| 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 | 44.5 | Very low | 31.9 | Very low | 222 Ų | 222 | 169.4 Ų | 169.4 | 100% | 1.094 | 85% | 0.845 | S | S | * | * | 0 | 102.4 | 0 | -81 | -158.1 | -168.8 | 0 | 0 | 112.1 | |||||
| 2 | Y | 28.4 | Very low | 32 | Very low | 221 Ų | 221 | 166.1 Ų | 166.1 | 87% | 0.867 | 84% | 0.841 | S | S | * | * | trans | -143.3 | 137.1 | 149.8 | -100.8 | -88.1 | 0 | 0 | 0 | 107 | ||||
| 3 | R | 30.6 | Very low | 32.1 | Very low | 235 Ų | 235 | 170.2 Ų | 170.2 | 89% | 0.887 | 84% | 0.84 | S | S | * | * | trans | -102.2 | 99.1 | -173.1 | -73.6 | -175.7 | 176.7 | 175.2 | 0.2 | 111.7 | ||||
| 4 | F | 30.1 | Very low | 31.9 | Very low | 192 Ų | 192 | 169.9 Ų | 169.9 | 84% | 0.842 | 84% | 0.843 | S | S | * | * | trans | -82.2 | 116 | 163.3 | -85.6 | -82.4 | 0 | 0 | 0 | 110.6 | ||||
| 5 | L | 33.8 | Very low | 31.6 | Very low | 149 Ų | 149 | 170.3 Ų | 170.3 | 78% | 0.78 | 84% | 0.841 | S | S | * | * | trans | -100.8 | 82.7 | 179.4 | -93.6 | 159.9 | 0 | 0 | 0 | 110.2 | R7 | L5-R7 VanDerWaalsContact C-N 3.34Å; L5-R7 PolarHBondContact O-N 2.78Å | ||
| 6 | S | 29 | Very low | 31.5 | Very low | 115 Ų | 115 | 167.1 Ų | 167.1 | 80% | 0.804 | 84% | 0.841 | S | S | * | * | trans | -69 | 84 | 177.8 | -58.4 | 0 | 0 | 0 | 0 | 112 | T8 | S6-T8 PolarHBondContact O-N 3.36Š| ||
| 7 | R | 29.9 | Very low | 31.6 | Very low | 221 Ų | 221 | 167.5 Ų | 167.5 | 83% | 0.834 | 85% | 0.845 | S | S | * | * | trans | -81.4 | 101.3 | 168.9 | -80.2 | -173.2 | 171 | -174.2 | -0.8 | 110.5 | L5 V9 | L5-R7 VanDerWaalsContact C-N 3.34Å; L5-R7 PolarHBondContact O-N 2.78Å; R7-V9 HydrophobicContact CB-CG2 4.48Å; R7-V9 PolarHBondContact O-N 3.43Å | ||
| 8 | T | 31.3 | Very low | 31.3 | Very low | 140 Ų | 140 | 164.8 Ų | 164.8 | 86% | 0.859 | 84% | 0.842 | S | S | * | * | trans | -67.8 | 125.6 | 160.9 | 37.4 | 0 | 0 | 0 | 0 | 109.8 | S6 | S6-T8 PolarHBondContact O-N 3.36Š| ||
| 9 | V | 30.2 | Very low | 31.2 | Very low | 108 Ų | 108 | 162.8 Ų | 162.8 | 66% | 0.655 | 84% | 0.839 | S | S | * | * | trans | -125.5 | 108.2 | 176.9 | -177.2 | 0 | 0 | 0 | 0 | 109.1 | R7 V11 | R7-V9 HydrophobicContact CB-CG2 4.48Å; R7-V9 PolarHBondContact O-N 3.43Å; V9-V11 HydrophobicContact CG1-CG2 3.92Å; V9-V11 PolarHBondContact O-N 3.18Å; V9-V11 VanDerWaalsContact O-N 3.09Å | ||
