| 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 | 37.5 | Very low | 50.5 | Low | 247 Ų | 247 | 154.1 Ų | 154.1 | 100% | 1.217 | 88% | 0.878 | S | S | * | * | 0 | 121.6 | 0 | -68.5 | -169.1 | -165.1 | 0 | 0 | 108.1 | |||||
| 2 | A | 42.3 | Very low | 50.5 | Low | 104 Ų | 104 | 148.8 Ų | 148.8 | 86% | 0.86 | 87% | 0.867 | S | S | * | * | P | Polyproline II helix | trans | -84.8 | 121.6 | -178.1 | 0 | 0 | 0 | 0 | 0 | 110.5 | ||
| 3 | G | 51.2 | Low | 50.1 | Low | 69 Ų | 69 | 146.9 Ų | 146.9 | 71% | 0.711 | 86% | 0.859 | S | S | * | * | P | Polyproline II helix | trans | -79.3 | 122.2 | 175.9 | 0 | 0 | 0 | 0 | 0 | 111.3 | ||
| 4 | K | 55.2 | Low | 49.5 | Very low | 212 Ų | 212 | 153.6 Ų | 153.6 | 92% | 0.922 | 87% | 0.865 | S | S | * | * | P | Polyproline II helix | trans | -76 | 122.8 | 174.3 | -66 | 165.2 | 175.2 | 177.3 | 0 | 108.7 | ||
| 5 | K | 60.7 | Low | 49.1 | Very low | 189 Ų | 189 | 148.1 Ų | 148.1 | 82% | 0.822 | 85% | 0.846 | S | S | * | * | P | Polyproline II helix | trans | -100.6 | 120 | 172 | -34.1 | 179.9 | -165.5 | 175.9 | 0 | 107.7 | ||
| 6 | N | 52.7 | Low | 48.9 | Very low | 153 Ų | 153 | 150 Ų | 150 | 82% | 0.818 | 85% | 0.845 | S | S | * | * | P | Polyproline II helix | trans | -73.4 | 132.1 | 174.7 | 52.5 | -7.5 | 0 | 0 | 0 | 110.3 | ||
| 7 | V | 53.4 | Low | 48.6 | Very low | 139 Ų | 139 | 151 Ų | 151 | 84% | 0.842 | 85% | 0.848 | S | S | * | * | trans | -112.7 | 63.6 | -177.6 | -158.7 | 0 | 0 | 0 | 0 | 109.4 | ||||
| 8 | L | 52.2 | Low | 48.6 | Very low | 172 Ų | 172 | 147.4 Ų | 147.4 | 90% | 0.901 | 84% | 0.835 | S | S | * | * | trans | -140.3 | 72.4 | 177.4 | -78.3 | 174.1 | 0 | 0 | 0 | 110.4 | ||||
| 9 | S | 52.6 | Low | 48.3 | Very low | 113 Ų | 113 | 149 Ų | 149 | 79% | 0.79 | 83% | 0.834 | S | S | * | * | trans | -164.6 | 86.2 | 169.1 | 162.5 | 0 | 0 | 0 | 0 | 109.1 | ||||
| 10 | S | 53.5 | Low | 48.1 | Very low | 127 Ų | 127 | 147.3 Ų | 147.3 | 89% | 0.888 | 83% | 0.83 | S | S | * | * | trans | -172.7 | 67.7 | 152.9 | -86.1 | 0 | 0 | 0 | 0 | 108.9 | ||||
| 11 | L | 44.1 | Very low | 47.6 | Very low | 170 Ų | 170 | 149 Ų | 149 | 89% | 0.89 | 83% | 0.831 | S | S | * | * | trans | -111.2 | 90.7 | 161.7 | -175.1 | 67.2 | 0 | 0 | 0 | 106 | ||||
| 12 | A | 50.5 | Low | 47.8 | Very low | 90 Ų | 90 | 143 Ų | 143 | 74% | 0.744 | 81% | 0.813 | S | S | * | * | trans | -85.1 | 122.1 | 175 | 0 | 0 | 0 | 0 | 0 | 108.9 | ||||
| 13 | V | 45.1 | Very low | 47.8 | Very low | 125 Ų | 125 | 145 Ų | 145 | 76% | 0.758 | 81% | 0.81 | S | S | * | * | trans | -71.9 | 118.2 | 173.7 | 172.9 | 0 | 0 | 0 | 0 | 108 | A15 | V13-A15 HydrophobicContact CG1-CB 4.26Å; V13-A15 PolarHBondContact O-N 3.26Å | ||
| 14 | Y | 42.1 | Very low | 47.2 | Very low | 241 Ų | 241 | 145.6 Ų | 145.6 | 95% | 0.945 | 82% | 0.816 | S | S | * | * | trans | -88.5 | 97 | 163.7 | -104.1 | -97.2 | 0 | 0 | 0 | 107.5 | ||||
| 15 | A | 43.5 | Very low | 46.5 | Very low | 71 Ų | 71 | 144.7 Ų | 144.7 | 59% | 0.587 | 82% | 0.815 | S | S | * | * | trans | -96.6 | 134.5 | 166.2 | 0 | 0 | 0 | 0 | 0 | 108.7 | V13 | V13-A15 HydrophobicContact CG1-CB 4.26Å; V13-A15 PolarHBondContact O-N 3.26Å | ||
| 16 | E | 46.4 | Very low | 45.4 | Very low | 178 Ų | 178 | 140.6 Ų | 140.6 | 83% | 0.832 | 82% | 0.816 | S | S | * | * | trans | 21.4 | 110.1 | 153.9 | -70 | 175.4 | 111.1 | 0 | 0 | 118.1 | ||||
| 17 | D | 42.8 | Very low | 44.5 | Very low | 167 Ų | 167 | 136.4 Ų | 136.4 | 89% | 0.893 | 81% | 0.81 | S | S | * | * | trans | -133.9 | 98.1 | 148.2 | -156.5 | 24.2 | 0 | 0 | 0 | 108.3 | ||||
| 18 | S | 48.3 | Very low | 43.8 | Very low | 87 Ų | 87 | 138.1 Ų | 138.1 | 61% | 0.608 | 81% | 0.812 | S | S | * | * | trans | -73.8 | 130.5 | 170.2 | -56 | 0 | 0 | 0 | 0 | 108.5 | ||||
| 19 | E | 42.9 | Very low | 43 | Very low | 177 Ų | 177 | 138.8 Ų | 138.8 | 83% | 0.827 | 81% | 0.811 | S | S | * | * | 151 | 174.2 | 103.5 | -72.1 | -144.4 | 157 | 0 | 0 | 107.5 | |||||
| 20 | P | 44.8 | Very low | 42.3 | Very low | 115 Ų | 115 | 138.3 Ų | 138.3 | 75% | 0.747 | 81% | 0.814 | S | S | * | * | cis | -125 | 167.7 | -18 | 24.3 | -2.9 | 0 | 0 | 0 | 114.1 | ||||
| 21 | E | 37.4 | Very low | 41.3 | Very low | 182 Ų | 182 | 139.4 Ų | 139.4 | 85% | 0.85 | 82% | 0.815 | S | S | * | * | trans | -58 | 141.3 | 168.1 | -64.7 | -176.1 | 123.1 | 0 | 0 | 112.4 | ||||
| 22 | S | 41.5 | Very low | 40.7 | Very low | 121 Ų | 121 | 134.4 Ų | 134.4 | 85% | 0.846 | 80% | 0.804 | S | S | * | * | trans | -132.5 | 94.7 | 169.2 | 179.1 | 0 | 0 | 0 | 0 | 108.4 | ||||
| 23 | D | 43.5 | Very low | 39.8 | Very low | 147 Ų | 147 | 136.1 Ų | 136.1 | 79% | 0.786 | 81% | 0.81 | S | S | * | * | trans | -66.7 | 134 | 171.2 | -67.9 | -36.9 | 0 | 0 | 0 | 110.6 | ||||
| 24 | G | 37.5 | Very low | 39.4 | Very low | 82 Ų | 82 | 135.2 Ų | 135.2 | 85% | 0.845 | 82% | 0.816 | S | S | * | * | trans | -145.9 | 74.1 | 174.9 | 0 | 0 | 0 | 0 | 0 | 110.5 | ||||
| 25 | E | 41.8 | Very low | 39.2 | Very low | 193 Ų | 193 | 128.6 Ų | 128.6 | 90% | 0.902 | 81% | 0.811 | S | S | * | * | trans | -78.6 | 123.8 | 164.4 | 68.5 | -165.3 | 158.7 | 0 | 0 | 110.1 | ||||
| 26 | A | 36.8 | Very low | 39.3 | Very low | 102 Ų | 102 | 133.8 Ų | 133.8 | 84% | 0.843 | 82% | 0.823 | S | S | * | * | trans | 176.7 | 113.2 | 154 | 0 | 0 | 0 | 0 | 0 | 105.8 | ||||
| 27 | G | 33.7 | Very low | 39.1 | Very low | 66 Ų | 66 | 134 Ų | 134 | 68% | 0.68 | 83% | 0.825 | S | S | * | * | 112.6 | 83.2 | 70.3 | 0 | 0 | 0 | 0 | 0 | 107.2 | E29 | G27-E29 PolarHBondContact O-N 3.14Š| |||
| 28 | I | 40.2 | Very low | 39.5 | Very low | 175 Ų | 175 | 135.4 Ų | 135.4 | 90% | 0.897 | 82% | 0.822 | S | S | * | * | trans | -75.4 | 107.7 | 169.1 | 32 | 160.8 | 0 | 0 | 0 | 108.7 | ||||
| 29 | E | 34.5 | Very low | 39.1 | Very low | 186 Ų | 186 | 134.1 Ų | 134.1 | 87% | 0.869 | 82% | 0.823 | S | S | * | * | trans | -148.8 | 131.3 | 160.8 | 25.4 | -151.4 | 142 | 0 | 0 | 112.1 | G27 | G27-E29 PolarHBondContact O-N 3.14Š| ||
| 30 | A | 38.5 | Very low | 38.9 | Very low | 103 Ų | 103 | 129.2 Ų | 129.2 | 85% | 0.851 | 82% | 0.82 | S | S | * | * | trans | -87.4 | 136.9 | -176.6 | 0 | 0 | 0 | 0 | 0 | 111 | ||||
| 31 | V | 32 | Very low | 38.9 | Very low | 150 Ų | 150 | 131.6 Ų | 131.6 | 91% | 0.909 | 83% | 0.826 | S | S | * | * | trans | -171.9 | 134.8 | 134.2 | 70.3 | 0 | 0 | 0 | 0 | 109.4 | ||||
| 32 | G | 32 | Very low | 39.2 | Very low | 64 Ų | 64 | 128.6 Ų | 128.6 | 66% | 0.66 | 82% | 0.819 | S | S | * | * | trans | -87 | 173.5 | -171.1 | 0 | 0 | 0 | 0 | 0 | 116.1 | ||||
| 33 | S | 31 | Very low | 39.4 | Very low | 126 Ų | 126 | 128.1 Ų | 128.1 | 88% | 0.881 | 82% | 0.816 | S | S | * | * | trans | -169.3 | 129.3 | 140.6 | -83.1 | 0 | 0 | 0 | 0 | 111.8 | ||||
| 34 | A | 37.4 | Very low | 39.3 | Very low | 107 Ų | 107 | 127.5 Ų | 127.5 | 88% | 0.884 | 81% | 0.813 | S | S | * | * | trans | 11.9 | 120.1 | 154.7 | 0 | 0 | 0 | 0 | 0 | 120.6 | ||||
| 35 | A | 36.5 | Very low | 39.5 | Very low | 101 Ų | 101 | 128 Ų | 128 | 84% | 0.835 | 81% | 0.809 | S | S | * | * | trans | -147.5 | 125.1 | 141 | 0 | 0 | 0 | 0 | 0 | 109.2 | E37 | A35-E37 PolarHBondContact O-N 3.03Š| ||
| 36 | E | 46.3 | Very low | 39.7 | Very low | 181 Ų | 181 | 129.7 Ų | 129.7 | 85% | 0.846 | 81% | 0.809 | S | S | * | * | trans | -60.2 | 125.8 | 170.7 | -74.1 | 179.8 | 101.3 | 0 | 0 | 110.5 | ||||
| 37 | E | 42.2 | Very low | 39.9 | Very low | 183 Ų | 183 | 127.6 Ų | 127.6 | 86% | 0.855 | 80% | 0.797 | S | S | * | * | trans | -138.1 | 108.6 | 153.9 | -162.5 | -174.6 | 163.6 | 0 | 0 | 108.5 | A35 G39 | A35-E37 PolarHBondContact O-N 3.03Å; E37-G39 VanDerWaalsContact C-N 3.26Å; E37-G39 PolarHBondContact O-N 2.96Å | ||
| 38 | K | 51 | Low | 40.5 | Very low | 195 Ų | 195 | 133.7 Ų | 133.7 | 85% | 0.848 | 81% | 0.807 | S | S | * | * | trans | -74.1 | 80.1 | 174.4 | -68.5 | -171.6 | 178 | -179.3 | 0 | 109.5 | G40 | K38-G40 PolarHBondContact O-N 2.97Š| ||
| 39 | G | 39 | Very low | 40.6 | Very low | 60 Ų | 60 | 132.3 Ų | 132.3 | 62% | 0.619 | 80% | 0.802 | S | S | * | * | trans | -84.9 | 98.4 | 164.1 | 0 | 0 | 0 | 0 | 0 | 109.8 | E37 L41 | E37-G39 VanDerWaalsContact C-N 3.26Å; E37-G39 PolarHBondContact O-N 2.96Å; G39-L41 PolarHBondContact O-N 2.89Å | ||
| 40 | G | 40.4 | Very low | 40.9 | Very low | 75 Ų | 75 | 128.6 Ų | 128.6 | 77% | 0.773 | 79% | 0.788 | S | S | * | * | trans | -63.1 | 111.2 | 179.9 | 0 | 0 | 0 | 0 | 0 | 112.3 | K38 V42 | K38-G40 PolarHBondContact O-N 2.97Å; G40-V42 PolarHBondContact O-N 3.32Å | ||
| 41 | L | 44.6 | Very low | 40.8 | Very low | 165 Ų | 165 | 133.6 Ų | 133.6 | 86% | 0.864 | 79% | 0.791 | S | S | * | * | trans | -73.7 | 107.9 | 163.8 | -72.9 | 160.5 | 0 | 0 | 0 | 107.8 | G39 S43 | G39-L41 PolarHBondContact O-N 2.89Å; L41-S43 PolarHBondContact O-N 3.36Å | ||
| 42 | V | 42.6 | Very low | 41.6 | Very low | 118 Ų | 118 | 131.3 Ų | 131.3 | 72% | 0.715 | 78% | 0.782 | S | S | * | * | trans | -70.7 | 96.1 | 167.7 | 176.2 | 0 | 0 | 0 | 0 | 107.1 | G40 D44 | G40-V42 PolarHBondContact O-N 3.32Å; V42-D44 VanDerWaalsContact C-N 3.27Å; V42-D44 PolarHBondContact O-N 3.26Å; V42-D44 VanDerWaalsContact O-N 3.12Å | ||
| 43 | S | 45.3 | Very low | 42.5 | Very low | 111 Ų | 111 | 138.6 Ų | 138.6 | 78% | 0.776 | 79% | 0.789 | S | S | * | * | trans | -74.5 | 86.7 | 162 | -54.5 | 0 | 0 | 0 | 0 | 107.6 | L41 A45 | L41-S43 PolarHBondContact O-N 3.36Å; S43-A45 VanDerWaalsContact C-N 3.34Å; S43-A45 PolarHBondContact O-N 2.76Å | ||
| 44 | D | 41.2 | Very low | 43.2 | Very low | 135 Ų | 135 | 140.7 Ų | 140.7 | 72% | 0.722 | 79% | 0.789 | S | S | * | * | trans | -68.6 | 102.5 | 160.1 | -87.5 | -43.2 | 0 | 0 | 0 | 106.9 | V42 Y46 | V42-D44 VanDerWaalsContact C-N 3.27Å; V42-D44 PolarHBondContact O-N 3.26Å; V42-D44 VanDerWaalsContact O-N 3.12Å; D44-Y46 PolarHBondContact O-N 3.41Å | ||
| 45 | A | 43.3 | Very low | 43.3 | Very low | 91 Ų | 91 | 139 Ų | 139 | 75% | 0.752 | 78% | 0.783 | S | S | * | * | trans | -56.8 | 116.4 | 166.3 | 0 | 0 | 0 | 0 | 0 | 107.7 | S43 G47 | S43-A45 VanDerWaalsContact C-N 3.34Å; S43-A45 PolarHBondContact O-N 2.76Å; A45-G47 PolarHBondContact O-N 3.04Å | ||
| 46 | Y | 44.3 | Very low | 43.9 | Very low | 230 Ų | 230 | 137.5 Ų | 137.5 | 90% | 0.902 | 78% | 0.777 | S | S | * | * | trans | -57.4 | 108.1 | 162.3 | -82.7 | -96.4 | 0 | 0 | 0 | 106.5 | D44 E48 | D44-Y46 PolarHBondContact O-N 3.41Å; Y46-E48 PolarHBondContact O-N 3.02Å | ||
| 47 | G | 42.4 | Very low | 43.6 | Very low | 57 Ų | 57 | 136.2 Ų | 136.2 | 59% | 0.588 | 78% | 0.776 | S | S | * | * | trans | -51.7 | 130.4 | 175.5 | 0 | 0 | 0 | 0 | 0 | 109.5 | A45 D49 | A45-G47 PolarHBondContact O-N 3.04Å; G47-D49 PolarHBondContact O-N 3.48Å | ||
| 48 | E | 46.1 | Very low | 44.1 | Very low | 195 Ų | 195 | 137.3 Ų | 137.3 | 91% | 0.911 | 78% | 0.781 | S | S | * | * | trans | -59.3 | 83 | 157.2 | -74.3 | 178.8 | 96.5 | 0 | 0 | 108.1 | Y46 D50 | Y46-E48 PolarHBondContact O-N 3.02Å; E48-D50 VanDerWaalsContact C-N 3.26Å; E48-D50 PolarHBondContact O-N 3.4Å; E48-D50 VanDerWaalsContact O-N 3.1Å | ||
| 49 | D | 41.1 | Very low | 43.5 | Very low | 146 Ų | 146 | 134.9 Ų | 134.9 | 78% | 0.781 | 78% | 0.777 | S | S | * | * | trans | -77.4 | 92.5 | 159.8 | -73.9 | -47.8 | 0 | 0 | 0 | 106.9 | G47 F51 | G47-D49 PolarHBondContact O-N 3.48Å; D49-F51 PolarHBondContact O-N 3.35Å | ||
| 50 | D | 42 | Very low | 43.7 | Very low | 108 Ų | 108 | 135.4 Ų | 135.4 | 58% | 0.578 | 78% | 0.782 | S | S | * | * | trans | -36.6 | 92 | 165.4 | -177.6 | 23.5 | 0 | 0 | 0 | 112.1 | E48 S52 | E48-D50 VanDerWaalsContact C-N 3.26Å; E48-D50 PolarHBondContact O-N 3.4Å; E48-D50 VanDerWaalsContact O-N 3.1Å; D50-S52 PolarHBondContact O-N 3.4Å; D50-S52 WeakPolarHBondContact OD1-CB 3.37Å; D50-S52 PolarHBondContact OD1-N 3.11Å; D50-S52 PolarHBondContact OD1-OG 3.26Å | ||
| 51 | F | 36.1 | Very low | 43.6 | Very low | 208 Ų | 208 | 142 Ų | 142 | 91% | 0.912 | 79% | 0.785 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -75.4 | 5.4 | 171 | -114 | -89.7 | 0 | 0 | 0 | 112.6 | D49 | D49-F51 PolarHBondContact O-N 3.35Š|
