | 0.789 | S | S | * | * | trans | -72.5 | 112.8 | 165.5 | 48 | 0 | 0 | 0 | 0 | 109.6 | ||||
| 287 | S | 38.9 | Very low | 42.6 | Very low | 108 Ų | 108 | 124 Ų | 124 | 76% | 0.755 | 78% | 0.782 | S | S | * | * | trans | -119.6 | 102 | 169.4 | -58.5 | 0 | 0 | 0 | 0 | 109.1 | T285 | T285-S287 PolarHBondContact O-N 3.03Š| ||
| 288 | A | 42.9 | Very low | 43.3 | Very low | 106 Ų | 106 | 123 Ų | 123 | 88% | 0.876 | 79% | 0.787 | S | S | * | * | trans | -74.8 | 128.3 | 170.4 | 0 | 0 | 0 | 0 | 0 | 110.1 | ||||
| 289 | S | 37.3 | Very low | 43.6 | Very low | 125 Ų | 125 | 120.3 Ų | 120.3 | 87% | 0.874 | 78% | 0.776 | S | S | * | * | trans | -154.6 | 129.3 | 153.3 | -169.8 | 0 | 0 | 0 | 0 | 108.6 | ||||
| 290 | G | 42.3 | Very low | 43.3 | Very low | 71 Ų | 71 | 117.8 Ų | 117.8 | 73% | 0.732 | 77% | 0.773 | S | S | * | * | trans | -85.5 | 141 | -157.3 | 0 | 0 | 0 | 0 | 0 | 115.5 | ||||
| 291 | S | 42.7 | Very low | 43.8 | Very low | 120 Ų | 120 | 119.6 Ų | 119.6 | 84% | 0.839 | 78% | 0.775 | S | S | * | * | S | Bend | trans | -160.1 | 111.9 | 133.6 | -13 | 0 | 0 | 0 | 0 | 109.6 | ||
| 292 | K | 46.2 | Very low | 44.3 | Very low | 202 Ų | 202 | 121.5 Ų | 121.5 | 88% | 0.878 | 78% | 0.779 | S | S | * | * | trans | 44.6 | 87.1 | 160.9 | -57 | 178.9 | -174.5 | 175.1 | 0 | 117.2 | T294 | K292-T294 PolarHBondContact O-N 3.3Š| ||
| 293 | T | 41.9 | Very low | 44.7 | Very low | 125 Ų | 125 | 120.9 Ų | 120.9 | 77% | 0.767 | 78% | 0.776 | S | S | * | * | trans | -60.9 | 119.8 | 162.6 | -91.8 | 0 | 0 | 0 | 0 | 110.6 | V295 | T293-V295 HydrophobicContact CG2-CB 4.42Å; T293-V295 HydrophobicContact CG2-CG2 3.3Å | ||
| 294 | T | 50.1 | Low | 45.3 | Very low | 124 Ų | 124 | 125.2 Ų | 125.2 | 76% | 0.761 | 79% | 0.785 | S | S | * | * | trans | -98.7 | 102.7 | 154.6 | -62.7 | 0 | 0 | 0 | 0 | 106.3 | K292 I296 | K292-T294 PolarHBondContact O-N 3.3Å; T294-I296 HydrophobicContact CG2-CG1 4.4Å; T294-I296 PolarHBondContact O-N 3.45Å; T294-I296 VanDerWaalsContact O-N 3.14Å | ||
| 295 | V | 46.9 | Very low | 45.6 | Very low | 121 Ų | 121 | 128.7 Ų | 128.7 | 73% | 0.733 | 79% | 0.789 | S | S | * | * | trans | -69.7 | 105.8 | 170.9 | -177.4 | 0 | 0 | 0 | 0 | 107.1 | T293 S297 | T293-V295 HydrophobicContact CG2-CB 4.42Å; T293-V295 HydrophobicContact CG2-CG2 3.3Å; V295-S297 PolarHBondContact O-N 3.47Å | ||
| 296 | I | 47 | Very low | 46 | Very low | 150 Ų | 150 | 127.9 Ų | 127.9 | 77% | 0.769 | 79% | 0.794 | S | S | * | * | trans | -78.5 | 105.3 | 167.7 | -57.1 | 173.9 | 0 | 0 | 0 | 106.3 | T294 A298 | T294-I296 HydrophobicContact CG2-CG1 4.4Å; T294-I296 PolarHBondContact O-N 3.45Å; T294-I296 VanDerWaalsContact O-N 3.14Å; I296-A298 PolarHBondContact O-N 3.36Å | ||
| 297 | S | 53 | Low | 45.8 | Very low | 92 Ų | 92 | 131.4 Ų | 131.4 | 64% | 0.643 | 80% | 0.798 | S | S | * | * | trans | -67.3 | 116.5 | 173.2 | -171.6 | 0 | 0 | 0 | 0 | 109.4 | V295 V299 | V295-S297 PolarHBondContact O-N 3.47Å; S297-V299 PolarHBondContact O-N 3Å | ||