| 10 | C | 31.4 | Very low | 31.1 | Very low | 134 Ų | 134 | 165.4 Ų | 165.4 | 91% | 0.905 | 84% | 0.839 | S | S | * | * | trans | -73.4 | 97.2 | 173.2 | -61.5 | 0 | 0 | 0 | 0 | 109.8 | ||||
| 11 | V | 31.7 | Very low | 30.9 | Very low | 126 Ų | 126 | 165 Ų | 165 | 76% | 0.764 | 83% | 0.834 | S | S | * | * | P | Polyproline II helix | trans | -88 | 116.8 | 176.7 | -178.6 | 0 | 0 | 0 | 0 | 110.1 | V9 | V9-V11 HydrophobicContact CG1-CG2 3.92Å; V9-V11 PolarHBondContact O-N 3.18Å; V9-V11 VanDerWaalsContact O-N 3.09Å |
| 12 | T | 33.4 | Very low | 30.1 | Very low | 130 Ų | 130 | 157.7 Ų | 157.7 | 80% | 0.798 | 82% | 0.816 | S | S | * | * | P | Polyproline II helix | trans | -72.4 | 143 | 171.8 | 41.4 | 0 | 0 | 0 | 0 | 111.3 | ||
| 13 | R | 32.5 | Very low | 30.1 | Very low | 220 Ų | 220 | 154.4 Ų | 154.4 | 83% | 0.83 | 81% | 0.808 | S | S | * | * | P | Polyproline II helix | trans | -59.3 | 136 | 175 | -82.1 | 174.5 | 161.5 | 157.7 | -5.9 | 111.3 | ||
| 14 | N | 29.3 | Very low | 30 | Very low | 166 Ų | 166 | 149.7 Ų | 149.7 | 89% | 0.888 | 81% | 0.805 | S | S | * | * | trans | -157.2 | 133.8 | 130 | -94.4 | -37.6 | 0 | 0 | 0 | 109.6 | ||||
| 15 | H | 27.4 | Very low | 29.9 | Very low | 176 Ų | 176 | 149.6 Ų | 149.6 | 82% | 0.815 | 80% | 0.804 | S | S | * | * | trans | -95.3 | 137.2 | 176.7 | -78.7 | -95.9 | 0 | 0 | 0 | 110.4 | ||||
| 16 | S | 30.6 | Very low | 29.6 | Very low | 119 Ų | 119 | 147.8 Ų | 147.8 | 83% | 0.832 | 80% | 0.804 | S | S | * | * | trans | -125.3 | 138.4 | 152.9 | 55.4 | 0 | 0 | 0 | 0 | 108.4 | ||||
| 17 | L | 32.8 | Very low | 29.6 | Very low | 173 Ų | 173 | 146.2 Ų | 146.2 | 91% | 0.906 | 80% | 0.798 | S | S | * | * | trans | -86.1 | 116.1 | -177.6 | -77.9 | 146.7 | 0 | 0 | 0 | 109.3 | ||||
| 18 | C | 27.5 | Very low | 29.6 | Very low | 119 Ų | 119 | 145 Ų | 145 | 80% | 0.804 | 80% | 0.799 | S | S | * | * | trans | -98.6 | 114.6 | 162.4 | -168.3 | 0 | 0 | 0 | 0 | 108.4 | ||||
| 19 | V | 29.6 | Very low | 29.4 | Very low | 128 Ų | 128 | 148.6 Ų | 148.6 | 78% | 0.776 | 80% | 0.798 | S | S | * | * | trans | -83.4 | 121.9 | 170.9 | 176.5 | 0 | 0 | 0 | 0 | 107.4 | ||||
| 20 | Y | 27.9 | Very low | 29.3 | Very low | 214 Ų | 214 | 150.9 Ų | 150.9 | 84% | 0.839 | 81% | 0.807 | S | S | * | * | trans | -93.2 | 123 | 173.6 | -160.3 | -94.9 | 0 | 0 | 0 | 110 | ||||