| 52 | S | 47.9 | Very low | 43.6 | Very low | 102 Ų | 102 | 142.1 Ų | 142.1 | 71% | 0.713 | 78% | 0.781 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -93 | 5.3 | -167 | -14.6 | 0 | 0 | 0 | 0 | 114.8 | D50 | D50-S52 PolarHBondContact O-N 3.4Å; D50-S52 WeakPolarHBondContact OD1-CB 3.37Å; D50-S52 PolarHBondContact OD1-N 3.11Å; D50-S52 PolarHBondContact OD1-OG 3.26Å |
| 53 | R | 51.1 | Low | 43.5 | Very low | 217 Ų | 217 | 144.7 Ų | 144.7 | 82% | 0.819 | 79% | 0.786 | S | S | * | * | trans | -114.2 | 55.1 | -174.7 | -154.2 | 177.5 | -176.3 | 165.9 | 1.9 | 114.6 | ||||
| 54 | L | 45.7 | Very low | 43.3 | Very low | 169 Ų | 169 | 147.2 Ų | 147.2 | 89% | 0.885 | 79% | 0.785 | S | S | * | * | trans | -121.3 | 95.3 | 146.4 | -65.6 | 174.7 | 0 | 0 | 0 | 104.1 | ||||
| 55 | G | 40.5 | Very low | 43.5 | Very low | 72 Ų | 72 | 149 Ų | 149 | 74% | 0.742 | 79% | 0.789 | S | S | * | * | 72.7 | 81.1 | 73.5 | 0 | 0 | 0 | 0 | 0 | 106.1 | |||||
| 56 | G | 48.5 | Very low | 43.2 | Very low | 69 Ų | 69 | 152 Ų | 152 | 71% | 0.711 | 79% | 0.793 | S | S | * | * | trans | -61.2 | 145.8 | -169.4 | 0 | 0 | 0 | 0 | 0 | 113 | ||||
| 57 | D | 39.7 | Very low | 43.4 | Very low | 155 Ų | 155 | 148.9 Ų | 148.9 | 83% | 0.829 | 79% | 0.786 | S | S | * | * | trans | -136.2 | 115.8 | 143.5 | -76.5 | -48.2 | 0 | 0 | 0 | 105.6 | D59 | D57-D59 PolarHBondContact O-N 3.05Š| ||
| 58 | E | 54.1 | Low | 43.2 | Very low | 205 Ų | 205 | 151.9 Ų | 151.9 | 96% | 0.958 | 79% | 0.789 | S | S | * | * | trans | -82 | 97.2 | 172.7 | 177.8 | -177.5 | 145.5 | 0 | 0 | 106.1 | ||||
| 59 | D | 37.6 | Very low | 43.3 | Very low | 145 Ų | 145 | 147.9 Ų | 147.9 | 78% | 0.775 | 78% | 0.783 | S | S | * | * | trans | -106.9 | 110.7 | 168.3 | 58.7 | -24 | 0 | 0 | 0 | 110.2 | D57 Y61 | D57-D59 PolarHBondContact O-N 3.05Å; D59-Y61 PolarHBondContact O-N 3.28Å | ||
| 60 | G | 42.3 | Very low | 43.6 | Very low | 70 Ų | 70 | 151 Ų | 151 | 72% | 0.722 | 78% | 0.784 | S | S | * | * | trans | -60.2 | 126 | 177.1 | 0 | 0 | 0 | 0 | 0 | 111.4 | E62 | G60-E62 PolarHBondContact O-N 2.92Š| ||
| 61 | Y | 39.1 | Very low | 43.9 | Very low | 214 Ų | 214 | 154.5 Ų | 154.5 | 84% | 0.839 | 80% | 0.797 | S | S | * | * | trans | -76.2 | 106.1 | 167.2 | 53.9 | -82.8 | 0 | 0 | 0 | 107.9 | D59 | D59-Y61 PolarHBondContact O-N 3.28Š| ||
| 62 | E | 45 | Very low | 44.2 | Very low | 167 Ų | 167 | 149.5 Ų | 149.5 | 78% | 0.78 | 79% | 0.787 | S | S | * | * | trans | -89.1 | 113.4 | 161.5 | -71.1 | -89.6 | 174.1 | 0 | 0 | 106.4 | G60 E64 | G60-E62 PolarHBondContact O-N 2.92Å; E62-E64 PolarHBondContact O-N 3.22Å | ||
| 63 | E | 40.7 | Very low | 43.8 | Very low | 172 Ų | 172 | 151.1 Ų | 151.1 | 80% | 0.804 | 79% | 0.788 | S | S | * | * | trans | -73.7 | 105.2 | 166.6 | -87.3 | -179.4 | 156.2 | 0 | 0 | 108.1 | ||||
| 64 | E | 40.8 | Very low | 43.6 | Very low | 164 Ų | 164 | 146 Ų | 146 | 77% | 0.766 | 78% | 0.777 | S | S | * | * | trans | -93.9 | 107.8 | 164.4 | -66.8 | -73.1 | -172.5 | 0 | 0 | 108.2 | E62 D66 | E62-E64 PolarHBondContact O-N 3.22Å; E64-D66 PolarHBondContact O-N 2.84Å; E64-D66 VanDerWaalsContact O-N 3.14Å | ||
| 65 | E | 44.2 | Very low | 43.6 | Very low | 172 Ų | 172 | 142.6 Ų | 142.6 | 80% | 0.804 | 76% | 0.763 | S | S | * | * | trans | -69.5 | 97.9 | 171.5 | -72.4 | -178.3 | 154.9 | 0 | 0 | 109.6 | E67 | E65-E67 PolarHBondContact O-N 3.45Š| ||
| 66 | D | 37.8 | Very low | 44.1 | Very low | 156 Ų | 156 | 145 Ų | 145 | 83% | 0.834 | 76% | 0.755 | S | S | * | * | trans | -87.4 | 92.2 | 176.6 | -130.1 | -30.4 | 0 | 0 | 0 | 110.6 | E64 N68 | E64-D66 PolarHBondContact O-N 2.84Å; E64-D66 VanDerWaalsContact O-N 3.14Å; D66-N68 PolarHBondContact O-N 2.81Å | ||
| 67 | E | 49.8 | Very low | 44.2 | Very low | 163 Ų | 163 | 144.2 Ų | 144.2 | 76% | 0.762 | 74% | 0.742 | S | S | * | * | trans | -63.5 | 90.3 | 167.9 | -75.7 | -82.9 | 173.6 | 0 | 0 | 110.7 | E65 | E65-E67 PolarHBondContact O-N 3.45Š| ||
| 68 | N | 37.1 | Very low | 44.8 | Very low | 120 Ų | 120 | 145.5 Ų | 145.5 | 64% | 0.642 | 74% | 0.743 | S | S | * | * | trans | -121.5 | 72.7 | 168.2 | -163.4 | 7.7 | 0 | 0 | 0 | 111.9 | D66 R70 | D66-N68 PolarHBondContact O-N 2.81Å; N68-R70 VanDerWaalsContact C-N 3.31Å; N68-R70 PolarHBondContact O-N 3.09Å | ||
| 69 | S | 49.3 | Very low | 45 | Very low | 112 Ų | 112 | 143.6 Ų | 143.6 | 78% | 0.783 | 73% | 0.731 | S | S | * | * | trans | -64.4 | 88.1 | 160.7 | -75.2 | 0 | 0 | 0 | 0 | 110.5 | ||||
| 70 | R | 45.7 | Very low | 46.1 | Very low | 211 Ų | 211 | 142.5 Ų | 142.5 | 80% | 0.796 | 72% | 0.716 | S | S | * | * | trans | -114.2 | 91.9 | 158.1 | -82.2 | -175.5 | 172.1 | 176.8 | 0.1 | 109.6 | N68 S72 | N68-R70 VanDerWaalsContact C-N 3.31Å; N68-R70 PolarHBondContact O-N 3.09Å; R70-S72 PolarHBondContact O-N 2.84Å | ||
| 71 | Q | 50.1 | Low | 47.8 | Very low | 182 Ų | 182 | 143 Ų | 143 | 85% | 0.85 | 70% | 0.703 | S | S | * | * | trans | -42.6 | 101.5 | 167.5 | -168.6 | 160.5 | -16.8 | 0 | 0 | 110.9 | ||||
| 72 | S | 41.4 | Very low | 49.7 | Very low | 102 Ų | 102 | 137 Ų | 137 | 71% | 0.713 | 69% | 0.689 | S | S | * | * | trans | -107.5 | 112.2 | 159.3 | 62.9 | 0 | 0 | 0 | 0 | 106.2 | R70 N74 | R70-S72 PolarHBondContact O-N 2.84Å; S72-N74 PolarHBondContact O-N 3.27Å | ||
| 73 | D | 40 | Very low | 51.1 | Low | 136 Ų | 136 | 132.9 Ų | 132.9 | 73% | 0.727 | 67% | 0.67 | S | S | * | * | trans | -59.9 | 96.7 | 174 | -93.5 | -53.2 | 0 | 0 | 0 | 109.2 | ||||
| 74 | N | 45.7 | Very low | 53 | Low | 111 Ų | 111 | 129.9 Ų | 129.9 | 59% | 0.594 | 66% | 0.656 | S | S | * | * | trans | -143.2 | 44 | 168.5 | -138.9 | -2 | 0 | 0 | 0 | 110.6 | S72 E76 A77 | S72-N74 PolarHBondContact O-N 3.27Å; N74-E76 PolarHBondContact O-N 3.13Å; N74-A77 PolarHBondContact O-N 2.94Å | ||
| 75 | T | 46.4 | Very low | 54.9 | Low | 96 Ų | 96 | 126 Ų | 126 | 59% | 0.589 | 64% | 0.64 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -71.9 | 3.9 | -171.9 | -31 | 0 | 0 | 0 | 0 | 114.6 | ||
| 76 | E | 49.9 | Very low | 56.6 | Low | 123 Ų | 123 | 121.2 Ų | 121.2 | 58% | 0.575 | 62% | 0.623 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -112.7 | -9.3 | 179.6 | -92.3 | -69.6 | 124.8 | 0 | 0 | 114.3 | N74 R80 | N74-E76 PolarHBondContact O-N 3.13Å; E76-R80 IonicContact OE2-CZ 3.78Å; E76-R80 IonicContact OE2-NH2 3.66Å; E76-R80 PolarHBondContact OE2-NH2 3.24Å |
| 77 | A | 52.2 | Low | 58.8 | Low | 52 Ų | 52 | 114.4 Ų | 114.4 | 43% | 0.43 | 59% | 0.588 | S | S | . | * | T | Hydrogen-bonded Turn | trans | -91.6 | -22.3 | -179.9 | 0 | 0 | 0 | 0 | 0 | 113.2 | N74 K79 | N74-A77 PolarHBondContact O-N 2.94Å; A77-K79 VanDerWaalsContact C-N 3.33Å; A77-K79 PolarHBondContact O-N 3.03Å |
| 78 | E | 51.8 | Low | 60.2 | Low | 182 Ų | 182 | 109.9 Ų | 109.9 | 85% | 0.85 | 57% | 0.574 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -83.1 | -3.4 | -175.7 | -68.8 | -167.7 | 147.7 | 0 | 0 | 114.6 | ||
| 79 | K | 57.2 | Low | 62.4 | Low | 166 Ų | 166 | 110.6 Ų | 110.6 | 72% | 0.722 | 57% | 0.572 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -113.8 | -5.3 | -175.7 | -62.2 | -179.9 | -174.3 | 173.6 | 0 | 114.9 | A77 | A77-K79 VanDerWaalsContact C-N 3.33Å; A77-K79 PolarHBondContact O-N 3.03Å |
| 80 | R | 61.7 | Low | 63.9 | Low | 121 Ų | 121 | 106.9 Ų | 106.9 | 46% | 0.457 | 55% | 0.546 | S | S | . | . | S | Bend | trans | -83.9 | 134 | -178.8 | -65.4 | -90.4 | 175 | 76.4 | 15 | 108.8 | E76 L85 | E76-R80 IonicContact OE2-CZ 3.78Å; E76-R80 IonicContact OE2-NH2 3.66Å; E76-R80 PolarHBondContact OE2-NH2 3.24Å; R80-L85 HydrophobicContact CB-CD1 4.33Å; R80-L85 HydrophobicContact CB-CD2 3.83Å; R80-L85 HydrophobicContact CB-CG 3.94Å; R80-L85 HydrophobicContact CG-CD2 4.28Å |
| 81 | D | 78.4 | Confident | 65.7 | Low | 82 Ų | 82 | 101.6 Ų | 101.6 | 44% | 0.439 | 53% | 0.53 | S | S | . | . | trans | -58 | 131.6 | 174.3 | 179.2 | 77.3 | 0 | 0 | 0 | 109.5 | Q83 E84 L85 | D81-Q83 PolarHBondContact O-N 3.22Å; D81-Q83 VanDerWaalsContact O-N 3.07Å; D81-Q83 PolarHBondContact OD1-OE1 3.46Å; D81-Q83 WeakPolarHBondContact OD2-CB 3.36Å; D81-Q83 PolarHBondContact OD2-N 2.98Å; D81-Q83 VanDerWaalsContact OD2-N 3.1Å; D81-Q83 PolarHBondContact OD2-OE1 2.88Å; D81-E84 HydrophobicContact CB-CB 4.45Å; D81-E84 HydrophobicContact CB-CG 4.16Å; D81-E84 WeakPolarHBondContact O-CB 3.21Å; D81-E84 PolarHBondContact O-N 3.34Å; D81-L85 PolarHBondContact O-N 3.46Å | ||
| 82 | P | 78.5 | Confident | 67.3 | Low | 86 Ų | 86 | 101.9 Ų | 101.9 | 56% | 0.558 | 52% | 0.524 | S | S | * | . | H | α-helix | trans | -53.6 | -31.5 | -177.5 | -29.1 | 35.9 | 0 | 0 | 0 | 113.6 | L85 V86 | P82-L85 PolarHBondContact O-N 3.22Å; P82-V86 WeakPolarHBondContact O-CG2 3.18Å; P82-V86 PolarHBondContact O-N 3.44Å; P82-V86 VanDerWaalsContact O-N 3.15Å |
| 83 | Q | 75.6 | Confident | 69.2 | Low | 82 Ų | 82 | 99.5 Ų | 99.5 | 38% | 0.383 | 51% | 0.505 | S | S | . | . | H | α-helix | trans | -74.2 | -32.5 | 179.7 | -65.6 | 73.6 | -10.3 | 0 | 0 | 111.6 | D81 L85 V86 A87 K167 | D81-Q83 PolarHBondContact O-N 3.22Å; D81-Q83 VanDerWaalsContact O-N 3.07Å; D81-Q83 PolarHBondContact OD1-OE1 3.46Å; D81-Q83 WeakPolarHBondContact OD2-CB 3.36Å; D81-Q83 PolarHBondContact OD2-N 2.98Å; D81-Q83 VanDerWaalsContact OD2-N 3.1Å; D81-Q83 PolarHBondContact OD2-OE1 2.88Å; Q83-L85 VanDerWaalsContact C-N 3.34Å; Q83-V86 PolarHBondContact O-N 3.07Å; Q83-A87 WeakPolarHBondContact O-CB 3.37Å; Q83-A87 PolarHBondContact O-N 2.84Å; Q83-K167 HydrophobicContact CG-CD 4.47Å |
| 84 | E | 78.9 | Confident | 71 | Confident | 109 Ų | 109 | 99.5 Ų | 99.5 | 51% | 0.509 | 49% | 0.494 | S | S | . | . | H | α-helix | trans | -66.2 | -36.4 | 171.5 | -72.5 | -170.6 | 164 | 0 | 0 | 112.3 | D81 A87 S88 | D81-E84 HydrophobicContact CB-CB 4.45Å; D81-E84 HydrophobicContact CB-CG 4.16Å; D81-E84 WeakPolarHBondContact O-CB 3.21Å; D81-E84 PolarHBondContact O-N 3.34Å; E84-A87 PolarHBondContact O-N 3.4Å; E84-S88 VanDerWaalsContact O-CB 3.31Å; E84-S88 WeakPolarHBondContact O-CB 3.46Å; E84-S88 PolarHBondContact O-N 3.38Å; E84-S88 PolarHBondContact O-OG 2.87Å |
| 85 | L | 80.9 | Confident | 72.8 | Confident | 82 Ų | 82 | 100.1 Ų | 100.1 | 43% | 0.429 | 50% | 0.498 | S | S | . | . | H | α-helix | trans | -65.5 | -42.7 | 175.7 | -66.8 | 177.5 | 0 | 0 | 0 | 111.4 | R80 D81 P82 Q83 F89 | R80-L85 HydrophobicContact CB-CD1 4.33Å; R80-L85 HydrophobicContact CB-CD2 3.83Å; R80-L85 HydrophobicContact CB-CG 3.94Å; R80-L85 HydrophobicContact CG-CD2 4.28Å; D81-L85 PolarHBondContact O-N 3.46Å; P82-L85 PolarHBondContact O-N 3.22Å; Q83-L85 VanDerWaalsContact C-N 3.34Å; L85-F89 WeakPolarHBondContact O-CB 3.46Å; L85-F89 PolarHBondContact O-N 3.26Å |
| 86 | V | 81.3 | Confident | 74.4 | Confident | 71 Ų | 71 | 99.8 Ų | 99.8 | 43% | 0.43 | 49% | 0.491 | S | S | . | . | H | α-helix | trans | -63.2 | -46.5 | 174.7 | 173.7 | 0 | 0 | 0 | 0 | 110.6 | P82 Q83 S88 F89 S90 P166 | P82-V86 WeakPolarHBondContact O-CG2 3.18Å; P82-V86 PolarHBondContact O-N 3.44Å; P82-V86 VanDerWaalsContact O-N 3.15Å; Q83-V86 PolarHBondContact O-N 3.07Å; V86-S88 PolarHBondContact O-N 3.3Å; V86-F89 PolarHBondContact O-N 3.42Å; V86-S90 WeakPolarHBondContact O-CB 3.29Å; V86-S90 PolarHBondContact O-N 2.96Å; V86-S90 PolarHBondContact O-OG 3.15Å; V86-S90 VanDerWaalsContact O-OG 3.12Å; V86-P166 HydrophobicContact CG1-CB 4.41Å |
| 87 | A | 82.4 | Confident | 75.9 | Confident | 14 Ų | 14 | 96.1 Ų | 96.1 | 12% | 0.116 | 48% | 0.479 | C | S | . | . | H | α-helix | trans | -58.9 | -47.6 | 177.4 | 0 | 0 | 0 | 0 | 0 | 112.1 | Q83 E84 F89 S90 E91 P166 | Q83-A87 WeakPolarHBondContact O-CB 3.37Å; Q83-A87 PolarHBondContact O-N 2.84Å; E84-A87 PolarHBondContact O-N 3.4Å; A87-F89 VanDerWaalsContact C-N 3.33Å; A87-F89 PolarHBondContact O-N 3.47Å; A87-S90 PolarHBondContact O-N 3.27Å; A87-E91 WeakPolarHBondContact O-CB 3.29Å; A87-E91 PolarHBondContact O-N 3.38Å; A87-P166 HydrophobicContact CB-CB 3.81Å; A87-P166 HydrophobicContact CB-CG 4.46Å |