| 298 | A | 52.7 | Low | 45.9 | Very low | 104 Ų | 104 | 138.9 Ų | 138.9 | 86% | 0.86 | 82% | 0.821 | S | S | * | * | trans | -81.5 | 49.1 | 177.1 | 0 | 0 | 0 | 0 | 0 | 112.2 | I296 | I296-A298 PolarHBondContact O-N 3.36Š| ||
| 299 | V | 44.3 | Very low | 46 | Very low | 110 Ų | 110 | 140.6 Ų | 140.6 | 67% | 0.667 | 82% | 0.818 | S | S | * | * | trans | -119.6 | 90.3 | 170.6 | -177.8 | 0 | 0 | 0 | 0 | 108.1 | S297 T301 | S297-V299 PolarHBondContact O-N 3Å; V299-T301 PolarHBondContact O-N 3.36Å | ||
| 300 | G | 42.1 | Very low | 46.5 | Very low | 72 Ų | 72 | 141.4 Ų | 141.4 | 74% | 0.742 | 82% | 0.815 | S | S | * | * | trans | -66.1 | 113 | 170.9 | 0 | 0 | 0 | 0 | 0 | 110.4 | I302 | G300-I302 PolarHBondContact O-N 3.23Š| ||
| 301 | T | 46.8 | Very low | 46.7 | Very low | 130 Ų | 130 | 145.3 Ų | 145.3 | 80% | 0.798 | 82% | 0.82 | S | S | * | * | trans | -83.5 | 106.6 | 168.4 | 18 | 0 | 0 | 0 | 0 | 108.9 | V299 V303 | V299-T301 PolarHBondContact O-N 3.36Å; T301-V303 PolarHBondContact O-N 3.28Å | ||
| 302 | I | 48.6 | Very low | 47 | Very low | 165 Ų | 165 | 146.8 Ų | 146.8 | 85% | 0.846 | 82% | 0.819 | S | S | * | * | trans | -82.3 | 104.8 | 173.1 | -48.6 | 167.4 | 0 | 0 | 0 | 107.6 | G300 K304 | G300-I302 PolarHBondContact O-N 3.23Å; I302-K304 PolarHBondContact O-N 3.14Å | ||
| 303 | V | 49.2 | Very low | 47 | Very low | 128 Ų | 128 | 143.3 Ų | 143.3 | 78% | 0.776 | 82% | 0.815 | S | S | * | * | trans | -77.8 | 107.3 | 170 | 179.6 | 0 | 0 | 0 | 0 | 108.5 | T301 K305 | T301-V303 PolarHBondContact O-N 3.28Å; V303-K305 PolarHBondContact O-N 3.34Å | ||
| 304 | K | 51.2 | Low | 47.4 | Very low | 200 Ų | 200 | 144.5 Ų | 144.5 | 87% | 0.87 | 82% | 0.818 | S | S | * | * | P | Polyproline II helix | trans | -65 | 117.7 | 165.2 | -89.5 | 178.9 | 172.7 | 167.8 | 0 | 108.9 | I302 | I302-K304 PolarHBondContact O-N 3.14Š|
| 305 | K | 45.3 | Very low | 47.2 | Very low | 208 Ų | 208 | 146 Ų | 146 | 90% | 0.904 | 82% | 0.822 | S | S | * | * | P | Polyproline II helix | trans | -94.1 | 122.6 | 163.9 | -155.6 | -180 | -176.6 | -178 | 0 | 109.6 | V303 | V303-K305 PolarHBondContact O-N 3.34Š|
| 306 | A | 46.5 | Very low | 47.2 | Very low | 93 Ų | 93 | 147.9 Ų | 147.9 | 77% | 0.769 | 83% | 0.829 | S | S | * | * | P | Polyproline II helix | trans | -73.3 | 154.7 | 179.3 | 0 | 0 | 0 | 0 | 0 | 112.5 | ||
| 307 | K | 45.9 | Very low | 47.2 | Very low | 206 Ų | 206 | 147.8 Ų | 147.8 | 90% | 0.896 | 83% | 0.834 | S | S | * | * | P | Polyproline II helix | trans | -65.4 | 127.1 | 173.2 | -174.4 | 173.2 | -177.9 | 176.7 | 0 | 110.5 | ||
| 308 | Q | 41.3 | Very low | 46.7 | Very low | 265 Ų | 265 | 152.8 Ų | 152.8 | 100% | 1.238 | 85% | 0.851 | S | S | * | * | trans | -130.8 | 0 | 151.4 | -101.4 | -171.9 | -22.8 | 0 | 0 | 107 |
Retrieved 308 of 308 residues in 111 ms
(Link to these results)