| 21 | E | 26.6 | Very low | 29.2 | Very low | 157 Ų | 157 | 151.9 Ų | 151.9 | 73% | 0.734 | 80% | 0.803 | S | S | * | * | trans | -94.3 | 110.6 | -174.7 | -171.6 | 166.2 | -134.9 | 0 | 0 | 110.4 | H23 | E21-H23 PolarHBondContact O-N 3.21Å; E21-H23 VanDerWaalsContact O-N 3.17Å | ||
| 22 | G | 28.8 | Very low | 29.1 | Very low | 69 Ų | 69 | 151.4 Ų | 151.4 | 71% | 0.711 | 80% | 0.801 | S | S | * | * | trans | -70.1 | 109.3 | -172.2 | 0 | 0 | 0 | 0 | 0 | 113.3 | ||||
| 23 | H | 27.3 | Very low | 29 | Very low | 152 Ų | 152 | 150.9 Ų | 150.9 | 70% | 0.704 | 80% | 0.802 | S | S | * | * | trans | -92.2 | 112.9 | 167 | -87.9 | 58.5 | 0 | 0 | 0 | 110.9 | E21 | E21-H23 PolarHBondContact O-N 3.21Å; E21-H23 VanDerWaalsContact O-N 3.17Å | ||
| 24 | V | 29.3 | Very low | 28.9 | Very low | 136 Ų | 136 | 151.1 Ų | 151.1 | 82% | 0.824 | 80% | 0.803 | S | S | * | * | trans | -79.9 | 121.6 | 170 | 176.2 | 0 | 0 | 0 | 0 | 108.8 | ||||
| 25 | F | 28.1 | Very low | 28.8 | Very low | 190 Ų | 190 | 149.7 Ų | 149.7 | 83% | 0.833 | 80% | 0.8 | S | S | * | * | trans | -121.7 | 133.5 | 159.7 | -95.6 | -81.7 | 0 | 0 | 0 | 110.3 | ||||
| 26 | S | 27.8 | Very low | 28.9 | Very low | 111 Ų | 111 | 149.1 Ų | 149.1 | 78% | 0.776 | 80% | 0.802 | S | S | * | * | trans | -111 | 129.7 | 178.9 | 173.9 | 0 | 0 | 0 | 0 | 109.3 | ||||
| 27 | A | 28.3 | Very low | 28.8 | Very low | 82 Ų | 82 | 149.4 Ų | 149.4 | 68% | 0.678 | 80% | 0.799 | S | S | * | * | trans | -174.2 | 122.8 | 141.2 | 0 | 0 | 0 | 0 | 0 | 112.7 | ||||
| 28 | K | 29.2 | Very low | 28.6 | Very low | 196 Ų | 196 | 144.5 Ų | 144.5 | 85% | 0.852 | 79% | 0.79 | S | S | * | * | trans | 60.1 | 129.8 | 133 | -59.9 | 175.9 | 179.6 | -179.4 | 0 | 120.5 | ||||
| 29 | Y | 28 | Very low | 28.6 | Very low | 214 Ų | 214 | 145.8 Ų | 145.8 | 84% | 0.839 | 79% | 0.794 | S | S | * | * | trans | -63.4 | 151.3 | 155.6 | -71.6 | -106.8 | 0 | 0 | 0 | 111 | ||||
| 30 | D | 27 | Very low | 28.8 | Very low | 157 Ų | 157 | 143.1 Ų | 143.1 | 84% | 0.84 | 79% | 0.792 | S | S | * | * | trans | -145.9 | 133.3 | 144.2 | -103.7 | -42.8 | 0 | 0 | 0 | 109.4 | ||||
| 31 | N | 31.2 | Very low | 29.1 | Very low | 154 Ų | 154 | 139.3 Ų | 139.3 | 82% | 0.824 | 79% | 0.791 | S | S | * | * | trans | -93.5 | 110.4 | -179.7 | -77.6 | -32.7 | 0 | 0 | 0 | 110 | ||||