| 88 | S | 80.6 | Confident | 77 | Confident | 67 Ų | 67 | 98.8 Ų | 98.8 | 47% | 0.469 | 49% | 0.492 | S | S | . | . | H | α-helix | trans | -61.3 | -40 | 178.5 | -59.6 | 0 | 0 | 0 | 0 | 112.3 | E84 V86 R92 | E84-S88 VanDerWaalsContact O-CB 3.31Å; E84-S88 WeakPolarHBondContact O-CB 3.46Å; E84-S88 PolarHBondContact O-N 3.38Å; E84-S88 PolarHBondContact O-OG 2.87Å; V86-S88 PolarHBondContact O-N 3.3Å; S88-R92 WeakPolarHBondContact O-CB 3.3Å; S88-R92 PolarHBondContact O-N 3.08Å |
| 89 | F | 81.9 | Confident | 78.3 | Confident | 136 Ų | 136 | 97.3 Ų | 97.3 | 60% | 0.596 | 49% | 0.489 | S | S | * | . | H | α-helix | trans | -67.8 | -48.5 | 176.1 | 176.5 | -100.9 | 0 | 0 | 0 | 111.3 | L85 V86 A87 E91 R92 V93 | L85-F89 WeakPolarHBondContact O-CB 3.46Å; L85-F89 PolarHBondContact O-N 3.26Å; V86-F89 PolarHBondContact O-N 3.42Å; A87-F89 VanDerWaalsContact C-N 3.33Å; A87-F89 PolarHBondContact O-N 3.47Å; F89-E91 VanDerWaalsContact C-N 3.3Å; F89-E91 PolarHBondContact O-N 2.97Å; F89-R92 PolarHBondContact O-N 2.76Å; F89-V93 HydrophobicContact CD1-CG2 4.2Å; F89-V93 HydrophobicContact CD2-CG2 4.32Å; F89-V93 HydrophobicContact CE1-CG2 3.74Å; F89-V93 HydrophobicContact CE2-CG2 3.87Å; F89-V93 HydrophobicContact CG-CG2 4.47Å; F89-V93 HydrophobicContact CZ-CG2 3.57Å; F89-V93 WeakPolarHBondContact O-CG2 3.41Å; F89-V93 PolarHBondContact O-N 2.9Å |
| 90 | S | 82.4 | Confident | 79.3 | Confident | 33 Ų | 33 | 94.4 Ų | 94.4 | 23% | 0.231 | 48% | 0.478 | C | S | . | . | H | α-helix | trans | -60.5 | -38.6 | 177.4 | -66.3 | 0 | 0 | 0 | 0 | 112.1 | V86 A87 R94 | V86-S90 WeakPolarHBondContact O-CB 3.29Å; V86-S90 PolarHBondContact O-N 2.96Å; V86-S90 PolarHBondContact O-OG 3.15Å; V86-S90 VanDerWaalsContact O-OG 3.12Å; A87-S90 PolarHBondContact O-N 3.27Å; S90-R94 WeakPolarHBondContact O-CB 3.48Å; S90-R94 WeakPolarHBondContact O-CG 3.32Å; S90-R94 PolarHBondContact O-N 3.44Å; S90-R94 PolarHBondContact O-NE 2.76Å |
| 91 | E | 82.9 | Confident | 80.1 | Confident | 101 Ų | 101 | 93.4 Ų | 93.4 | 47% | 0.472 | 48% | 0.481 | S | S | . | . | H | α-helix | trans | -63.3 | -47.5 | 172.7 | -173.5 | 176.5 | -169.3 | 0 | 0 | 111.9 | A87 F89 V93 R94 N95 | A87-E91 WeakPolarHBondContact O-CB 3.29Å; A87-E91 PolarHBondContact O-N 3.38Å; F89-E91 VanDerWaalsContact C-N 3.3Å; F89-E91 PolarHBondContact O-N 2.97Å; E91-V93 VanDerWaalsContact C-N 3.35Å; E91-V93 PolarHBondContact O-N 3.07Å; E91-R94 PolarHBondContact O-N 3.24Å; E91-N95 PolarHBondContact O-N 2.98Å; E91-N95 VanDerWaalsContact O-N 3.12Å; E91-N95 PolarHBondContact O-ND2 3.41Å; E91-N95 VanDerWaalsContact O-ND2 3.14Å |
| 92 | R | 82.6 | Confident | 80.1 | Confident | 188 Ų | 188 | 97.8 Ų | 97.8 | 71% | 0.709 | 50% | 0.496 | S | S | * | . | H | α-helix | trans | -58.6 | -45.4 | 176.2 | -178.6 | 174.3 | -68.4 | -176.5 | -0.5 | 112 | S88 F89 N95 M96 | S88-R92 WeakPolarHBondContact O-CB 3.3Å; S88-R92 PolarHBondContact O-N 3.08Å; F89-R92 PolarHBondContact O-N 2.76Å; R92-N95 PolarHBondContact O-N 3.15Å; R92-M96 WeakPolarHBondContact O-CG 3.47Å; R92-M96 PolarHBondContact O-N 3.41Å |
| 93 | V | 81.4 | Confident | 80.2 | Confident | 52 Ų | 52 | 101.2 Ų | 101.2 | 32% | 0.315 | 51% | 0.509 | S | S | . | . | H | α-helix | trans | -65 | -39.8 | 179.7 | 173.6 | 0 | 0 | 0 | 0 | 111.5 | F89 E91 N95 M96 I101 | F89-V93 HydrophobicContact CD1-CG2 4.2Å; F89-V93 HydrophobicContact CD2-CG2 4.32Å; F89-V93 HydrophobicContact CE1-CG2 3.74Å; F89-V93 HydrophobicContact CE2-CG2 3.87Å; F89-V93 HydrophobicContact CG-CG2 4.47Å; F89-V93 HydrophobicContact CZ-CG2 3.57Å; F89-V93 WeakPolarHBondContact O-CG2 3.41Å; F89-V93 PolarHBondContact O-N 2.9Å; E91-V93 VanDerWaalsContact C-N 3.35Å; E91-V93 PolarHBondContact O-N 3.07Å; V93-N95 PolarHBondContact O-N 2.89Å; V93-M96 PolarHBondContact O-N 3Å; V93-I101 HydrophobicContact CG1-CD1 4.28Å |
| 94 | R | 79.4 | Confident | 80.3 | Confident | 135 Ų | 135 | 102.3 Ų | 102.3 | 51% | 0.509 | 52% | 0.522 | S | S | . | . | H | α-helix | trans | -64 | -28.8 | 176.5 | -75.7 | -178.5 | -64.7 | 170.8 | 0.8 | 113.3 | S90 E91 M169 | S90-R94 WeakPolarHBondContact O-CB 3.48Å; S90-R94 WeakPolarHBondContact O-CG 3.32Å; S90-R94 PolarHBondContact O-N 3.44Å; S90-R94 PolarHBondContact O-NE 2.76Å; E91-R94 PolarHBondContact O-N 3.24Å; R94-M169 PolarHBondContact NH1-SD 3.17Å; R94-M169 VanDerWaalsContact NH1-SD 3.44Å |
| 95 | N | 82.7 | Confident | 80.1 | Confident | 124 Ų | 124 | 102.8 Ų | 102.8 | 66% | 0.663 | 54% | 0.535 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -89.8 | -3.9 | -178.2 | -64.6 | -24.5 | 0 | 0 | 0 | 113.5 | E91 R92 V93 | E91-N95 PolarHBondContact O-N 2.98Å; E91-N95 VanDerWaalsContact O-N 3.12Å; E91-N95 PolarHBondContact O-ND2 3.41Å; E91-N95 VanDerWaalsContact O-ND2 3.14Å; R92-N95 PolarHBondContact O-N 3.15Å; V93-N95 PolarHBondContact O-N 2.89Å |
| 96 | M | 80.8 | Confident | 79.7 | Confident | 89 Ų | 89 | 107.6 Ų | 107.6 | 44% | 0.438 | 56% | 0.555 | S | S | . | * | S | Bend | trans | -93.4 | 151.4 | 177.1 | -68 | -78.2 | -83.1 | 0 | 0 | 110.6 | R92 V93 E100 | R92-M96 WeakPolarHBondContact O-CG 3.47Å; R92-M96 PolarHBondContact O-N 3.41Å; V93-M96 PolarHBondContact O-N 3Å; M96-E100 HydrophobicContact CE-CB 3.7Å |
| 97 | S | 79.8 | Confident | 79.5 | Confident | 47 Ų | 47 | 109.7 Ų | 109.7 | 33% | 0.329 | 57% | 0.57 | S | S | . | * | trans | -72.4 | 150.2 | 172.2 | 65.4 | 0 | 0 | 0 | 0 | 110.7 | D99 E100 | S97-D99 PolarHBondContact O-N 3.29Å; S97-D99 VanDerWaalsContact O-N 3.07Å; S97-E100 PolarHBondContact N-OE2 3.39Å; S97-E100 VanDerWaalsContact N-OE2 3.12Å; S97-E100 PolarHBondContact O-N 3.03Å; S97-E100 VanDerWaalsContact OG-CG 3.26Å; S97-E100 WeakPolarHBondContact OG-CG 3.26Å; S97-E100 PolarHBondContact OG-OE2 2.87Å | ||
| 98 | P | 76.3 | Confident | 78.8 | Confident | 108 Ų | 108 | 115.6 Ų | 115.6 | 70% | 0.701 | 61% | 0.608 | S | S | * | * | G | 310 helix | trans | -54.9 | -30.6 | -178.8 | -26.6 | 34.6 | 0 | 0 | 0 | 114.1 | E100 I101 | P98-E100 VanDerWaalsContact C-N 3.3Å; P98-E100 PolarHBondContact O-N 3.46Å; P98-I101 PolarHBondContact O-N 3.29Å |
| 99 | D | 78.9 | Confident | 78.3 | Confident | 150 Ų | 150 | 115.5 Ų | 115.5 | 80% | 0.802 | 62% | 0.617 | S | S | * | * | G | 310 helix | trans | -75.5 | -17.7 | -179.3 | -62.9 | -29.9 | 0 | 0 | 0 | 113.3 | S97 | S97-D99 PolarHBondContact O-N 3.29Å; S97-D99 VanDerWaalsContact O-N 3.07Å |
| 100 | E | 77.1 | Confident | 77.6 | Confident | 105 Ų | 105 | 120.2 Ų | 120.2 | 49% | 0.491 | 63% | 0.631 | S | S | . | * | G | 310 helix | trans | -91.6 | -9.5 | 177.3 | -67.7 | 166.9 | 148 | 0 | 0 | 112.6 | M96 S97 P98 K102 | M96-E100 HydrophobicContact CE-CB 3.7Å; S97-E100 PolarHBondContact N-OE2 3.39Å; S97-E100 VanDerWaalsContact N-OE2 3.12Å; S97-E100 PolarHBondContact O-N 3.03Å; S97-E100 VanDerWaalsContact OG-CG 3.26Å; S97-E100 WeakPolarHBondContact OG-CG 3.26Å; S97-E100 PolarHBondContact OG-OE2 2.87Å; P98-E100 VanDerWaalsContact C-N 3.3Å; P98-E100 PolarHBondContact O-N 3.46Å; E100-K102 PolarHBondContact O-N 2.89Å; E100-K102 VanDerWaalsContact O-N 3.08Å |
| 101 | I | 79.3 | Confident | 77.1 | Confident | 101 Ų | 101 | 122.5 Ų | 122.5 | 52% | 0.518 | 65% | 0.646 | S | S | . | * | trans | -75.6 | 99 | 176.7 | -55.8 | 176 | 0 | 0 | 0 | 108.7 | V93 P98 | V93-I101 HydrophobicContact CG1-CD1 4.28Å; P98-I101 PolarHBondContact O-N 3.29Å | ||
| 102 | K | 79.4 | Confident | 77.2 | Confident | 173 Ų | 173 | 121.3 Ų | 121.3 | 75% | 0.752 | 65% | 0.649 | S | S | * | * | trans | -106.1 | 141.8 | 174.9 | -65.6 | 178.7 | -177 | 173.2 | 0 | 110.1 | E100 | E100-K102 PolarHBondContact O-N 2.89Å; E100-K102 VanDerWaalsContact O-N 3.08Å | ||
| 103 | I | 80 | Confident | 77.4 | Confident | 159 Ų | 159 | 117.8 Ų | 117.8 | 82% | 0.815 | 64% | 0.644 | S | S | * | * | P | Polyproline II helix | trans | -59.2 | 127.8 | 168.5 | -57.5 | 176.1 | 0 | 0 | 0 | 106.8 | ||
| 104 | P | 76.5 | Confident | 77.7 | Confident | 104 Ų | 104 | 121.5 Ų | 121.5 | 68% | 0.675 | 66% | 0.658 | S | S | * | * | P | Polyproline II helix | trans | -56.8 | 144.7 | 177.4 | 21 | -30.6 | 0 | 0 | 0 | 110.3 | ||
| 105 | P | 76.3 | Confident | 78.1 | Confident | 119 Ų | 119 | 119.2 Ų | 119.2 | 77% | 0.773 | 66% | 0.655 | S | S | * | * | P | Polyproline II helix | trans | -59.8 | 152.5 | 176.6 | 27.7 | -34.7 | 0 | 0 | 0 | 110.1 | ||
| 106 | E | 72.6 | Confident | 78.3 | Confident | 183 Ų | 183 | 117.1 Ų | 117.1 | 86% | 0.855 | 64% | 0.642 | S | S | * | * | P | Polyproline II helix | trans | -51.9 | 131.4 | 179.7 | -68 | -179.2 | -178.5 | 0 | 0 | 110.2 | ||
| 107 | P | 75.8 | Confident | 78.8 | Confident | 115 Ų | 115 | 117.6 Ų | 117.6 | 75% | 0.747 | 65% | 0.646 | S | S | * | * | P | Polyproline II helix | trans | -59.5 | 130 | -177.5 | 22.8 | -32 | 0 | 0 | 0 | 109.4 | G109 | P107-G109 PolarHBondContact O-N 3.39Š|
| 108 | P | 68.9 | Low | 79.3 | Confident | 138 Ų | 138 | 120.7 Ų | 120.7 | 90% | 0.896 | 65% | 0.653 | S | S | * | * | S | Bend | trans | -71.1 | 103.5 | 177.8 | 27.2 | -32.1 | 0 | 0 | 0 | 109.4 | ||
| 109 | G | 69.8 | Low | 80 | Confident | 65 Ų | 65 | 120.4 Ų | 120.4 | 67% | 0.67 | 65% | 0.645 | S | S | * | * | S | Bend | trans | 172.2 | 145 | 176.3 | 0 | 0 | 0 | 0 | 0 | 112 | P107 | P107-G109 PolarHBondContact O-N 3.39Š|
| 110 | R | 67.3 | Low | 80.5 | Confident | 235 Ų | 235 | 118.2 Ų | 118.2 | 89% | 0.887 | 63% | 0.63 | S | S | * | * | P | Polyproline II helix | trans | -75.1 | 130.7 | 165.7 | -67 | -177.3 | -179.5 | -122.3 | 0.3 | 107.3 | ||
| 111 | C | 72.1 | Confident | 81.1 | Confident | 82 Ų | 82 | 119.9 Ų | 119.9 | 55% | 0.554 | 64% | 0.636 | S | S | * | * | P | Polyproline II helix | trans | -54.8 | 155.1 | 171.5 | -58.5 | 0 | 0 | 0 | 0 | 109.9 | N113 Q116 | C111-N113 PolarHBondContact O-N 3.14Å; C111-Q116 HydrophobicContact CB-CG 3.71Å; C111-Q116 PolarHBondContact O-NE2 3.18Å |
| 112 | S | 84.3 | Confident | 81.4 | Confident | 75 Ų | 75 | 118.6 Ų | 118.6 | 52% | 0.524 | 63% | 0.629 | S | S | . | * | P | Polyproline II helix | trans | -57.1 | 132.2 | 178.1 | 73.5 | 0 | 0 | 0 | 0 | 110.7 | H114 L115 Q116 | S112-H114 VanDerWaalsContact C-N 3.26Å; S112-H114 PolarHBondContact O-N 3.41Å; S112-L115 PolarHBondContact O-N 3.35Å; S112-L115 WeakPolarHBondContact OG-CB 3.05Å; S112-Q116 PolarHBondContact O-N 3.12Å; S112-Q116 VanDerWaalsContact O-N 3.09Å |
| 113 | N | 86.5 | Confident | 81.8 | Confident | 114 Ų | 114 | 117.4 Ų | 117.4 | 61% | 0.61 | 62% | 0.621 | S | S | * | * | H | α-helix | trans | -57.4 | -41.7 | -174.4 | -66.9 | -58.7 | 0 | 0 | 0 | 111.2 | C111 L115 Q116 D117 | C111-N113 PolarHBondContact O-N 3.14Å; N113-L115 VanDerWaalsContact C-N 3.29Å; N113-L115 PolarHBondContact O-N 3.27Å; N113-Q116 PolarHBondContact O-N 3.12Å; N113-D117 VanDerWaalsContact O-CG 3.26Å; N113-D117 PolarHBondContact O-N 3.27Å |
| 114 | H | 87.5 | Confident | 82.2 | Confident | 130 Ų | 130 | 113.2 Ų | 113.2 | 60% | 0.602 | 60% | 0.598 | S | S | * | * | H | α-helix | trans | -57.6 | -37.5 | 176.6 | -177.4 | 73.4 | 0 | 0 | 0 | 113.8 | S112 K118 | S112-H114 VanDerWaalsContact C-N 3.26Å; S112-H114 PolarHBondContact O-N 3.41Å; H114-K118 WeakPolarHBondContact NE2-CE 3.01Å; H114-K118 PolarHBondContact NE2-NZ 3.03Å; H114-K118 WeakPolarHBondContact O-CB 3.41Å; H114-K118 PolarHBondContact O-N 3.19Å; H114-K118 VanDerWaalsContact O-N 3.11Å |
| 115 | L | 87.3 | Confident | 82.7 | Confident | 87 Ų | 87 | 111.9 Ų | 111.9 | 46% | 0.455 | 58% | 0.579 | S | S | . | * | H | α-helix | trans | -77.2 | -38.3 | -179.8 | -168.4 | 130.9 | 0 | 0 | 0 | 111.3 | S112 N113 K118 I119 | S112-L115 PolarHBondContact O-N 3.35Å; S112-L115 WeakPolarHBondContact OG-CB 3.05Å; N113-L115 VanDerWaalsContact C-N 3.29Å; N113-L115 PolarHBondContact O-N 3.27Å; L115-K118 PolarHBondContact O-N 3.44Å; L115-I119 HydrophobicContact CD2-CD1 3.57Å; L115-I119 HydrophobicContact CD2-CG1 4.5Å; L115-I119 HydrophobicContact CG-CD1 4.33Å; L115-I119 VanDerWaalsContact O-CG1 3.3Å; L115-I119 WeakPolarHBondContact O-CG1 3.39Å; L115-I119 PolarHBondContact O-N 3.12Å |