| 32 | V | 28.8 | Very low | 29.4 | Very low | 117 Ų | 117 | 138.9 Ų | 138.9 | 71% | 0.709 | 79% | 0.794 | S | S | * | * | trans | -130.9 | 103.5 | 170 | -177 | 0 | 0 | 0 | 0 | 110.2 | R34 | V32-R34 HydrophobicContact CG1-CG 4.45Š| ||
| 33 | S | 30.5 | Very low | 29.7 | Very low | 119 Ų | 119 | 141.3 Ų | 141.3 | 83% | 0.832 | 80% | 0.797 | S | S | * | * | trans | -74.7 | 130.5 | 168.6 | 44.8 | 0 | 0 | 0 | 0 | 110.6 | ||||
| 34 | R | 30.5 | Very low | 29.8 | Very low | 224 Ų | 224 | 141.8 Ų | 141.8 | 85% | 0.845 | 80% | 0.804 | S | S | * | * | trans | -135 | 116.3 | 160.6 | -72.6 | -167.6 | -174.9 | -164.3 | 2.4 | 109.8 | V32 | V32-R34 HydrophobicContact CG1-CG 4.45Š| ||
| 35 | V | 27.8 | Very low | 29.8 | Very low | 137 Ų | 137 | 140.1 Ų | 140.1 | 83% | 0.83 | 80% | 0.798 | S | S | * | * | trans | -69.3 | 132.7 | 163.8 | 176.3 | 0 | 0 | 0 | 0 | 107.9 | T37 | V35-T37 HydrophobicContact CG1-CG2 4.48Š| ||
| 36 | L | 29 | Very low | 30 | Very low | 163 Ų | 163 | 137.9 Ų | 137.9 | 85% | 0.853 | 80% | 0.8 | S | S | * | * | trans | -142.6 | 134.7 | 166 | -128.8 | 161.2 | 0 | 0 | 0 | 108 | ||||
| 37 | T | 29.1 | Very low | 30 | Very low | 125 Ų | 125 | 137.5 Ų | 137.5 | 77% | 0.767 | 80% | 0.797 | S | S | * | * | trans | -102.1 | 142 | -162.9 | 42 | 0 | 0 | 0 | 0 | 113.1 | V35 | V35-T37 HydrophobicContact CG1-CG2 4.48Š| ||
| 38 | G | 27.9 | Very low | 30 | Very low | 70 Ų | 70 | 139.5 Ų | 139.5 | 72% | 0.722 | 81% | 0.806 | S | S | * | * | trans | 110 | 157.1 | 155 | 0 | 0 | 0 | 0 | 0 | 116.8 | ||||
| 39 | V | 28.8 | Very low | 30.1 | Very low | 147 Ų | 147 | 136 Ų | 136 | 89% | 0.891 | 80% | 0.8 | S | S | * | * | trans | 63.8 | 97 | 177.6 | -166.6 | 0 | 0 | 0 | 0 | 114.5 | ||||
| 40 | G | 32.6 | Very low | 30.2 | Very low | 71 Ų | 71 | 137 Ų | 137 | 73% | 0.732 | 80% | 0.802 | S | S | * | * | trans | -84.5 | 152.5 | 175.2 | 0 | 0 | 0 | 0 | 0 | 113.7 | ||||
| 41 | V | 34.6 | Very low | 30.3 | Very low | 134 Ų | 134 | 135.4 Ų | 135.4 | 81% | 0.812 | 80% | 0.802 | S | S | * | * | trans | -134.5 | 123.4 | 168.5 | -178 | 0 | 0 | 0 | 0 | 107.3 | P43 | V41-P43 VanDerWaalsContact O-CD 3.31Å; V41-P43 WeakPolarHBondContact O-CD 3.46Å | ||
| 42 | N | 32.6 | Very low | 30.2 | Very low | 149 Ų | 149 | 133.5 Ų | 133.5 | 80% | 0.797 | 80% | 0.8 | S | S | * | * | trans | -83.3 | 119 | -174 | -66.3 | -9.1 | 0 | 0 | 0 | 111.3 | ||||
| 43 | P | 34.8 | Very low | 30.2 | Very low | 120 Ų | 120 | 136.5 Ų | 136.5 | 78% | 0.779 | 81% | 0.806 | S | S | * | * | trans | -76.1 | 122.7 | 163.8 | 31.2 | -31.4 | 0 | 0 | 0 | 109.6 | V41 S45 | V41-P43 VanDerWaalsContact O-CD 3.31Å; V41-P43 WeakPolarHBondContact O-CD 3.46Å; P43-S45 PolarHBondContact O-N 3.35Å | ||
| 44 | L | 29.2 | Very low | 30.2 | Very low | 162 Ų | 162 | 139.8 Ų | 139.8 | 85% | 0.848 | 81% | 0.805 | S | S | * | * | trans | -74.1 | 95.5 | 175.5 | -78.3 | 165.7 | 0 | 0 | 0 | 110.4 | ||||
| 45 | S | 29.6 | Very low | 30.2 | Very low | 101 Ų | 101 | 138.1 Ų | 138.1 | 71% | 0.706 | 80% | 0.804 | S | S | * | * | trans | -81.9 | 119 | 170.5 | -172.1 | 0 | 0 | 0 | 0 | 110.6 | P43 C47 | P43-S45 PolarHBondContact O-N 3.35Å; S45-C47 PolarHBondContact O-N 3.16Å | ||
| 46 | T | 32.8 | Very low | 30.3 | Very low | 142 Ų | 142 | 138.3 Ų | 138.3 | 87% | 0.871 | 80% | 0.801 | S | S | * | * | trans | -92.9 | 79.6 | 179.2 | 54.8 | 0 | 0 | 0 | 0 | 111.4 | ||||
| 47 | C | 28.5 | Very low | 30.3 | Very low | 104 Ų | 104 | 138.3 Ų | 138.3 | 70% | 0.703 | 80% | 0.801 | S | S | * | * | P | Polyproline II helix | trans | -91.4 | 135.4 | 164.4 | -64.1 | 0 | 0 | 0 | 0 | 109.6 | S45 | S45-C47 PolarHBondContact O-N 3.16Š|
| 48 | S | 28.6 | Very low | 30.3 | Very low | 124 Ų | 124 | 137 Ų | 137 | 87% | 0.867 | 80% | 0.804 | S | S | * | * | P | Polyproline II helix | trans | -72.9 | 130.2 | -179 | -169.1 | 0 | 0 | 0 | 0 | 111.3 | ||
| 49 | V | 29.5 | Very low | 30.3 | Very low | 122 Ų | 122 | 141.4 Ų | 141.4 | 74% | 0.739 | 81% | 0.809 | S | S | * | * | P | Polyproline II helix | trans | -87 | 116.7 | 177.7 | 177 | 0 | 0 | 0 | 0 | 109.2 | ||
| 50 | R | 31.7 | Very low | 30.6 | Very low | 234 Ų | 234 | 140 Ų | 140 | 88% | 0.883 | 80% | 0.803 | S | S | * | * | P | Polyproline II helix | trans | -78.4 | 119.5 | 160.4 | -74.3 | -176.6 | 175.8 | 171.6 | -0.9 | 108.3 | C52 | R50-C52 PolarHBondContact O-N 2.78Š|
| 51 | C | 27.6 | Very low | 30.4 | Very low | 124 Ų | 124 | 141.2 Ų | 141.2 | 84% | 0.838 | 80% | 0.8 | S | S | * | * | P | Polyproline II helix | trans | -74.5 | 121.7 | 170.7 | -63.7 | 0 | 0 | 0 | 0 | 109.5 | ||