| 116 | Q | 88.4 | Confident | 83.2 | Confident | 81 Ų | 81 | 111.5 Ų | 111.5 | 38% | 0.379 | 57% | 0.566 | S | S | . | * | H | α-helix | trans | -59.7 | -47.5 | 172.5 | -66.4 | -173.6 | 53.7 | 0 | 0 | 111.2 | C111 S112 N113 K118 I119 Q120 | C111-Q116 HydrophobicContact CB-CG 3.71Å; C111-Q116 PolarHBondContact O-NE2 3.18Å; S112-Q116 PolarHBondContact O-N 3.12Å; S112-Q116 VanDerWaalsContact O-N 3.09Å; N113-Q116 PolarHBondContact O-N 3.12Å; Q116-K118 VanDerWaalsContact C-N 3.32Å; Q116-K118 PolarHBondContact O-N 2.93Å; Q116-I119 PolarHBondContact O-N 3.3Å; Q116-Q120 WeakPolarHBondContact O-CB 3.31Å; Q116-Q120 PolarHBondContact O-N 3.35Å |
| 117 | D | 90.8 | Very high | 83.8 | Confident | 99 Ų | 99 | 108 Ų | 108 | 53% | 0.529 | 55% | 0.552 | S | S | . | * | H | α-helix | trans | -62.4 | -39.3 | 178.3 | -67 | -25.9 | 0 | 0 | 0 | 111.9 | N113 Q120 K121 | N113-D117 VanDerWaalsContact O-CG 3.26Å; N113-D117 PolarHBondContact O-N 3.27Å; D117-Q120 PolarHBondContact O-N 3.07Å; D117-K121 WeakPolarHBondContact O-CB 3.36Å; D117-K121 PolarHBondContact O-N 3.28Å |
| 118 | K | 90.8 | Very high | 84.2 | Confident | 112 Ų | 112 | 110 Ų | 110 | 49% | 0.487 | 55% | 0.549 | S | S | . | . | H | α-helix | trans | -63.5 | -46.5 | 176.4 | -172.7 | 176 | -63.2 | 174.7 | 0 | 111.6 | H114 L115 Q116 K121 L122 | H114-K118 WeakPolarHBondContact NE2-CE 3.01Å; H114-K118 PolarHBondContact NE2-NZ 3.03Å; H114-K118 WeakPolarHBondContact O-CB 3.41Å; H114-K118 PolarHBondContact O-N 3.19Å; H114-K118 VanDerWaalsContact O-N 3.11Å; L115-K118 PolarHBondContact O-N 3.44Å; Q116-K118 VanDerWaalsContact C-N 3.32Å; Q116-K118 PolarHBondContact O-N 2.93Å; K118-K121 PolarHBondContact O-N 3.32Å; K118-L122 HydrophobicContact CG-CD1 4.45Å; K118-L122 VanDerWaalsContact O-CG 3.29Å; K118-L122 WeakPolarHBondContact O-CG 3.31Å; K118-L122 PolarHBondContact O-N 3.1Å |
| 119 | I | 90.6 | Very high | 84.6 | Confident | 101 Ų | 101 | 108.9 Ų | 108.9 | 52% | 0.518 | 53% | 0.531 | S | S | . | . | H | α-helix | trans | -63.3 | -46.8 | 177.1 | -68.7 | 169.5 | 0 | 0 | 0 | 110 | L115 Q116 K121 L122 Y123 | L115-I119 HydrophobicContact CD2-CD1 3.57Å; L115-I119 HydrophobicContact CD2-CG1 4.5Å; L115-I119 HydrophobicContact CG-CD1 4.33Å; L115-I119 VanDerWaalsContact O-CG1 3.3Å; L115-I119 WeakPolarHBondContact O-CG1 3.39Å; L115-I119 PolarHBondContact O-N 3.12Å; Q116-I119 PolarHBondContact O-N 3.3Å; I119-K121 PolarHBondContact O-N 2.91Å; I119-L122 PolarHBondContact O-N 2.91Å; I119-Y123 WeakPolarHBondContact O-CB 3.44Å; I119-Y123 PolarHBondContact O-N 3.08Å |
| 120 | Q | 90.3 | Very high | 85 | Confident | 105 Ų | 105 | 108.4 Ų | 108.4 | 49% | 0.491 | 53% | 0.526 | S | S | . | . | H | α-helix | trans | -59.5 | -47.1 | 178.2 | -179 | 172.4 | -8.8 | 0 | 0 | 111.2 | Q116 D117 L122 Y123 E124 | Q116-Q120 WeakPolarHBondContact O-CB 3.31Å; Q116-Q120 PolarHBondContact O-N 3.35Å; D117-Q120 PolarHBondContact O-N 3.07Å; Q120-L122 VanDerWaalsContact C-N 3.3Å; Q120-L122 PolarHBondContact O-N 2.83Å; Q120-Y123 PolarHBondContact O-N 3.28Å; Q120-Y123 VanDerWaalsContact O-N 3.15Å; Q120-E124 HydrophobicContact CG-CG 4.46Å; Q120-E124 PolarHBondContact NE2-OE1 3.3Å; Q120-E124 VanDerWaalsContact NE2-OE1 3.13Å; Q120-E124 WeakPolarHBondContact O-CG 3.41Å; Q120-E124 PolarHBondContact O-N 2.91Å |
| 121 | K | 89.6 | Confident | 85.1 | Confident | 140 Ų | 140 | 101.2 Ų | 101.2 | 61% | 0.609 | 50% | 0.504 | S | S | * | . | H | α-helix | trans | -60.4 | -37.6 | 177.6 | -170.1 | -178.6 | -179.3 | 172.5 | 0 | 112.4 | D117 K118 I119 R125 | D117-K121 WeakPolarHBondContact O-CB 3.36Å; D117-K121 PolarHBondContact O-N 3.28Å; K118-K121 PolarHBondContact O-N 3.32Å; I119-K121 PolarHBondContact O-N 2.91Å; K121-R125 WeakPolarHBondContact O-CB 3.41Å; K121-R125 PolarHBondContact O-N 3Å |
| 122 | L | 85.6 | Confident | 85.6 | Confident | 73 Ų | 73 | 100.1 Ų | 100.1 | 38% | 0.382 | 49% | 0.493 | S | S | . | . | H | α-helix | trans | -70.2 | -40.4 | 175.4 | -73.1 | 171.8 | 0 | 0 | 0 | 111.8 | K118 I119 Q120 R125 K126 M133 | K118-L122 HydrophobicContact CG-CD1 4.45Å; K118-L122 VanDerWaalsContact O-CG 3.29Å; K118-L122 WeakPolarHBondContact O-CG 3.31Å; K118-L122 PolarHBondContact O-N 3.1Å; I119-L122 PolarHBondContact O-N 2.91Å; Q120-L122 VanDerWaalsContact C-N 3.3Å; Q120-L122 PolarHBondContact O-N 2.83Å; L122-R125 PolarHBondContact O-N 3.25Å; L122-K126 PolarHBondContact O-N 3.4Å; L122-M133 HydrophobicContact CD2-CE 3.96Å |
| 123 | Y | 86.6 | Confident | 85.5 | Confident | 148 Ų | 148 | 101.2 Ų | 101.2 | 58% | 0.58 | 49% | 0.491 | S | S | * | . | H | α-helix | trans | -65.4 | -45.9 | 178.4 | -174.8 | -102.5 | 0 | 0 | 0 | 112 | I119 Q120 R125 K126 I127 | I119-Y123 WeakPolarHBondContact O-CB 3.44Å; I119-Y123 PolarHBondContact O-N 3.08Å; Q120-Y123 PolarHBondContact O-N 3.28Å; Q120-Y123 VanDerWaalsContact O-N 3.15Å; Y123-R125 VanDerWaalsContact C-N 3.3Å; Y123-R125 PolarHBondContact O-N 2.84Å; Y123-K126 WeakPolarHBondContact O-CB 3.44Å; Y123-K126 PolarHBondContact O-N 2.6Å; Y123-I127 HydrophobicContact CD1-CD1 3.78Å; Y123-I127 HydrophobicContact CE1-CD1 3.21Å; Y123-I127 HydrophobicContact CE1-CG1 4.37Å; Y123-I127 HydrophobicContact CE2-CD1 4.25Å; Y123-I127 HydrophobicContact CG-CD1 4.49Å; Y123-I127 VanDerWaalsContact CZ-CD1 3.49Å; Y123-I127 WeakPolarHBondContact O-CG1 3.37Å; Y123-I127 PolarHBondContact O-N 3.21Å; Y123-I127 VanDerWaalsContact O-N 3.07Å |
| 124 | E | 89.4 | Confident | 85.5 | Confident | 71 Ų | 71 | 100.2 Ų | 100.2 | 33% | 0.332 | 49% | 0.485 | S | S | . | . | H | α-helix | trans | -60.9 | -40.2 | 175.2 | -73.5 | -173.3 | -153.8 | 0 | 0 | 112.1 | Q120 I127 K128 | Q120-E124 HydrophobicContact CG-CG 4.46Å; Q120-E124 PolarHBondContact NE2-OE1 3.3Å; Q120-E124 VanDerWaalsContact NE2-OE1 3.13Å; Q120-E124 WeakPolarHBondContact O-CG 3.41Å; Q120-E124 PolarHBondContact O-N 2.91Å; E124-I127 PolarHBondContact O-N 3.1Å; E124-K128 VanDerWaalsContact O-CB 3.29Å; E124-K128 WeakPolarHBondContact O-CB 3.21Å; E124-K128 VanDerWaalsContact O-CG 3.32Å; E124-K128 WeakPolarHBondContact O-CG 3.02Å; E124-K128 PolarHBondContact O-N 3.35Å; E124-K128 IonicContact OE2-NZ 3.28Å; E124-K128 PolarHBondContact OE2-NZ 2.97Å |
| 125 | R | 85.3 | Confident | 85.4 | Confident | 76 Ų | 76 | 99.1 Ų | 99.1 | 29% | 0.287 | 48% | 0.477 | S | S | . | . | H | α-helix | trans | -64.9 | -42.3 | 176.9 | -160.1 | 179.2 | -45.1 | 148.5 | 17.4 | 112.1 | K121 L122 Y123 I127 E129 M131 | K121-R125 WeakPolarHBondContact O-CB 3.41Å; K121-R125 PolarHBondContact O-N 3Å; L122-R125 PolarHBondContact O-N 3.25Å; Y123-R125 VanDerWaalsContact C-N 3.3Å; Y123-R125 PolarHBondContact O-N 2.84Å; R125-I127 VanDerWaalsContact C-N 3.28Å; R125-I127 PolarHBondContact O-N 3.16Å; R125-E129 WeakPolarHBondContact CD-OE2 3.17Å; R125-E129 HydrophobicContact CG-CB 4.37Å; R125-E129 HydrophobicContact CG-CG 4.23Å; R125-E129 WeakPolarHBondContact CG-OE2 3.2Å; R125-E129 WeakPolarHBondContact O-CB 3.4Å; R125-E129 PolarHBondContact O-N 2.95Å; R125-M131 HydrophobicContact CG-SD 4.35Å |
| 126 | K | 87.3 | Confident | 85.4 | Confident | 111 Ų | 111 | 97.6 Ų | 97.6 | 48% | 0.483 | 47% | 0.468 | S | S | . | . | H | α-helix | trans | -57.4 | -42.7 | 174.1 | 178.6 | 179.3 | 177.6 | 174.9 | 0 | 111.5 | L122 Y123 G130 | L122-K126 PolarHBondContact O-N 3.4Å; Y123-K126 WeakPolarHBondContact O-CB 3.44Å; Y123-K126 PolarHBondContact O-N 2.6Å; K126-G130 VanDerWaalsContact O-CA 3.31Å; K126-G130 WeakPolarHBondContact O-CA 3.31Å; K126-G130 PolarHBondContact O-N 3.42Å |
| 127 | I | 85.6 | Confident | 85.3 | Confident | 111 Ų | 111 | 97.5 Ų | 97.5 | 57% | 0.569 | 47% | 0.47 | S | S | * | . | H | α-helix | trans | -74.8 | -45.8 | -179 | -67.2 | 176.4 | 0 | 0 | 0 | 112.1 | Y123 E124 R125 | Y123-I127 HydrophobicContact CD1-CD1 3.78Å; Y123-I127 HydrophobicContact CE1-CD1 3.21Å; Y123-I127 HydrophobicContact CE1-CG1 4.37Å; Y123-I127 HydrophobicContact CE2-CD1 4.25Å; Y123-I127 HydrophobicContact CG-CD1 4.49Å; Y123-I127 VanDerWaalsContact CZ-CD1 3.49Å; Y123-I127 WeakPolarHBondContact O-CG1 3.37Å; Y123-I127 PolarHBondContact O-N 3.21Å; Y123-I127 VanDerWaalsContact O-N 3.07Å; E124-I127 PolarHBondContact O-N 3.1Å; R125-I127 VanDerWaalsContact C-N 3.28Å; R125-I127 PolarHBondContact O-N 3.16Å |
| 128 | K | 84.7 | Confident | 85.1 | Confident | 156 Ų | 156 | 98.1 Ų | 98.1 | 68% | 0.678 | 47% | 0.469 | S | S | * | . | H | α-helix | trans | -77.5 | -43.7 | -173.4 | -70.8 | 170.3 | 179.1 | 166 | 0 | 112.9 | E124 | E124-K128 VanDerWaalsContact O-CB 3.29Å; E124-K128 WeakPolarHBondContact O-CB 3.21Å; E124-K128 VanDerWaalsContact O-CG 3.32Å; E124-K128 WeakPolarHBondContact O-CG 3.02Å; E124-K128 PolarHBondContact O-N 3.35Å; E124-K128 IonicContact OE2-NZ 3.28Å; E124-K128 PolarHBondContact OE2-NZ 2.97Å |
| 129 | E | 77.6 | Confident | 84.9 | Confident | 114 Ų | 114 | 100.4 Ų | 100.4 | 53% | 0.533 | 48% | 0.475 | S | S | . | . | H | α-helix | trans | -101.8 | -6.1 | -172.4 | -61.5 | 170.6 | -165.2 | 0 | 0 | 112.5 | R125 M131 | R125-E129 WeakPolarHBondContact CD-OE2 3.17Å; R125-E129 HydrophobicContact CG-CB 4.37Å; R125-E129 HydrophobicContact CG-CG 4.23Å; R125-E129 WeakPolarHBondContact CG-OE2 3.2Å; R125-E129 WeakPolarHBondContact O-CB 3.4Å; R125-E129 PolarHBondContact O-N 2.95Å; E129-M131 HydrophobicContact CB-CE 4.36Å; E129-M131 HydrophobicContact CB-CG 3.95Å; E129-M131 PolarHBondContact O-N 3.28Å; E129-M131 WeakPolarHBondContact OE2-CE 3.37Å; E129-M131 VanDerWaalsContact OE2-SD 3.33Å |
| 130 | G | 76.6 | Confident | 84.8 | Confident | 55 Ų | 55 | 100.5 Ų | 100.5 | 57% | 0.567 | 47% | 0.472 | S | S | * | . | trans | 64 | 16.9 | -174.4 | 0 | 0 | 0 | 0 | 0 | 113.4 | K126 D132 | K126-G130 VanDerWaalsContact O-CA 3.31Å; K126-G130 WeakPolarHBondContact O-CA 3.31Å; K126-G130 PolarHBondContact O-N 3.42Å; G130-D132 VanDerWaalsContact C-N 3.3Å; G130-D132 PolarHBondContact O-N 3.4Å | ||
| 131 | M | 71.2 | Confident | 84.7 | Confident | 85 Ų | 85 | 102.7 Ų | 102.7 | 42% | 0.419 | 48% | 0.48 | S | S | . | . | trans | -73.8 | 83 | 177.5 | -72.8 | -167 | -167.5 | 0 | 0 | 110.2 | R125 E129 I136 | R125-M131 HydrophobicContact CG-SD 4.35Å; E129-M131 HydrophobicContact CB-CE 4.36Å; E129-M131 HydrophobicContact CB-CG 3.95Å; E129-M131 PolarHBondContact O-N 3.28Å; E129-M131 WeakPolarHBondContact OE2-CE 3.37Å; E129-M131 VanDerWaalsContact OE2-SD 3.33Å; M131-I136 HydrophobicContact CB-CD1 4.13Å; M131-I136 HydrophobicContact CG-CD1 4.44Å | ||
| 132 | D | 82.5 | Confident | 84.4 | Confident | 58 Ų | 58 | 100.8 Ų | 100.8 | 31% | 0.31 | 47% | 0.473 | S | S | . | . | trans | -79.8 | 118.3 | 168.2 | -178.1 | 13.5 | 0 | 0 | 0 | 109.9 | G130 N134 Y135 I136 | G130-D132 VanDerWaalsContact C-N 3.3Å; G130-D132 PolarHBondContact O-N 3.4Å; D132-N134 VanDerWaalsContact C-N 3.26Å; D132-N134 PolarHBondContact O-N 3.07Å; D132-N134 PolarHBondContact OD1-N 2.92Å; D132-Y135 VanDerWaalsContact O-CB 3.31Å; D132-Y135 WeakPolarHBondContact O-CB 3.07Å; D132-Y135 PolarHBondContact O-N 3.46Å; D132-Y135 VanDerWaalsContact O-N 3.08Å; D132-I136 WeakPolarHBondContact O-CG1 3.42Å; D132-I136 PolarHBondContact O-N 3.05Å | ||
| 133 | M | 81.8 | Confident | 84.4 | Confident | 99 Ų | 99 | 101.2 Ų | 101.2 | 49% | 0.488 | 47% | 0.472 | S | S | . | . | H | α-helix | trans | -58.6 | -39.1 | 179.8 | -67.7 | -62.9 | 174.1 | 0 | 0 | 111.7 | L122 Y135 I136 I137 | L122-M133 HydrophobicContact CD2-CE 3.96Å; M133-Y135 VanDerWaalsContact C-N 3.3Å; M133-Y135 PolarHBondContact O-N 3.21Å; M133-I136 PolarHBondContact O-N 3.11Å; M133-I136 HydrophobicContact SD-CD1 4.35Å; M133-I137 WeakPolarHBondContact O-CD1 3.21Å; M133-I137 VanDerWaalsContact O-CG1 3.23Å; M133-I137 WeakPolarHBondContact O-CG1 3.2Å; M133-I137 PolarHBondContact O-N 2.66Å |