| 52 | C | 29.8 | Very low | 30.1 | Very low | 114 Ų | 114 | 142.6 Ų | 142.6 | 77% | 0.77 | 80% | 0.803 | S | S | * | * | trans | -108.3 | 126.8 | 167.4 | -64.8 | 0 | 0 | 0 | 0 | 108.5 | R50 K54 | R50-C52 PolarHBondContact O-N 2.78Å; C52-K54 PolarHBondContact O-N 2.93Å | ||
| 53 | E | 29.4 | Very low | 30 | Very low | 181 Ų | 181 | 143.3 Ų | 143.3 | 85% | 0.846 | 80% | 0.801 | S | S | * | * | trans | -64.2 | 132.6 | 176.5 | -61.4 | -173.5 | 142.2 | 0 | 0 | 110.7 | ||||
| 54 | K | 29.9 | Very low | 29.8 | Very low | 187 Ų | 187 | 144.2 Ų | 144.2 | 81% | 0.813 | 80% | 0.799 | S | S | * | * | trans | -94.7 | 122.1 | 163.5 | -73.7 | -175 | 174.8 | -175.6 | 0 | 108.7 | C52 | C52-K54 PolarHBondContact O-N 2.93Š| ||
| 55 | K | 30 | Very low | 29.8 | Very low | 190 Ų | 190 | 145.2 Ų | 145.2 | 83% | 0.826 | 80% | 0.8 | S | S | * | * | trans | -93.7 | 107.7 | 157.9 | -73.8 | -179.7 | 179.2 | 173.2 | 0 | 107.4 | ||||
| 56 | D | 30.8 | Very low | 29.7 | Very low | 140 Ų | 140 | 144.6 Ų | 144.6 | 75% | 0.749 | 80% | 0.801 | S | S | * | * | trans | -67.9 | 136.6 | 170.9 | -63.1 | -50.7 | 0 | 0 | 0 | 109.7 | ||||
| 57 | N | 28.9 | Very low | 29.3 | Very low | 163 Ų | 163 | 144.2 Ų | 144.2 | 87% | 0.872 | 80% | 0.798 | S | S | * | * | trans | -145.8 | 116.2 | 159 | -101.2 | -36.6 | 0 | 0 | 0 | 107.5 | ||||
| 58 | A | 27.8 | Very low | 29.2 | Very low | 98 Ų | 98 | 146.5 Ų | 146.5 | 81% | 0.81 | 80% | 0.804 | S | S | * | * | P | Polyproline II helix | trans | -83.6 | 140.6 | -174.4 | 0 | 0 | 0 | 0 | 0 | 111.5 | P60 | A58-P60 WeakPolarHBondContact O-CD 3.29Š|
| 59 | I | 29.1 | Very low | 29.2 | Very low | 163 Ų | 163 | 145.6 Ų | 145.6 | 84% | 0.836 | 79% | 0.793 | S | S | * | * | P | Polyproline II helix | trans | -90.1 | 125.3 | 169 | -59.7 | 169.2 | 0 | 0 | 0 | 108.6 | ||
| 60 | P | 35.3 | Very low | 29.1 | Very low | 117 Ų | 117 | 146.8 Ų | 146.8 | 76% | 0.76 | 80% | 0.795 | S | S | * | * | P | Polyproline II helix | trans | -93.3 | 128.3 | 153 | 33.1 | -26.9 | 0 | 0 | 0 | 110.1 | A58 | A58-P60 WeakPolarHBondContact O-CD 3.29Š|
| 61 | S | 27.8 | Very low | 28.9 | Very low | 96 Ų | 96 | 141.4 Ų | 141.4 | 67% | 0.671 | 79% | 0.788 | S | S | * | * | P | Polyproline II helix | trans | -80.5 | 148.2 | 165.6 | -178 | 0 | 0 | 0 | 0 | 110.2 | ||
| 62 | N | 27.6 | Very low | 29 | Very low | 164 Ų | 164 | 144 Ų | 144 | 88% | 0.877 | 79% | 0.788 | S | S | * | * | trans | -163.7 | 161.4 | 140.4 | -93.1 | -28.6 | 0 | 0 | 0 | 109.6 | ||||
| 63 | Q | 31.8 | Very low | 29 | Very low | 164 Ų | 164 | 143 Ų | 143 | 77% | 0.766 | 79% | 0.788 | S | S | * | * | trans | -110.7 | 171.4 | -175.1 | -58.5 | 179.8 | -114.5 | 0 | 0 | 112.5 | ||||
| 64 | D | 29.7 | Very low | 29 | Very low | 138 Ų | 138 | 143.4 Ų | 143.4 | 74% | 0.738 | 79% | 0.787 | S | S | * | * | trans | 112.1 | 127.5 | 142.7 | -58.8 | -32 | 0 | 0 | 0 | 121.1 | ||||
| 65 | E | 29.2 | Very low | 28.9 | Very low | 184 Ų | 184 | 141 Ų | 141 | 86% | 0.86 | 78% | 0.781 | S | S | * | * | trans | 49.8 | 99 | 149.6 | -58 | -161.2 | 132 | 0 | 0 | 123.8 | ||||
| 66 | A | 26.8 | Very low | 28.8 | Very low | 88 Ų | 88 | 137.9 Ų | 137.9 | 73% | 0.727 | 78% | 0.779 | S | S | * | * | 85.3 | 158.9 | 109.7 | 0 | 0 | 0 | 0 | 0 | 123.5 | |||||
| 67 | T | 26.2 | Very low | 28.6 | Very low | 133 Ų | 133 | 138.8 Ų | 138.8 | 82% | 0.816 | 78% | 0.779 | S | S | * | * | trans | 76.6 | 89.7 | 163.2 | 52.5 | 0 | 0 | 0 | 0 | 122.6 | ||||
| 68 | N | 25 | Very low | 28.6 | Very low | 153 Ų | 153 | 139.4 Ų | 139.4 | 82% | 0.818 | 78% | 0.781 | S | S | * | * | 72.9 | 153 | 107.8 | -150.8 | 16.5 | 0 | 0 | 0 | 123 | |||||
| 69 | V | 29.6 | Very low | 28.5 | Very low | 105 Ų | 105 | 141.9 Ų | 141.9 | 64% | 0.636 | 78% | 0.776 | S | S | * | * | trans | 85.2 | 95.5 | 161.1 | -168.1 | 0 | 0 | 0 | 0 | 121 | ||||
| 70 | D | 27.9 | Very low | 28.4 | Very low | 147 Ų | 147 | 142.4 Ų | 142.4 | 79% | 0.786 | 78% | 0.775 | S | S | * | * | 60.4 | 163.1 | 128.4 | -66 | -35.9 | 0 | 0 | 0 | 127.1 | |||||
| 71 | T | 27.8 | Very low | 28 | Very low | 121 Ų | 121 | 144.3 Ų | 144.3 | 74% | 0.742 | 77% | 0.773 | S | S | * | * | trans | 92.2 | 89.8 | 155.2 | 34.9 | 0 | 0 | 0 | 0 | 122.9 | ||||
| 72 | Q | 29 | Very low | 27.8 | Very low | 179 Ų | 179 | 145.6 Ų | 145.6 | 84% | 0.836 | 78% | 0.778 | S | S | * | * | 65.7 | 110.4 | 116.3 | -74.5 | -171.1 | -5.1 | 0 | 0 | 123.4 | |||||
| 73 | A | 29 | Very low | 27.7 | Very low | 93 Ų | 93 | 147.1 Ų | 147.1 | 77% | 0.769 | 78% | 0.779 | S | S | * | * | 95.8 | 160.5 | 107.5 | 0 | 0 | 0 | 0 | 0 | 123 | |||||