| 134 | N | 86.2 | Confident | 84.4 | Confident | 92 Ų | 92 | 102.2 Ų | 102.2 | 49% | 0.492 | 47% | 0.474 | S | S | . | . | H | α-helix | trans | -62.4 | -41.4 | 176.9 | -175 | 29.6 | 0 | 0 | 0 | 111 | D132 I137 Q138 | D132-N134 VanDerWaalsContact C-N 3.26Å; D132-N134 PolarHBondContact O-N 3.07Å; D132-N134 PolarHBondContact OD1-N 2.92Å; N134-I137 PolarHBondContact O-N 2.82Å; N134-Q138 VanDerWaalsContact CG-NE2 3.27Å; N134-Q138 PolarHBondContact ND2-NE2 3.17Å; N134-Q138 VanDerWaalsContact ND2-NE2 3.2Å; N134-Q138 VanDerWaalsContact O-CG 3.31Å; N134-Q138 WeakPolarHBondContact O-CG 3.21Å; N134-Q138 PolarHBondContact O-N 3.2Å; N134-Q138 PolarHBondContact OD1-NE2 3.44Å |
| 135 | Y | 86.1 | Confident | 84.4 | Confident | 107 Ų | 107 | 103 Ų | 103 | 42% | 0.42 | 48% | 0.481 | S | S | . | . | H | α-helix | trans | -65.5 | -40.8 | 177.1 | -169 | -115.1 | 0 | 0 | 0 | 113.1 | D132 M133 Q138 R139 | D132-Y135 VanDerWaalsContact O-CB 3.31Å; D132-Y135 WeakPolarHBondContact O-CB 3.07Å; D132-Y135 PolarHBondContact O-N 3.46Å; D132-Y135 VanDerWaalsContact O-N 3.08Å; M133-Y135 VanDerWaalsContact C-N 3.3Å; M133-Y135 PolarHBondContact O-N 3.21Å; Y135-Q138 PolarHBondContact O-N 3.14Å; Y135-R139 HydrophobicContact CE1-CG 4.43Å; Y135-R139 WeakPolarHBondContact O-CB 3.34Å; Y135-R139 PolarHBondContact O-N 2.96Å; Y135-R139 VanDerWaalsContact O-N 3.07Å; Y135-R139 PolarHBondContact OH-NE 3.41Å; Y135-R139 VanDerWaalsContact OH-NE 3.11Å; Y135-R139 PolarHBondContact OH-NH2 3.21Å |
| 136 | I | 86.6 | Confident | 84.5 | Confident | 55 Ų | 55 | 103.8 Ų | 103.8 | 28% | 0.282 | 50% | 0.496 | S | S | . | . | H | α-helix | trans | -64.1 | -44.1 | 176.8 | -67.2 | 166.1 | 0 | 0 | 0 | 110.3 | M131 D132 M133 R139 K140 | M131-I136 HydrophobicContact CB-CD1 4.13Å; M131-I136 HydrophobicContact CG-CD1 4.44Å; D132-I136 WeakPolarHBondContact O-CG1 3.42Å; D132-I136 PolarHBondContact O-N 3.05Å; M133-I136 PolarHBondContact O-N 3.11Å; M133-I136 HydrophobicContact SD-CD1 4.35Å; I136-R139 PolarHBondContact O-N 3.44Å; I136-K140 HydrophobicContact CG2-CD 4.35Å; I136-K140 WeakPolarHBondContact O-CG 3.42Å; I136-K140 PolarHBondContact O-N 3.44Å; I136-K140 VanDerWaalsContact O-N 3.16Å |
| 137 | I | 86.9 | Confident | 84.5 | Confident | 80 Ų | 80 | 101.3 Ų | 101.3 | 41% | 0.41 | 49% | 0.493 | S | S | . | . | H | α-helix | trans | -60.9 | -47 | 178.1 | -68.5 | 163.7 | 0 | 0 | 0 | 110.5 | M133 N134 R139 K140 F143 | M133-I137 WeakPolarHBondContact O-CD1 3.21Å; M133-I137 VanDerWaalsContact O-CG1 3.23Å; M133-I137 WeakPolarHBondContact O-CG1 3.2Å; M133-I137 PolarHBondContact O-N 2.66Å; N134-I137 PolarHBondContact O-N 2.82Å; I137-R139 VanDerWaalsContact C-N 3.33Å; I137-R139 PolarHBondContact O-N 3.32Å; I137-K140 PolarHBondContact O-N 3.06Å; I137-F143 HydrophobicContact CG2-CB 4.19Å; I137-F143 HydrophobicContact CG2-CD1 3.93Å; I137-F143 HydrophobicContact CG2-CE1 4.46Å; I137-F143 HydrophobicContact CG2-CG 3.97Å; I137-F143 WeakPolarHBondContact O-CB 3.45Å |
| 138 | Q | 86.3 | Confident | 84.7 | Confident | 112 Ų | 112 | 97.4 Ų | 97.4 | 52% | 0.523 | 47% | 0.473 | S | S | . | . | H | α-helix | trans | -66.3 | -31.2 | 179.9 | -69.4 | 174.2 | 33.5 | 0 | 0 | 114 | N134 Y135 | N134-Q138 VanDerWaalsContact CG-NE2 3.27Å; N134-Q138 PolarHBondContact ND2-NE2 3.17Å; N134-Q138 VanDerWaalsContact ND2-NE2 3.2Å; N134-Q138 VanDerWaalsContact O-CG 3.31Å; N134-Q138 WeakPolarHBondContact O-CG 3.21Å; N134-Q138 PolarHBondContact O-N 3.2Å; N134-Q138 PolarHBondContact OD1-NE2 3.44Å; Y135-Q138 PolarHBondContact O-N 3.14Å |
| 139 | R | 86 | Confident | 84.9 | Confident | 159 Ų | 159 | 97.1 Ų | 97.1 | 60% | 0.6 | 47% | 0.468 | S | S | * | . | H | α-helix | trans | -77 | -31.2 | 179.1 | -83.4 | -173 | 164.1 | -174.5 | -2 | 113.4 | Y135 I136 I137 K141 R144 | Y135-R139 HydrophobicContact CE1-CG 4.43Å; Y135-R139 WeakPolarHBondContact O-CB 3.34Å; Y135-R139 PolarHBondContact O-N 2.96Å; Y135-R139 VanDerWaalsContact O-N 3.07Å; Y135-R139 PolarHBondContact OH-NE 3.41Å; Y135-R139 VanDerWaalsContact OH-NE 3.11Å; Y135-R139 PolarHBondContact OH-NH2 3.21Å; I136-R139 PolarHBondContact O-N 3.44Å; I137-R139 VanDerWaalsContact C-N 3.33Å; I137-R139 PolarHBondContact O-N 3.32Å; R139-K141 PolarHBondContact O-N 3.4Å; R139-R144 PolarHBondContact O-NH2 2.85Å |
| 140 | K | 89 | Confident | 85.4 | Confident | 103 Ų | 103 | 97.7 Ų | 97.7 | 45% | 0.448 | 47% | 0.471 | S | S | . | . | trans | -66.1 | 130.8 | 179.6 | -78.4 | -179.4 | 177 | -173.2 | 0 | 110.4 | I136 I137 E142 F143 | I136-K140 HydrophobicContact CG2-CD 4.35Å; I136-K140 WeakPolarHBondContact O-CG 3.42Å; I136-K140 PolarHBondContact O-N 3.44Å; I136-K140 VanDerWaalsContact O-N 3.16Å; I137-K140 PolarHBondContact O-N 3.06Å; K140-E142 VanDerWaalsContact C-N 3.25Å; K140-E142 PolarHBondContact O-N 2.98Å; K140-F143 HydrophobicContact CB-CD2 3.65Å; K140-F143 HydrophobicContact CB-CE2 4.3Å; K140-F143 HydrophobicContact CD-CD2 4Å; K140-F143 HydrophobicContact CD-CE2 3.77Å; K140-F143 HydrophobicContact CG-CD2 4.48Å; K140-F143 PolarHBondContact O-N 2.8Å | ||
| 141 | K | 87.3 | Confident | 86 | Confident | 152 Ų | 152 | 101.9 Ų | 101.9 | 66% | 0.661 | 47% | 0.474 | S | S | * | . | G | 310 helix | trans | -70.2 | -27.3 | -177.4 | 63.8 | 179.6 | -178.7 | 177.7 | 0 | 111.7 | R139 F143 R144 | R139-K141 PolarHBondContact O-N 3.4Å; K141-F143 PolarHBondContact O-N 3.08Å; K141-R144 WeakPolarHBondContact O-CB 3.4Å; K141-R144 PolarHBondContact O-N 3.02Å; K141-R144 VanDerWaalsContact O-N 3.14Å |
| 142 | E | 84.3 | Confident | 86.9 | Confident | 100 Ų | 100 | 100.6 Ų | 100.6 | 47% | 0.467 | 47% | 0.468 | S | S | . | . | G | 310 helix | trans | -66.1 | -26.6 | -179.5 | -62.4 | 70.1 | -149.8 | 0 | 0 | 112.1 | K140 I148 | K140-E142 VanDerWaalsContact C-N 3.25Å; K140-E142 PolarHBondContact O-N 2.98Å; E142-I148 WeakPolarHBondContact O-CB 3.23Å |
| 143 | F | 84.8 | Confident | 87.2 | Confident | 81 Ų | 81 | 99.8 Ų | 99.8 | 36% | 0.355 | 46% | 0.464 | S | S | . | . | G | 310 helix | trans | -91.9 | -2.3 | 177.5 | -69 | -89.4 | 0 | 0 | 0 | 113.4 | I137 K140 K141 I148 L152 | I137-F143 HydrophobicContact CG2-CB 4.19Å; I137-F143 HydrophobicContact CG2-CD1 3.93Å; I137-F143 HydrophobicContact CG2-CE1 4.46Å; I137-F143 HydrophobicContact CG2-CG 3.97Å; I137-F143 WeakPolarHBondContact O-CB 3.45Å; K140-F143 HydrophobicContact CB-CD2 3.65Å; K140-F143 HydrophobicContact CB-CE2 4.3Å; K140-F143 HydrophobicContact CD-CD2 4Å; K140-F143 HydrophobicContact CD-CE2 3.77Å; K140-F143 HydrophobicContact CG-CD2 4.48Å; K140-F143 PolarHBondContact O-N 2.8Å; K141-F143 PolarHBondContact O-N 3.08Å; F143-I148 HydrophobicContact CD1-CG1 4.36Å; F143-L152 HydrophobicContact CE1-CD2 4.4Å |
| 144 | R | 86.6 | Confident | 87.6 | Confident | 169 Ų | 169 | 102.1 Ų | 102.1 | 64% | 0.638 | 47% | 0.473 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -85 | -24.3 | 176.6 | -67 | -176.3 | -176.6 | 148.7 | 3.1 | 113 | R139 K141 | R139-R144 PolarHBondContact O-NH2 2.85Å; K141-R144 WeakPolarHBondContact O-CB 3.4Å; K141-R144 PolarHBondContact O-N 3.02Å; K141-R144 VanDerWaalsContact O-N 3.14Å |
| 145 | N | 89.1 | Confident | 87.7 | Confident | 87 Ų | 87 | 106.2 Ų | 106.2 | 47% | 0.465 | 49% | 0.487 | S | S | . | . | S | Bend | trans | -84 | 121.8 | 178.4 | -171.2 | -18.2 | 0 | 0 | 0 | 109.1 | S147 I148 | N145-S147 PolarHBondContact ND2-OG 3.41Å; N145-S147 PolarHBondContact O-N 3.3Å; N145-S147 PolarHBondContact OD1-N 3.41Å; N145-S147 PolarHBondContact OD1-OG 3.41Å; N145-S147 VanDerWaalsContact OD1-OG 3.13Å; N145-I148 WeakPolarHBondContact O-CB 3.31Å; N145-I148 WeakPolarHBondContact O-CG2 3.23Å; N145-I148 PolarHBondContact O-N 3.48Å |
| 146 | P | 86.9 | Confident | 87.8 | Confident | 93 Ų | 93 | 104.6 Ų | 104.6 | 60% | 0.604 | 49% | 0.49 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -58.1 | -17.9 | 176.9 | 23.4 | -34 | 0 | 0 | 0 | 114 | I148 Y149 | P146-I148 PolarHBondContact O-N 3.27Å; P146-I148 VanDerWaalsContact O-N 3.15Å; P146-Y149 HydrophobicContact CB-CD2 4.44Å; P146-Y149 HydrophobicContact CB-CE2 4.45Å; P146-Y149 WeakPolarHBondContact O-CD2 3.18Å; P146-Y149 PolarHBondContact O-N 2.94Å |
| 147 | S | 88.2 | Confident | 87.8 | Confident | 60 Ų | 60 | 106.2 Ų | 106.2 | 42% | 0.42 | 51% | 0.512 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -65.8 | -10.9 | 172.9 | 69.5 | 0 | 0 | 0 | 0 | 114.3 | N145 Y149 | N145-S147 PolarHBondContact ND2-OG 3.41Å; N145-S147 PolarHBondContact O-N 3.3Å; N145-S147 PolarHBondContact OD1-N 3.41Å; N145-S147 PolarHBondContact OD1-OG 3.41Å; N145-S147 VanDerWaalsContact OD1-OG 3.13Å; S147-Y149 PolarHBondContact O-N 3.28Å |
| 148 | I | 90.4 | Very high | 87.8 | Confident | 28 Ų | 28 | 107.1 Ų | 107.1 | 14% | 0.144 | 52% | 0.517 | C | S | . | . | H | α-helix | trans | -65.3 | -26.1 | 174.1 | -164.4 | 57.6 | 0 | 0 | 0 | 112.4 | E142 F143 N145 P146 E150 K151 L152 | E142-I148 WeakPolarHBondContact O-CB 3.23Å; F143-I148 HydrophobicContact CD1-CG1 4.36Å; N145-I148 WeakPolarHBondContact O-CB 3.31Å; N145-I148 WeakPolarHBondContact O-CG2 3.23Å; N145-I148 PolarHBondContact O-N 3.48Å; P146-I148 PolarHBondContact O-N 3.27Å; P146-I148 VanDerWaalsContact O-N 3.15Å; I148-E150 VanDerWaalsContact C-N 3.32Å; I148-E150 PolarHBondContact O-N 3.42Å; I148-K151 HydrophobicContact CD1-CB 4.46Å; I148-K151 HydrophobicContact CD1-CD 4.31Å; I148-K151 PolarHBondContact O-N 3.28Å; I148-K151 VanDerWaalsContact O-N 3.16Å; I148-L152 HydrophobicContact CG1-CD1 4.22Å; I148-L152 HydrophobicContact CG1-CG 4.24Å; I148-L152 HydrophobicContact CG2-CD1 4.28Å; I148-L152 WeakPolarHBondContact O-CG 3.41Å; I148-L152 PolarHBondContact O-N 3.12Å |
| 149 | Y | 87.4 | Confident | 87.7 | Confident | 150 Ų | 150 | 105.8 Ų | 105.8 | 59% | 0.588 | 51% | 0.513 | S | S | * | . | H | α-helix | trans | -61.7 | -39 | -177.5 | -68.9 | -56.3 | 0 | 0 | 0 | 112.2 | P146 S147 K151 L152 I153 | P146-Y149 HydrophobicContact CB-CD2 4.44Å; P146-Y149 HydrophobicContact CB-CE2 4.45Å; P146-Y149 WeakPolarHBondContact O-CD2 3.18Å; P146-Y149 PolarHBondContact O-N 2.94Å; S147-Y149 PolarHBondContact O-N 3.28Å; Y149-K151 VanDerWaalsContact C-N 3.28Å; Y149-K151 PolarHBondContact O-N 3.45Å; Y149-L152 HydrophobicContact CD1-CD1 4.24Å; Y149-L152 PolarHBondContact O-N 3.38Å; Y149-L152 VanDerWaalsContact O-N 3.08Å; Y149-I153 WeakPolarHBondContact O-CB 3.5Å; Y149-I153 WeakPolarHBondContact O-CD1 3.39Å; Y149-I153 WeakPolarHBondContact O-CG1 3.39Å; Y149-I153 PolarHBondContact O-N 2.99Å |
| 150 | E | 88.7 | Confident | 87.4 | Confident | 127 Ų | 127 | 105.2 Ų | 105.2 | 59% | 0.593 | 52% | 0.517 | S | S | * | . | H | α-helix | trans | -55.9 | -44 | 175.8 | -66.7 | 176.4 | -174.3 | 0 | 0 | 111.5 | I148 Q154 | I148-E150 VanDerWaalsContact C-N 3.32Å; I148-E150 PolarHBondContact O-N 3.42Å; E150-Q154 WeakPolarHBondContact O-CB 3.47Å; E150-Q154 VanDerWaalsContact O-CG 3.23Å; E150-Q154 WeakPolarHBondContact O-CG 3.47Å; E150-Q154 PolarHBondContact O-N 2.99Å |
| 151 | K | 90.3 | Very high | 86.9 | Confident | 142 Ų | 142 | 105.5 Ų | 105.5 | 62% | 0.617 | 52% | 0.523 | S | S | * | . | H | α-helix | trans | -69.5 | -36.7 | 177.6 | -63.3 | -176.3 | -179.4 | -179.1 | 0 | 112.2 | I148 Y149 F155 | I148-K151 HydrophobicContact CD1-CB 4.46Å; I148-K151 HydrophobicContact CD1-CD 4.31Å; I148-K151 PolarHBondContact O-N 3.28Å; I148-K151 VanDerWaalsContact O-N 3.16Å; Y149-K151 VanDerWaalsContact C-N 3.28Å; Y149-K151 PolarHBondContact O-N 3.45Å; K151-F155 WeakPolarHBondContact O-CB 3.4Å; K151-F155 PolarHBondContact O-N 3.33Å |
| 152 | L | 89.4 | Confident | 86.4 | Confident | 58 Ų | 58 | 100.2 Ų | 100.2 | 30% | 0.304 | 51% | 0.512 | S | S | . | . | H | α-helix | trans | -69.8 | -39.6 | 178.2 | -67.8 | 173.9 | 0 | 0 | 0 | 111.7 | F143 I148 Y149 F155 C156 | F143-L152 HydrophobicContact CE1-CD2 4.4Å; I148-L152 HydrophobicContact CG1-CD1 4.22Å; I148-L152 HydrophobicContact CG1-CG 4.24Å; I148-L152 HydrophobicContact CG2-CD1 4.28Å; I148-L152 WeakPolarHBondContact O-CG 3.41Å; I148-L152 PolarHBondContact O-N 3.12Å; Y149-L152 HydrophobicContact CD1-CD1 4.24Å; Y149-L152 PolarHBondContact O-N 3.38Å; Y149-L152 VanDerWaalsContact O-N 3.08Å; L152-F155 PolarHBondContact O-N 2.95Å; L152-C156 WeakPolarHBondContact O-CB 3.31Å; L152-C156 PolarHBondContact O-N 3.16Å; L152-C156 PolarHBondContact O-SG 3.36Å; L152-C156 VanDerWaalsContact O-SG 3.4Å |
| 153 | I | 89.3 | Confident | 86.2 | Confident | 42 Ų | 42 | 98 Ų | 98 | 22% | 0.215 | 51% | 0.505 | C | S | . | . | H | α-helix | trans | -60.9 | -48.1 | 174.6 | -69.9 | 160.9 | 0 | 0 | 0 | 109.3 | Y149 A157 I158 E160 | Y149-I153 WeakPolarHBondContact O-CB 3.5Å; Y149-I153 WeakPolarHBondContact O-CD1 3.39Å; Y149-I153 WeakPolarHBondContact O-CG1 3.39Å; Y149-I153 PolarHBondContact O-N 2.99Å; I153-A157 WeakPolarHBondContact O-CA 2.94Å; I153-A157 PolarHBondContact O-N 3.26Å; I153-I158 HydrophobicContact CG2-CB 4.29Å; I153-I158 VanDerWaalsContact CG2-O 3.31Å; I153-I158 WeakPolarHBondContact CG2-O 3.19Å; I153-I158 PolarHBondContact O-N 3.17Å; I153-E160 HydrophobicContact CD1-CG 4.13Å; I153-E160 HydrophobicContact CG2-CG 3.67Å |
| 154 | Q | 88.7 | Confident | 86 | Confident | 148 Ų | 148 | 101.7 Ų | 101.7 | 69% | 0.692 | 53% | 0.529 | S | S | * | . | H | α-helix | trans | -61.7 | -46.4 | 175.5 | -70.6 | 168.7 | 16.4 | 0 | 0 | 112.5 | E150 A157 | E150-Q154 WeakPolarHBondContact O-CB 3.47Å; E150-Q154 VanDerWaalsContact O-CG 3.23Å; E150-Q154 WeakPolarHBondContact O-CG 3.47Å; E150-Q154 PolarHBondContact O-N 2.99Å; Q154-A157 PolarHBondContact O-N 3.01Å |
| 155 | F | 89.9 | Confident | 85.6 | Confident | 178 Ų | 178 | 100.5 Ų | 100.5 | 78% | 0.781 | 53% | 0.525 | S | S | * | . | H | α-helix | trans | -66.4 | -39.7 | -178.8 | 177.9 | -99.3 | 0 | 0 | 0 | 112.7 | K151 L152 A157 | K151-F155 WeakPolarHBondContact O-CB 3.4Å; K151-F155 PolarHBondContact O-N 3.33Å; L152-F155 PolarHBondContact O-N 2.95Å; F155-A157 VanDerWaalsContact C-N 3.29Å |
| 156 | C | 88 | Confident | 85.1 | Confident | 72 Ų | 72 | 96.7 Ų | 96.7 | 49% | 0.486 | 51% | 0.505 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -86.5 | 0.6 | 178.8 | -65.5 | 0 | 0 | 0 | 0 | 113 | L152 I158 | L152-C156 WeakPolarHBondContact O-CB 3.31Å; L152-C156 PolarHBondContact O-N 3.16Å; L152-C156 PolarHBondContact O-SG 3.36Å; L152-C156 VanDerWaalsContact O-SG 3.4Å; C156-I158 HydrophobicContact CB-CD1 3.64Å; C156-I158 HydrophobicContact CB-CG1 3.64Å; C156-I158 PolarHBondContact O-N 3.38Å |
| 157 | A | 86 | Confident | 84.7 | Confident | 90 Ų | 90 | 98.3 Ų | 98.3 | 74% | 0.744 | 50% | 0.503 | S | S | * | . | T | Hydrogen-bonded Turn | trans | 47.7 | 45.4 | -175.2 | 0 | 0 | 0 | 0 | 0 | 112.6 | I153 Q154 F155 | I153-A157 WeakPolarHBondContact O-CA 2.94Å; I153-A157 PolarHBondContact O-N 3.26Å; Q154-A157 PolarHBondContact O-N 3.01Å; F155-A157 VanDerWaalsContact C-N 3.29Å |
| 158 | I | 86.7 | Confident | 84 | Confident | 99 Ų | 99 | 100.5 Ų | 100.5 | 51% | 0.508 | 51% | 0.51 | S | S | . | . | trans | -83.1 | 130.4 | -179.6 | -62.7 | 170.3 | 0 | 0 | 0 | 108.5 | I153 C156 E160 | I153-I158 HydrophobicContact CG2-CB 4.29Å; I153-I158 VanDerWaalsContact CG2-O 3.31Å; I153-I158 WeakPolarHBondContact CG2-O 3.19Å; I153-I158 PolarHBondContact O-N 3.17Å; C156-I158 HydrophobicContact CB-CD1 3.64Å; C156-I158 HydrophobicContact CB-CG1 3.64Å; C156-I158 PolarHBondContact O-N 3.38Å; I158-E160 PolarHBondContact O-N 3.33Å | ||
| 159 | D | 84.3 | Confident | 83.4 | Confident | 83 Ų | 83 | 103.3 Ų | 103.3 | 44% | 0.444 | 52% | 0.523 | S | S | . | . | trans | -76.9 | 114.5 | 167.2 | -177.8 | 1.9 | 0 | 0 | 0 | 109 | L161 G162 H173 | D159-L161 PolarHBondContact O-N 3.49Å; D159-L161 PolarHBondContact OD1-N 3.15Å; D159-L161 VanDerWaalsContact OD1-N 3.12Å; D159-G162 PolarHBondContact O-N 3.16Å; D159-G162 PolarHBondContact OD1-N 3.04Å; D159-G162 WeakPolarHBondContact OD2-CA 3.43Å; D159-G162 PolarHBondContact OD2-N 3.14Å; D159-H173 IonicContact OD1-CE1 2.94Å; D159-H173 IonicContact OD1-NE2 3.94Å; D159-H173 PolarHBondContact OD1-NE2 2.87Å; D159-H173 IonicContact OD2-CD2 2.94Å; D159-H173 IonicContact OD2-NE2 2.81Å; D159-H173 PolarHBondContact OD2-NE2 3.12Å | ||
| 160 | E | 80.6 | Confident | 82.8 | Confident | 148 Ų | 148 | 101.5 Ų | 101.5 | 69% | 0.692 | 52% | 0.519 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -62.7 | -31.2 | -178.1 | -65 | -177 | -153.4 | 0 | 0 | 112.9 | I153 I158 | I153-E160 HydrophobicContact CD1-CG 4.13Å; I153-E160 HydrophobicContact CG2-CG 3.67Å; I158-E160 PolarHBondContact O-N 3.33Å |
| 161 | L | 76.9 | Confident | 82.3 | Confident | 108 Ų | 108 | 98.6 Ų | 98.6 | 57% | 0.565 | 51% | 0.507 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -97.5 | -2.3 | 175.9 | -61 | 179.4 | 0 | 0 | 0 | 111.3 | D159 P172 | D159-L161 PolarHBondContact O-N 3.49Å; D159-L161 PolarHBondContact OD1-N 3.15Å; D159-L161 VanDerWaalsContact OD1-N 3.12Å; L161-P172 HydrophobicContact CB-CB 3.96Å; L161-P172 WeakPolarHBondContact O-CB 3.47Å; L161-P172 WeakPolarHBondContact O-CG 3.48Å |
| 162 | G | 78.1 | Confident | 81.8 | Confident | 41 Ų | 41 | 93.1 Ų | 93.1 | 42% | 0.423 | 49% | 0.486 | S | S | . | . | trans | -60.4 | 136.4 | -176.5 | 0 | 0 | 0 | 0 | 0 | 111.9 | D159 | D159-G162 PolarHBondContact O-N 3.16Å; D159-G162 PolarHBondContact OD1-N 3.04Å; D159-G162 WeakPolarHBondContact OD2-CA 3.43Å; D159-G162 PolarHBondContact OD2-N 3.14Å | ||
| 163 | T | 79.4 | Confident | 81 | Confident | 54 Ų | 54 | 95.1 Ų | 95.1 | 33% | 0.331 | 49% | 0.494 | S | S | . | . | trans | -110.9 | 156.7 | 173.6 | 76.5 | 0 | 0 | 0 | 0 | 111.8 | Y165 F170 P172 | T163-Y165 PolarHBondContact O-N 3.03Å; T163-Y165 PolarHBondContact OG1-N 3.19Å; T163-Y165 PolarHBondContact OG1-O 3.05Å; T163-F170 HydrophobicContact CG2-CD1 3.4Å; T163-F170 HydrophobicContact CG2-CE1 3.47Å; T163-F170 VanDerWaalsContact CG2-CE1 3.47Å; T163-P172 HydrophobicContact CG2-CG 3.43Å; T163-P172 VanDerWaalsContact CG2-CG 3.43Å | ||
| 164 | N | 80.9 | Confident | 80.2 | Confident | 159 Ų | 159 | 95.6 Ų | 95.6 | 85% | 0.85 | 51% | 0.509 | S | S | * | . | S | Bend | trans | -77.3 | -4.1 | 168.1 | -164.8 | -96.4 | 0 | 0 | 0 | 112 | ||
| 165 | Y | 78.3 | Confident | 79.6 | Confident | 144 Ų | 144 | 97.1 Ų | 97.1 | 57% | 0.565 | 51% | 0.509 | S | S | * | . | S | Bend | trans | -80.6 | 145.7 | 178.6 | -65.3 | -61.8 | 0 | 0 | 0 | 110.5 | T163 M169 | T163-Y165 PolarHBondContact O-N 3.03Å; T163-Y165 PolarHBondContact OG1-N 3.19Å; T163-Y165 PolarHBondContact OG1-O 3.05Å; Y165-M169 HydrophobicContact CD1-CE 2.98Å; Y165-M169 HydrophobicContact CE1-CE 3.58Å; Y165-M169 HydrophobicContact CG-CE 3.54Å |
| 166 | P | 79.3 | Confident | 78.9 | Confident | 7 Ų | 7 | 91.8 Ų | 91.8 | 5% | 0.045 | 49% | 0.494 | C | S | . | . | trans | -62.6 | 143.7 | 170.9 | 30.9 | -36.8 | 0 | 0 | 0 | 109.4 | V86 A87 D168 M169 F170 | V86-P166 HydrophobicContact CG1-CB 4.41Å; A87-P166 HydrophobicContact CB-CB 3.81Å; A87-P166 HydrophobicContact CB-CG 4.46Å; P166-D168 WeakPolarHBondContact CB-OD1 3.16Å; P166-D168 WeakPolarHBondContact CG-OD1 3.42Å; P166-D168 PolarHBondContact O-N 3.01Å; P166-D168 VanDerWaalsContact O-N 3.17Å; P166-M169 HydrophobicContact CG-CB 4.26Å; P166-M169 PolarHBondContact O-N 3.13Å; P166-F170 PolarHBondContact O-N 3.2Å; P166-F170 VanDerWaalsContact O-N 3.14Å | ||
| 167 | K | 77.2 | Confident | 78.1 | Confident | 126 Ų | 126 | 95.9 Ų | 95.9 | 55% | 0.548 | 51% | 0.506 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -62.8 | -22.2 | -173.9 | -63.6 | 178.5 | 179.5 | -179.3 | 0 | 113 | Q83 M169 | Q83-K167 HydrophobicContact CG-CD 4.47Å; K167-M169 PolarHBondContact O-N 3.04Å |
| 168 | D | 74.9 | Confident | 77.3 | Confident | 106 Ų | 106 | 97.5 Ų | 97.5 | 57% | 0.567 | 50% | 0.502 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -64.2 | -29.6 | 173 | 69.1 | -28.5 | 0 | 0 | 0 | 112.5 | P166 | P166-D168 WeakPolarHBondContact CB-OD1 3.16Å; P166-D168 WeakPolarHBondContact CG-OD1 3.42Å; P166-D168 PolarHBondContact O-N 3.01Å; P166-D168 VanDerWaalsContact O-N 3.17Å |
| 169 | M | 76.5 | Confident | 76.8 | Confident | 88 Ų | 88 | 95.7 Ų | 95.7 | 43% | 0.433 | 50% | 0.498 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -96.6 | -40.8 | -178 | -171.5 | 169.6 | 69 | 0 | 0 | 111.9 | R94 Y165 P166 K167 | R94-M169 PolarHBondContact NH1-SD 3.17Å; R94-M169 VanDerWaalsContact NH1-SD 3.44Å; Y165-M169 HydrophobicContact CD1-CE 2.98Å; Y165-M169 HydrophobicContact CE1-CE 3.58Å; Y165-M169 HydrophobicContact CG-CE 3.54Å; P166-M169 HydrophobicContact CG-CB 4.26Å; P166-M169 PolarHBondContact O-N 3.13Å; K167-M169 PolarHBondContact O-N 3.04Å |
| 170 | F | 75.6 | Confident | 76.6 | Confident | 111 Ų | 111 | 97.4 Ų | 97.4 | 49% | 0.487 | 50% | 0.499 | S | S | . | . | trans | -152.6 | 114.2 | 178.3 | -174.5 | -109.9 | 0 | 0 | 0 | 110.6 | T163 P166 P172 | T163-F170 HydrophobicContact CG2-CD1 3.4Å; T163-F170 HydrophobicContact CG2-CE1 3.47Å; T163-F170 VanDerWaalsContact CG2-CE1 3.47Å; P166-F170 PolarHBondContact O-N 3.2Å; P166-F170 VanDerWaalsContact O-N 3.14Å; F170-P172 HydrophobicContact CD1-CG 4.04Å; F170-P172 HydrophobicContact CE1-CG 3.73Å; F170-P172 WeakPolarHBondContact O-CD 3.15Å | ||
| 171 | D | 78.4 | Confident | 76.7 | Confident | 66 Ų | 66 | 99.8 Ų | 99.8 | 35% | 0.353 | 50% | 0.503 | S | S | . | . | trans | -110.7 | 103.1 | 171.9 | -168 | -2.4 | 0 | 0 | 0 | 110.3 | H173 G174 | D171-H173 PolarHBondContact O-N 3.26Å; D171-H173 VanDerWaalsContact O-N 3.17Å; D171-H173 PolarHBondContact OD1-N 3.5Å; D171-G174 PolarHBondContact O-N 3.04Å | ||
| 172 | P | 79.4 | Confident | 76.9 | Confident | 27 Ų | 27 | 100.7 Ų | 100.7 | 18% | 0.175 | 50% | 0.504 | C | S | . | . | T | Hydrogen-bonded Turn | trans | -51.6 | -31.3 | 171.8 | -27.5 | 34.8 | 0 | 0 | 0 | 113.9 | L161 T163 F170 | L161-P172 HydrophobicContact CB-CB 3.96Å; L161-P172 WeakPolarHBondContact O-CB 3.47Å; L161-P172 WeakPolarHBondContact O-CG 3.48Å; T163-P172 HydrophobicContact CG2-CG 3.43Å; T163-P172 VanDerWaalsContact CG2-CG 3.43Å; F170-P172 HydrophobicContact CD1-CG 4.04Å; F170-P172 HydrophobicContact CE1-CG 3.73Å; F170-P172 WeakPolarHBondContact O-CD 3.15Å |
| 173 | H | 73.4 | Confident | 77.1 | Confident | 100 Ų | 100 | 99.7 Ų | 99.7 | 46% | 0.463 | 49% | 0.492 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -100.1 | 9.2 | -177.7 | -58.5 | -71.8 | 0 | 0 | 0 | 112.4 | D159 D171 W175 | D159-H173 IonicContact OD1-CE1 2.94Å; D159-H173 IonicContact OD1-NE2 3.94Å; D159-H173 PolarHBondContact OD1-NE2 2.87Å; D159-H173 IonicContact OD2-CD2 2.94Å; D159-H173 IonicContact OD2-NE2 2.81Å; D159-H173 PolarHBondContact OD2-NE2 3.12Å; D171-H173 PolarHBondContact O-N 3.26Å; D171-H173 VanDerWaalsContact O-N 3.17Å; D171-H173 PolarHBondContact OD1-N 3.5Å; H173-W175 PolarHBondContact O-N 2.94Å; H173-W175 VanDerWaalsContact O-N 3.16Å |
| 174 | G | 72.3 | Confident | 77.2 | Confident | 53 Ų | 53 | 102 Ų | 102 | 55% | 0.546 | 50% | 0.502 | S | S | . | . | trans | -73.1 | -1.5 | -176.1 | 0 | 0 | 0 | 0 | 0 | 115.2 | D171 | D171-G174 PolarHBondContact O-N 3.04Š| ||
| 175 | W | 76.1 | Confident | 77.4 | Confident | 180 Ų | 180 | 96.2 Ų | 96.2 | 68% | 0.682 | 48% | 0.477 | S | S | * | . | trans | -79.5 | 120.9 | 176.7 | -61.6 | 99.2 | 0 | 0 | 0 | 110.3 | H173 Y180 | H173-W175 PolarHBondContact O-N 2.94Å; H173-W175 VanDerWaalsContact O-N 3.16Å; W175-Y180 HydrophobicContact CB-CE2 4Å; W175-Y180 WeakPolarHBondContact O-CE2 3.42Å; W175-Y180 PolarHBondContact O-OH 2.85Å | ||
| 176 | S | 75.1 | Confident | 77.6 | Confident | 66 Ų | 66 | 94.7 Ų | 94.7 | 46% | 0.462 | 47% | 0.473 | S | S | . | . | trans | -72.5 | 153.2 | 173.2 | 58.4 | 0 | 0 | 0 | 0 | 111.5 | D178 S179 Y180 | S176-D178 PolarHBondContact O-N 3.12Å; S176-S179 WeakPolarHBondContact O-CB 3.22Å; S176-S179 PolarHBondContact O-N 3.18Å; S176-S179 PolarHBondContact OG-OG 3.35Å; S176-Y180 WeakPolarHBondContact O-CD2 3.07Å; S176-Y180 WeakPolarHBondContact O-CE2 3.38Å | ||
| 177 | E | 71.1 | Confident | 77.8 | Confident | 158 Ų | 158 | 97.1 Ų | 97.1 | 74% | 0.738 | 49% | 0.493 | S | S | * | . | G | 310 helix | trans | -51.5 | -32 | -179.9 | -161.3 | 167.3 | -180 | 0 | 0 | 113.3 | S179 Y180 A183 | E177-S179 PolarHBondContact O-N 3.48Å; E177-Y180 WeakPolarHBondContact O-CD2 3.36Å; E177-Y180 PolarHBondContact O-N 3.02Å; E177-A183 WeakPolarHBondContact O-CB 3.48Å |
| 178 | D | 69.1 | Low | 78.1 | Confident | 124 Ų | 124 | 97.4 Ų | 97.4 | 66% | 0.663 | 50% | 0.496 | S | S | * | . | G | 310 helix | trans | -66.4 | -20.1 | 177.6 | -65.2 | -29.9 | 0 | 0 | 0 | 114.7 | S176 | S176-D178 PolarHBondContact O-N 3.12Š|
| 179 | S | 76.3 | Confident | 78.6 | Confident | 60 Ų | 60 | 99 Ų | 99 | 42% | 0.42 | 50% | 0.498 | S | S | . | . | G | 310 helix | trans | -85.2 | -12.3 | 177.4 | -61.8 | 0 | 0 | 0 | 0 | 112.9 | S176 E177 | S176-S179 WeakPolarHBondContact O-CB 3.22Å; S176-S179 PolarHBondContact O-N 3.18Å; S176-S179 PolarHBondContact OG-OG 3.35Å; E177-S179 PolarHBondContact O-N 3.48Å |
| 180 | Y | 80.1 | Confident | 79 | Confident | 119 Ų | 119 | 99 Ų | 99 | 47% | 0.467 | 50% | 0.499 | S | S | . | . | S | Bend | trans | -82.1 | 151.1 | -178.6 | -65.8 | -93.5 | 0 | 0 | 0 | 111.4 | W175 S176 E177 E182 A183 L184 | W175-Y180 HydrophobicContact CB-CE2 4Å; W175-Y180 WeakPolarHBondContact O-CE2 3.42Å; W175-Y180 PolarHBondContact O-OH 2.85Å; S176-Y180 WeakPolarHBondContact O-CD2 3.07Å; S176-Y180 WeakPolarHBondContact O-CE2 3.38Å; E177-Y180 WeakPolarHBondContact O-CD2 3.36Å; E177-Y180 PolarHBondContact O-N 3.02Å; Y180-E182 PolarHBondContact O-N 3.18Å; Y180-E182 VanDerWaalsContact O-N 3.12Å; Y180-A183 PolarHBondContact O-N 2.99Å; Y180-L184 PolarHBondContact O-N 3.32Å |
| 181 | Y | 82.7 | Confident | 79.3 | Confident | 198 Ų | 198 | 99.2 Ų | 99.2 | 78% | 0.776 | 50% | 0.502 | S | S | * | . | H | α-helix | trans | -48.6 | -43.2 | -176.8 | 174.5 | -99.4 | 0 | 0 | 0 | 113.3 | A183 L184 A185 | Y181-A183 PolarHBondContact O-N 3.4Å; Y181-L184 PolarHBondContact O-N 3.32Å; Y181-A185 WeakPolarHBondContact O-CB 3.4Å; Y181-A185 PolarHBondContact O-N 3.4Å |
| 182 | E | 81.6 | Confident | 79.3 | Confident | 127 Ų | 127 | 100.4 Ų | 100.4 | 59% | 0.593 | 51% | 0.506 | S | S | * | . | H | α-helix | trans | -63.4 | -41.8 | -179.7 | -71.3 | -159.5 | -174.1 | 0 | 0 | 113.5 | Y180 K186 | Y180-E182 PolarHBondContact O-N 3.18Å; Y180-E182 VanDerWaalsContact O-N 3.12Å; E182-K186 WeakPolarHBondContact O-CB 3.17Å; E182-K186 WeakPolarHBondContact O-CD 3.39Å; E182-K186 WeakPolarHBondContact O-CG 3.48Å; E182-K186 PolarHBondContact O-N 3.49Å; E182-K186 IonicContact OE2-NZ 2.94Å; E182-K186 PolarHBondContact OE2-NZ 3.49Å |
| 183 | A | 81 | Confident | 79.4 | Confident | 21 Ų | 21 | 102.9 Ų | 102.9 | 17% | 0.174 | 52% | 0.518 | C | S | . | . | H | α-helix | trans | -70.8 | -39.7 | -178.1 | 0 | 0 | 0 | 0 | 0 | 111.1 | E177 Y180 Y181 K186 A187 | E177-A183 WeakPolarHBondContact O-CB 3.48Å; Y180-A183 PolarHBondContact O-N 2.99Å; Y181-A183 PolarHBondContact O-N 3.4Å; A183-K186 PolarHBondContact O-N 3.31Å; A183-A187 WeakPolarHBondContact O-CB 3.4Å; A183-A187 PolarHBondContact O-N 3.32Å |
| 184 | L | 82.6 | Confident | 79.8 | Confident | 101 Ų | 101 | 105 Ų | 105 | 53% | 0.529 | 53% | 0.526 | S | S | . | . | H | α-helix | trans | -62 | -45.1 | 173.9 | -66.8 | 174.8 | 0 | 0 | 0 | 111.8 | Y180 Y181 K186 A187 Q188 | Y180-L184 PolarHBondContact O-N 3.32Å; Y181-L184 PolarHBondContact O-N 3.32Å; L184-K186 PolarHBondContact O-N 2.97Å; L184-A187 PolarHBondContact O-N 2.9Å; L184-Q188 WeakPolarHBondContact O-CB 3.34Å; L184-Q188 PolarHBondContact O-N 3.48Å |
| 185 | A | 84.3 | Confident | 80 | Confident | 39 Ų | 39 | 106.3 Ų | 106.3 | 32% | 0.322 | 52% | 0.52 | S | S | . | . | H | α-helix | trans | -63.3 | -41.8 | 177.2 | 0 | 0 | 0 | 0 | 0 | 111.9 | Y181 K189 | Y181-A185 WeakPolarHBondContact O-CB 3.4Å; Y181-A185 PolarHBondContact O-N 3.4Å; A185-K189 WeakPolarHBondContact O-CB 3.2Å; A185-K189 PolarHBondContact O-N 2.98Å |
| 186 | K | 83.8 | Confident | 80.1 | Confident | 112 Ų | 112 | 103.2 Ų | 103.2 | 49% | 0.487 | 51% | 0.513 | S | S | . | . | H | α-helix | trans | -62.5 | -45.9 | 174.5 | -73.1 | 165 | -167.7 | 161.5 | 0 | 111 | E182 A183 L184 K189 I190 | E182-K186 WeakPolarHBondContact O-CB 3.17Å; E182-K186 WeakPolarHBondContact O-CD 3.39Å; E182-K186 WeakPolarHBondContact O-CG 3.48Å; E182-K186 PolarHBondContact O-N 3.49Å; E182-K186 IonicContact OE2-NZ 2.94Å; E182-K186 PolarHBondContact OE2-NZ 3.49Å; A183-K186 PolarHBondContact O-N 3.31Å; L184-K186 PolarHBondContact O-N 2.97Å; K186-K189 PolarHBondContact O-N 2.99Å; K186-I190 WeakPolarHBondContact O-CB 3.38Å; K186-I190 WeakPolarHBondContact O-CD1 3.31Å; K186-I190 WeakPolarHBondContact O-CG1 3.38Å; K186-I190 PolarHBondContact O-N 2.99Å |
| 187 | A | 82.1 | Confident | 80.2 | Confident | 57 Ų | 57 | 106.5 Ų | 106.5 | 47% | 0.471 | 52% | 0.519 | S | S | . | . | H | α-helix | trans | -62 | -45.8 | 178.6 | 0 | 0 | 0 | 0 | 0 | 112.1 | A183 L184 I190 E191 | A183-A187 WeakPolarHBondContact O-CB 3.4Å; A183-A187 PolarHBondContact O-N 3.32Å; L184-A187 PolarHBondContact O-N 2.9Å; A187-I190 PolarHBondContact O-N 3.37Å; A187-E191 PolarHBondContact O-N 2.95Å |
| 188 | Q | 84.6 | Confident | 80.4 | Confident | 132 Ų | 132 | 101.6 Ų | 101.6 | 62% | 0.617 | 51% | 0.505 | S | S | * | . | H | α-helix | trans | -62.7 | -43.6 | 177.8 | -172.6 | 180 | 27.3 | 0 | 0 | 111.8 | L184 E191 M192 | L184-Q188 WeakPolarHBondContact O-CB 3.34Å; L184-Q188 PolarHBondContact O-N 3.48Å; Q188-E191 PolarHBondContact O-N 2.98Å; Q188-M192 WeakPolarHBondContact O-CB 3.21Å; Q188-M192 WeakPolarHBondContact O-CG 3.35Å; Q188-M192 PolarHBondContact O-N 3.24Å |
| 189 | K | 85.3 | Confident | 80.7 | Confident | 139 Ų | 139 | 102 Ų | 102 | 60% | 0.604 | 50% | 0.501 | S | S | * | . | H | α-helix | trans | -61.3 | -45.5 | 176.2 | -175.8 | 178.6 | 178.5 | -179.8 | 0 | 111.6 | A185 K186 E191 M192 D193 | A185-K189 WeakPolarHBondContact O-CB 3.2Å; A185-K189 PolarHBondContact O-N 2.98Å; K186-K189 PolarHBondContact O-N 2.99Å; K189-E191 VanDerWaalsContact C-N 3.3Å; K189-E191 PolarHBondContact O-N 3.15Å; K189-M192 PolarHBondContact O-N 3.38Å; K189-D193 WeakPolarHBondContact O-CB 3.29Å; K189-D193 VanDerWaalsContact O-CG 3.22Å; K189-D193 PolarHBondContact O-N 3.05Å |
| 190 | I | 85 | Confident | 80.5 | Confident | 88 Ų | 88 | 107 Ų | 107 | 45% | 0.451 | 52% | 0.516 | S | S | . | . | H | α-helix | trans | -61.4 | -40.1 | 178 | -70.3 | 164.2 | 0 | 0 | 0 | 111.2 | K186 A187 K194 | K186-I190 WeakPolarHBondContact O-CB 3.38Å; K186-I190 WeakPolarHBondContact O-CD1 3.31Å; K186-I190 WeakPolarHBondContact O-CG1 3.38Å; K186-I190 PolarHBondContact O-N 2.99Å; A187-I190 PolarHBondContact O-N 3.37Å; I190-K194 HydrophobicContact CG2-CD 4.15Å; I190-K194 WeakPolarHBondContact O-CB 3.45Å; I190-K194 WeakPolarHBondContact O-CG 3.49Å; I190-K194 PolarHBondContact O-N 3.48Å |
| 191 | E | 80.8 | Confident | 79.8 | Confident | 117 Ų | 117 | 106.9 Ų | 106.9 | 55% | 0.547 | 52% | 0.519 | S | S | . | . | H | α-helix | trans | -65.1 | -46.7 | 176.2 | -162.6 | -155.7 | 169.7 | 0 | 0 | 111.6 | A187 Q188 K189 D193 K194 L195 | A187-E191 PolarHBondContact O-N 2.95Å; Q188-E191 PolarHBondContact O-N 2.98Å; K189-E191 VanDerWaalsContact C-N 3.3Å; K189-E191 PolarHBondContact O-N 3.15Å; E191-D193 PolarHBondContact O-N 2.93Å; E191-K194 WeakPolarHBondContact O-CB 3.44Å; E191-K194 PolarHBondContact O-N 2.85Å; E191-L195 WeakPolarHBondContact O-CG 3.38Å; E191-L195 PolarHBondContact O-N 3.43Å |
| 192 | M | 78.3 | Confident | 78.9 | Confident | 90 Ų | 90 | 107 Ų | 107 | 44% | 0.443 | 52% | 0.518 | S | S | . | . | H | α-helix | trans | -61 | -45.2 | 177.6 | -74.6 | -61.8 | -62 | 0 | 0 | 111.9 | Q188 K189 K194 L195 E196 | Q188-M192 WeakPolarHBondContact O-CB 3.21Å; Q188-M192 WeakPolarHBondContact O-CG 3.35Å; Q188-M192 PolarHBondContact O-N 3.24Å; K189-M192 PolarHBondContact O-N 3.38Å; M192-K194 VanDerWaalsContact C-N 3.31Å; M192-K194 PolarHBondContact O-N 3.27Å; M192-L195 PolarHBondContact O-N 3.25Å; M192-L195 VanDerWaalsContact O-N 3.15Å; M192-E196 WeakPolarHBondContact O-CG 3.38Å; M192-E196 PolarHBondContact O-N 3.4Å |
| 193 | D | 81.9 | Confident | 78.1 | Confident | 80 Ų | 80 | 105.1 Ų | 105.1 | 43% | 0.428 | 52% | 0.516 | S | S | . | . | H | α-helix | trans | -62.8 | -37.3 | 177.3 | -71.5 | -14.6 | 0 | 0 | 0 | 111.6 | K189 E191 K197 | K189-D193 WeakPolarHBondContact O-CB 3.29Å; K189-D193 VanDerWaalsContact O-CG 3.22Å; K189-D193 PolarHBondContact O-N 3.05Å; E191-D193 PolarHBondContact O-N 2.93Å; D193-K197 VanDerWaalsContact O-CB 3.23Å; D193-K197 WeakPolarHBondContact O-CB 3.23Å; D193-K197 PolarHBondContact O-N 2.89Å |
| 194 | K | 82.6 | Confident | 77.5 | Confident | 144 Ų | 144 | 111 Ų | 111 | 63% | 0.626 | 54% | 0.537 | S | S | * | . | H | α-helix | trans | -64.5 | -43.6 | 173.9 | -77.1 | 169.7 | -177.8 | 173.7 | 0 | 111.5 | I190 E191 M192 A198 | I190-K194 HydrophobicContact CG2-CD 4.15Å; I190-K194 WeakPolarHBondContact O-CB 3.45Å; I190-K194 WeakPolarHBondContact O-CG 3.49Å; I190-K194 PolarHBondContact O-N 3.48Å; E191-K194 WeakPolarHBondContact O-CB 3.44Å; E191-K194 PolarHBondContact O-N 2.85Å; M192-K194 VanDerWaalsContact C-N 3.31Å; M192-K194 PolarHBondContact O-N 3.27Å; K194-A198 VanDerWaalsContact O-CB 3.29Å; K194-A198 WeakPolarHBondContact O-CB 3.43Å; K194-A198 PolarHBondContact O-N 2.96Å |
| 195 | L | 76.8 | Confident | 76.3 | Confident | 81 Ų | 81 | 108.6 Ų | 108.6 | 42% | 0.424 | 53% | 0.532 | S | S | . | . | H | α-helix | trans | -67.5 | -40.1 | 177.9 | -70.5 | 175.3 | 0 | 0 | 0 | 111.9 | E191 M192 A198 K199 | E191-L195 WeakPolarHBondContact O-CG 3.38Å; E191-L195 PolarHBondContact O-N 3.43Å; M192-L195 PolarHBondContact O-N 3.25Å; M192-L195 VanDerWaalsContact O-N 3.15Å; L195-A198 PolarHBondContact O-N 3.45Å; L195-K199 WeakPolarHBondContact O-CB 3.38Å; L195-K199 WeakPolarHBondContact O-CG 3.34Å; L195-K199 PolarHBondContact O-N 3.48Å |
| 196 | E | 77.7 | Confident | 74.6 | Confident | 115 Ų | 115 | 110.6 Ų | 110.6 | 54% | 0.537 | 54% | 0.543 | S | S | . | . | H | α-helix | trans | -67.4 | -41.9 | 176.3 | -74.5 | -169.9 | 176.3 | 0 | 0 | 112.1 | M192 K199 K200 | M192-E196 WeakPolarHBondContact O-CG 3.38Å; M192-E196 PolarHBondContact O-N 3.4Å; E196-K199 PolarHBondContact O-N 3.32Å; E196-K200 VanDerWaalsContact O-CB 3.26Å; E196-K200 WeakPolarHBondContact O-CB 3.22Å; E196-K200 PolarHBondContact O-N 3.16Å |
| 197 | K | 76.8 | Confident | 73 | Confident | 135 Ų | 135 | 109.4 Ų | 109.4 | 59% | 0.587 | 55% | 0.547 | S | S | * | . | H | α-helix | trans | -62.4 | -44.9 | 174 | -170.3 | 177.6 | -179.9 | -177 | 0 | 111.2 | D193 K199 K200 E201 | D193-K197 VanDerWaalsContact O-CB 3.23Å; D193-K197 WeakPolarHBondContact O-CB 3.23Å; D193-K197 PolarHBondContact O-N 2.89Å; K197-K199 PolarHBondContact O-N 2.85Å; K197-K200 PolarHBondContact O-N 3.47Å; K197-E201 VanDerWaalsContact CE-OE1 3.31Å; K197-E201 WeakPolarHBondContact CE-OE1 3.35Å; K197-E201 WeakPolarHBondContact O-CB 3.43Å; K197-E201 WeakPolarHBondContact O-CG 3.24Å; K197-E201 PolarHBondContact O-N 2.89Å |
| 198 | A | 75.4 | Confident | 71.4 | Confident | 54 Ų | 54 | 115.6 Ų | 115.6 | 45% | 0.446 | 56% | 0.559 | S | S | . | * | H | α-helix | trans | -63.1 | -40.6 | 175.9 | 0 | 0 | 0 | 0 | 0 | 112.2 | K194 L195 R202 | K194-A198 VanDerWaalsContact O-CB 3.29Å; K194-A198 WeakPolarHBondContact O-CB 3.43Å; K194-A198 PolarHBondContact O-N 2.96Å; L195-A198 PolarHBondContact O-N 3.45Å; A198-R202 WeakPolarHBondContact O-CB 3.35Å; A198-R202 PolarHBondContact O-N 2.86Å |
| 199 | K | 74.4 | Confident | 69.8 | Low | 133 Ų | 133 | 115.8 Ų | 115.8 | 58% | 0.578 | 56% | 0.564 | S | S | * | * | H | α-helix | trans | -64 | -46.7 | 174.2 | -76.4 | 171 | -179.1 | 175.5 | 0 | 111.4 | L195 E196 K197 E201 R202 T203 | L195-K199 WeakPolarHBondContact O-CB 3.38Å; L195-K199 WeakPolarHBondContact O-CG 3.34Å; L195-K199 PolarHBondContact O-N 3.48Å; E196-K199 PolarHBondContact O-N 3.32Å; K197-K199 PolarHBondContact O-N 2.85Å; K199-E201 VanDerWaalsContact C-N 3.33Å; K199-E201 PolarHBondContact O-N 3.46Å; K199-R202 PolarHBondContact O-N 3.32Å; K199-T203 PolarHBondContact O-N 2.8Å; K199-T203 PolarHBondContact O-OG1 2.84Å |
| 200 | K | 72.8 | Confident | 68.3 | Low | 165 Ų | 165 | 114.9 Ų | 114.9 | 72% | 0.717 | 57% | 0.57 | S | S | * | * | H | α-helix | trans | -62.6 | -39.8 | 178.6 | -172.2 | 173 | -177.3 | 173.3 | 0 | 111.8 | E196 K197 K204 | E196-K200 VanDerWaalsContact O-CB 3.26Å; E196-K200 WeakPolarHBondContact O-CB 3.22Å; E196-K200 PolarHBondContact O-N 3.16Å; K197-K200 PolarHBondContact O-N 3.47Å; K200-K204 VanDerWaalsContact O-CB 3.24Å; K200-K204 WeakPolarHBondContact O-CB 3.45Å; K200-K204 PolarHBondContact O-N 3.15Å |
| 201 | E | 65.6 | Low | 66.5 | Low | 116 Ų | 116 | 115.6 Ų | 115.6 | 54% | 0.542 | 58% | 0.583 | S | S | . | * | H | α-helix | trans | -68.6 | -40.6 | 174.1 | -73.7 | -179.2 | -175.3 | 0 | 0 | 111.9 | K197 K199 K204 A205 | K197-E201 VanDerWaalsContact CE-OE1 3.31Å; K197-E201 WeakPolarHBondContact CE-OE1 3.35Å; K197-E201 WeakPolarHBondContact O-CB 3.43Å; K197-E201 WeakPolarHBondContact O-CG 3.24Å; K197-E201 PolarHBondContact O-N 2.89Å; K199-E201 VanDerWaalsContact C-N 3.33Å; K199-E201 PolarHBondContact O-N 3.46Å; E201-K204 PolarHBondContact O-N 3.03Å; E201-A205 WeakPolarHBondContact O-CB 3.48Å; E201-A205 PolarHBondContact O-N 3.45Å |
| 202 | R | 63.5 | Low | 65.1 | Low | 200 Ų | 200 | 114.1 Ų | 114.1 | 76% | 0.755 | 59% | 0.591 | S | S | * | * | H | α-helix | trans | -64.5 | -41.5 | 176.2 | -135.9 | -152.7 | -71.5 | -146 | 2.9 | 112.6 | A198 K199 A205 C206 | A198-R202 WeakPolarHBondContact O-CB 3.35Å; A198-R202 PolarHBondContact O-N 2.86Å; K199-R202 PolarHBondContact O-N 3.32Å; R202-A205 PolarHBondContact O-N 2.92Å; R202-C206 WeakPolarHBondContact O-CB 3.26Å; R202-C206 PolarHBondContact O-N 2.99Å |
| 203 | T | 64.6 | Low | 63.3 | Low | 89 Ų | 89 | 114.3 Ų | 114.3 | 55% | 0.546 | 61% | 0.607 | S | S | . | * | H | α-helix | trans | -68.5 | -39.4 | 176.8 | -53.5 | 0 | 0 | 0 | 0 | 111.2 | K199 A205 C206 C207 | K199-T203 PolarHBondContact O-N 2.8Å; K199-T203 PolarHBondContact O-OG1 2.84Å; T203-A205 PolarHBondContact O-N 3.36Å; T203-C206 PolarHBondContact O-N 3.28Å; T203-C207 PolarHBondContact O-N 3.05Å; T203-C207 PolarHBondContact O-SG 3.41Å |
| 204 | K | 68.9 | Low | 61.6 | Low | 144 Ų | 144 | 117.1 Ų | 117.1 | 63% | 0.626 | 63% | 0.629 | S | S | * | * | H | α-helix | trans | -66.6 | -34.3 | 175.7 | -172.1 | 176.7 | -179.1 | -179.8 | 0 | 112.9 | K200 E201 R208 | K200-K204 VanDerWaalsContact O-CB 3.24Å; K200-K204 WeakPolarHBondContact O-CB 3.45Å; K200-K204 PolarHBondContact O-N 3.15Å; E201-K204 PolarHBondContact O-N 3.03Å; K204-R208 PolarHBondContact O-N 3.49Å |
| 205 | A | 58 | Low | 59.9 | Low | 51 Ų | 51 | 113.7 Ų | 113.7 | 42% | 0.421 | 64% | 0.635 | S | S | . | * | H | α-helix | trans | -67.2 | -49.5 | 173 | 0 | 0 | 0 | 0 | 0 | 111.3 | E201 R202 T203 C207 R208 D209 | E201-A205 WeakPolarHBondContact O-CB 3.48Å; E201-A205 PolarHBondContact O-N 3.45Å; R202-A205 PolarHBondContact O-N 2.92Å; T203-A205 PolarHBondContact O-N 3.36Å; A205-C207 VanDerWaalsContact C-N 3.32Å; A205-C207 PolarHBondContact O-N 3.36Å; A205-R208 WeakPolarHBondContact O-CB 3.47Å; A205-R208 PolarHBondContact O-N 2.88Å; A205-D209 PolarHBondContact O-N 2.89Å |
| 206 | C | 48.1 | Very low | 57.9 | Low | 81 Ų | 81 | 117 Ų | 117 | 55% | 0.547 | 65% | 0.653 | S | S | . | * | H | α-helix | trans | -54.9 | -43.2 | 176.9 | -177.4 | 0 | 0 | 0 | 0 | 113 | R202 T203 R208 D209 V210 | R202-C206 WeakPolarHBondContact O-CB 3.26Å; R202-C206 PolarHBondContact O-N 2.99Å; T203-C206 PolarHBondContact O-N 3.28Å; C206-R208 VanDerWaalsContact C-N 3.31Å; C206-R208 PolarHBondContact O-N 3.22Å; C206-D209 PolarHBondContact O-N 3.46Å; C206-V210 WeakPolarHBondContact O-CG2 3.46Å |
| 207 | C | 48.8 | Very low | 56.5 | Low | 86 Ų | 86 | 122.9 Ų | 122.9 | 58% | 0.581 | 67% | 0.67 | S | S | * | * | H | α-helix | trans | -72.2 | -21.2 | 178.8 | -63.8 | 0 | 0 | 0 | 0 | 113.8 | T203 A205 | T203-C207 PolarHBondContact O-N 3.05Å; T203-C207 PolarHBondContact O-SG 3.41Å; A205-C207 VanDerWaalsContact C-N 3.32Å; A205-C207 PolarHBondContact O-N 3.36Å |
| 208 | R | 50.5 | Low | 54.6 | Low | 187 Ų | 187 | 121.8 Ų | 121.8 | 71% | 0.706 | 68% | 0.68 | S | S | * | * | H | α-helix | trans | -75.6 | -37.2 | 177.3 | -122.3 | 175.7 | 176.5 | 171.3 | -3.3 | 111.4 | K204 A205 C206 V210 S211 | K204-R208 PolarHBondContact O-N 3.49Å; A205-R208 WeakPolarHBondContact O-CB 3.47Å; A205-R208 PolarHBondContact O-N 2.88Å; C206-R208 VanDerWaalsContact C-N 3.31Å; C206-R208 PolarHBondContact O-N 3.22Å; R208-V210 PolarHBondContact O-N 2.96Å; R208-S211 PolarHBondContact O-N 3.08Å; R208-S211 PolarHBondContact O-OG 2.8Å |
| 209 | D | 50.6 | Low | 53 | Low | 136 Ų | 136 | 125.4 Ų | 125.4 | 73% | 0.727 | 70% | 0.7 | S | S | * | * | H | α-helix | trans | -73.9 | -11.7 | 179.7 | -63.7 | -49.5 | 0 | 0 | 0 | 113.6 | A205 C206 S211 | A205-D209 PolarHBondContact O-N 2.89Å; C206-D209 PolarHBondContact O-N 3.46Å; D209-S211 VanDerWaalsContact C-N 3.32Å; D209-S211 PolarHBondContact O-N 3.41Å |
| 210 | V | 53.3 | Low | 51.5 | Low | 121 Ų | 121 | 124.9 Ų | 124.9 | 73% | 0.733 | 71% | 0.71 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -85.7 | 2.1 | 177 | 173.1 | 0 | 0 | 0 | 0 | 113.1 | C206 R208 | C206-V210 WeakPolarHBondContact O-CG2 3.46Å; R208-V210 PolarHBondContact O-N 2.96Å |
| 211 | S | 47.4 | Very low | 50 | Low | 103 Ų | 103 | 121.6 Ų | 121.6 | 72% | 0.72 | 71% | 0.708 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -104.4 | 8 | -175.3 | 57.8 | 0 | 0 | 0 | 0 | 115.7 | R208 D209 | R208-S211 PolarHBondContact O-N 3.08Å; R208-S211 PolarHBondContact O-OG 2.8Å; D209-S211 VanDerWaalsContact C-N 3.32Å; D209-S211 PolarHBondContact O-N 3.41Å |
| 212 | A | 50.6 | Low | 49.1 | Very low | 86 Ų | 86 | 122.2 Ų | 122.2 | 71% | 0.711 | 72% | 0.722 | S | S | * | * | S | Bend | trans | -115.2 | 114.9 | 170 | 0 | 0 | 0 | 0 | 0 | 111.7 | ||
| 213 | A | 41.2 | Very low | 47.9 | Very low | 94 Ų | 94 | 119 Ų | 119 | 78% | 0.777 | 72% | 0.724 | S | S | * | * | trans | 89.4 | 121.6 | 168.1 | 0 | 0 | 0 | 0 | 0 | 118.5 | ||||
| 214 | P | 45.3 | Very low | 46.9 | Very low | 139 Ų | 139 | 125.8 Ų | 125.8 | 90% | 0.903 | 74% | 0.74 | S | S | * | * | trans | -83.8 | 117.5 | 157.5 | 33.1 | -24.9 | 0 | 0 | 0 | 108.6 | ||||
| 215 | G | 46.7 | Very low | 45.6 | Very low | 72 Ų | 72 | 123.1 Ų | 123.1 | 74% | 0.742 | 75% | 0.745 | S | S | * | * | trans | 164.9 | 114.9 | 172.8 | 0 | 0 | 0 | 0 | 0 | 114.4 | ||||
| 216 | D | 36.1 | Very low | 44.7 | Very low | 151 Ų | 151 | 123.9 Ų | 123.9 | 81% | 0.807 | 76% | 0.758 | S | S | * | * | trans | 66.2 | 97.9 | 161.9 | -79.9 | -35.9 | 0 | 0 | 0 | 121.4 | S218 | D216-S218 PolarHBondContact O-N 3.5Š| ||
| 217 | R | 47.9 | Very low | 44.6 | Very low | 237 Ų | 237 | 125.9 Ų | 125.9 | 89% | 0.894 | 77% | 0.767 | S | S | * | * | 11.2 | 102.5 | 123.7 | -62.9 | 176.9 | -177.8 | -114.5 | -0.6 | 116.1 | |||||
| 218 | S | 37.8 | Very low | 44.5 | Very low | 113 Ų | 113 | 126.5 Ų | 126.5 | 79% | 0.79 | 78% | 0.779 | S | S | * | * | -172.8 | 124.7 | 116.2 | 52.3 | 0 | 0 | 0 | 0 | 110.1 | D216 | D216-S218 PolarHBondContact O-N 3.5Š| |||
| 219 | C | 40.7 | Very low | 44.2 | Very low | 129 Ų | 129 | 121.9 Ų | 121.9 | 87% | 0.872 | 78% | 0.775 | S | S | * | * | P | Polyproline II helix | trans | -81.3 | 126.8 | 170.3 | -57.4 | 0 | 0 | 0 | 0 | 108.7 | ||
| 220 | P | 42.8 | Very low | 43.9 | Very low | 123 Ų | 123 | 120.4 Ų | 120.4 | 80% | 0.799 | 78% | 0.775 | S | S | * | * | P | Polyproline II helix | trans | -79 | 118 | 153.2 | 30.2 | -24.9 | 0 | 0 | 0 | 107.4 | ||
| 221 | S | 41.8 | Very low | 43.2 | Very low | 96 Ų | 96 | 125.9 Ų | 125.9 | 67% | 0.671 | 78% | 0.783 | S | S | * | * | P | Polyproline II helix | trans | -55.2 | 143.2 | 169.6 | 33.9 | 0 | 0 | 0 | 0 | 110.6 | V223 | S221-V223 PolarHBondContact O-N 3.31Š|
| 222 | P | 45.8 | Very low | 43.3 | Very low | 129 Ų | 129 | 126.9 Ų | 126.9 | 84% | 0.838 | 78% | 0.784 | S | S | * | * | trans | -70.9 | 107.2 | 171.7 | 28.5 | -28.9 | 0 | 0 | 0 | 107.6 | R224 | P222-R224 PolarHBondContact O-N 3.42Š| ||
| 223 | V | 39 | Very low | 43 | Very low | 132 Ų | 132 | 130.3 Ų | 130.3 | 80% | 0.8 | 79% | 0.79 | S | S | * | * | trans | -62.8 | 111.8 | 166.6 | 179.6 | 0 | 0 | 0 | 0 | 106.7 | S221 A225 | S221-V223 PolarHBondContact O-N 3.31Å; V223-A225 VanDerWaalsContact C-N 3.33Å; V223-A225 PolarHBondContact O-N 3.41Å | ||
| 224 | R | 43.5 | Very low | 43.4 | Very low | 232 Ų | 232 | 131.2 Ų | 131.2 | 88% | 0.875 | 79% | 0.791 | S | S | * | * | trans | -61.6 | 93.4 | 171.3 | -165.4 | 176.9 | 93.7 | -128.2 | 6.3 | 108 | P222 G226 | P222-R224 PolarHBondContact O-N 3.42Å; R224-G226 VanDerWaalsContact C-N 3.28Å; R224-G226 PolarHBondContact O-N 3.33Å | ||
| 225 | A | 41.9 | Very low | 43.5 | Very low | 87 Ų | 87 | 135.6 Ų | 135.6 | 72% | 0.719 | 81% | 0.805 | S | S | * | * | trans | -70.3 | 91.9 | 165.6 | 0 | 0 | 0 | 0 | 0 | 107.5 | V223 T227 | V223-A225 VanDerWaalsContact C-N 3.33Å; V223-A225 PolarHBondContact O-N 3.41Å; A225-T227 PolarHBondContact O-N 3Å; A225-T227 VanDerWaalsContact O-N 3.08Å | ||
| 226 | G | 39.7 | Very low | 43.3 | Very low | 68 Ų | 68 | 138.8 Ų | 138.8 | 70% | 0.701 | 81% | 0.808 | S | S | * | * | trans | -67.6 | 99.3 | 165.7 | 0 | 0 | 0 | 0 | 0 | 108.5 | R224 A228 | R224-G226 VanDerWaalsContact C-N 3.28Å; R224-G226 PolarHBondContact O-N 3.33Å; G226-A228 PolarHBondContact O-N 3.31Å; G226-A228 VanDerWaalsContact O-N 3.15Å | ||
| 227 | T | 45 | Very low | 43.7 | Very low | 122 Ų | 122 | 138.1 Ų | 138.1 | 75% | 0.748 | 81% | 0.808 | S | S | * | * | trans | -74 | 97.5 | 161.4 | 51.6 | 0 | 0 | 0 | 0 | 107.1 | A225 S229 | A225-T227 PolarHBondContact O-N 3Å; A225-T227 VanDerWaalsContact O-N 3.08Å; T227-S229 VanDerWaalsContact C-N 3.3Å; T227-S229 PolarHBondContact O-N 3.06Å | ||
| 228 | A | 45.9 | Very low | 43.5 | Very low | 100 Ų | 100 | 132.6 Ų | 132.6 | 83% | 0.826 | 80% | 0.804 | S | S | * | * | trans | -70.4 | 89.8 | 165.2 | 0 | 0 | 0 | 0 | 0 | 108.4 | G226 S230 | G226-A228 PolarHBondContact O-N 3.31Å; G226-A228 VanDerWaalsContact O-N 3.15Å; A228-S230 PolarHBondContact O-N 3.04Å | ||
| 229 | S | 45.6 | Very low | 43.8 | Very low | 90 Ų | 90 | 133.8 Ų | 133.8 | 63% | 0.629 | 80% | 0.804 | S | S | * | * | trans | -78.2 | 100.4 | 163.8 | -62.2 | 0 | 0 | 0 | 0 | 107.5 | T227 W231 | T227-S229 VanDerWaalsContact C-N 3.3Å; T227-S229 PolarHBondContact O-N 3.06Å; S229-W231 PolarHBondContact O-N 3.06Å; S229-W231 VanDerWaalsContact O-N 3.16Å | ||
| 230 | S | 44.3 | Very low | 44 | Very low | 104 Ų | 104 | 134.1 Ų | 134.1 | 73% | 0.727 | 80% | 0.8 | S | S | * | * | trans | -63.6 | 107.4 | 171.9 | -175.1 | 0 | 0 | 0 | 0 | 109.1 | A228 V232 | A228-S230 PolarHBondContact O-N 3.04Å; S230-V232 PolarHBondContact O-N 2.97Å | ||
| 231 | W | 38.6 | Very low | 44.1 | Very low | 237 Ų | 237 | 134.8 Ų | 134.8 | 90% | 0.898 | 80% | 0.8 | S | S | * | * | trans | -84.8 | 96.7 | 162.5 | -71.5 | 78 | 0 | 0 | 0 | 107 | S229 L233 | S229-W231 PolarHBondContact O-N 3.06Å; S229-W231 VanDerWaalsContact O-N 3.16Å; W231-L233 PolarHBondContact O-N 3.5Å | ||
| 232 | V | 49.2 | Very low | 44.3 | Very low | 123 Ų | 123 | 137.6 Ų | 137.6 | 75% | 0.745 | 81% | 0.81 | S | S | * | * | trans | -82.8 | 103.7 | 165.2 | -179.8 | 0 | 0 | 0 | 0 | 107 | S230 S234 | S230-V232 PolarHBondContact O-N 2.97Å; V232-S234 PolarHBondContact O-N 3.4Å | ||
| 233 | L | 43.9 | Very low | 44.2 | Very low | 159 Ų | 159 | 138.2 Ų | 138.2 | 83% | 0.832 | 81% | 0.807 | S | S | * | * | trans | -65 | 113.5 | 161 | -85.4 | 142.8 | 0 | 0 | 0 | 108.1 | W231 | W231-L233 PolarHBondContact O-N 3.5Š| ||
| 234 | S | 49.7 | Very low | 44.6 | Very low | 112 Ų | 112 | 138.8 Ų | 138.8 | 78% | 0.783 | 81% | 0.808 | S | S | * | * | trans | -95.7 | 116 | 159.7 | -153.9 | 0 | 0 | 0 | 0 | 107.7 | V232 | V232-S234 PolarHBondContact O-N 3.4Š| ||
| 235 | L | 47.8 | Very low | 44.7 | Very low | 231 Ų | 231 | 130.3 Ų | 130.3 | 100% | 1.209 | 80% | 0.802 | S | S | * | * | trans | -61.1 | 0 | 153.2 | -106.7 | 72.1 | 0 | 0 | 0 | 109.8 |
Retrieved 235 of 235 residues in 164 ms
(Link to these results)