| 74 | K | 29.6 | Very low | 27.4 | Very low | 188 Ų | 188 | 147.9 Ų | 147.9 | 82% | 0.817 | 78% | 0.783 | S | S | * | * | trans | 80.5 | 100 | 167.5 | -121.4 | 160.7 | -175.2 | 175.1 | 0 | 116.5 | ||||
| 75 | I | 28.3 | Very low | 27.3 | Very low | 136 Ų | 136 | 148.8 Ų | 148.8 | 70% | 0.697 | 79% | 0.793 | S | S | * | * | 70.5 | 120.4 | 68.4 | -61.7 | 164.6 | 0 | 0 | 0 | 113.4 | |||||
| 76 | T | 28.1 | Very low | 27.2 | Very low | 126 Ų | 126 | 149.1 Ų | 149.1 | 77% | 0.773 | 79% | 0.792 | S | S | * | * | trans | 163.5 | 91.9 | 137.5 | -66.4 | 0 | 0 | 0 | 0 | 106.7 | ||||
| 77 | Q | 27.1 | Very low | 27.2 | Very low | 159 Ų | 159 | 149.3 Ų | 149.3 | 74% | 0.743 | 79% | 0.793 | S | S | * | * | 48.8 | 114 | 85.6 | -78.7 | -171.9 | -41.3 | 0 | 0 | 115.4 | |||||
| 78 | L | 28.2 | Very low | 27.2 | Very low | 175 Ų | 175 | 149.2 Ų | 149.2 | 92% | 0.916 | 79% | 0.792 | S | S | * | * | trans | -146.9 | 120.4 | 135.1 | -104.1 | 175.3 | 0 | 0 | 0 | 108.4 | ||||
| 79 | Q | 25.1 | Very low | 27.4 | Very low | 151 Ų | 151 | 149 Ų | 149 | 71% | 0.706 | 79% | 0.791 | S | S | * | * | trans | -103.2 | 149.7 | 161.5 | -76.1 | 169 | -114.1 | 0 | 0 | 107.6 | ||||
| 80 | E | 27.1 | Very low | 27.2 | Very low | 173 Ų | 173 | 155.7 Ų | 155.7 | 81% | 0.808 | 81% | 0.805 | S | S | * | * | trans | -169.9 | 109.8 | 133.7 | -101.6 | 157.5 | -158.2 | 0 | 0 | 105.5 | ||||
| 81 | E | 27.4 | Very low | 27.2 | Very low | 157 Ų | 157 | 156.2 Ų | 156.2 | 73% | 0.734 | 81% | 0.808 | S | S | * | * | 71.5 | 98 | 93.9 | -71.5 | -167.6 | 173.8 | 0 | 0 | 111.7 | |||||
| 82 | T | 22.9 | Very low | 27.4 | Very low | 124 Ų | 124 | 156.5 Ų | 156.5 | 76% | 0.761 | 82% | 0.815 | S | S | * | * | 62 | 125.4 | 81.3 | 61.5 | 0 | 0 | 0 | 0 | 115.3 | |||||
| 83 | E | 25.6 | Very low | 27.7 | Very low | 195 Ų | 195 | 156.2 Ų | 156.2 | 91% | 0.911 | 82% | 0.816 | S | S | * | * | -157.1 | 161.7 | 121.9 | -119.1 | -177.2 | 176.3 | 0 | 0 | 112.7 | |||||
| 84 | Q | 26.6 | Very low | 27.8 | Very low | 181 Ų | 181 | 160 Ų | 160 | 85% | 0.846 | 82% | 0.817 | S | S | * | * | trans | -118.9 | 144 | -177.8 | -54.4 | 172.3 | 9.9 | 0 | 0 | 110.5 | ||||
| 85 | V | 27.1 | Very low | 27.9 | Very low | 156 Ų | 156 | 159.6 Ų | 159.6 | 95% | 0.945 | 82% | 0.818 | S | S | * | * | trans | -138.4 | 153.8 | 154.2 | -173.5 | 0 | 0 | 0 | 0 | 109.4 | ||||
| 86 | K | 26.2 | Very low | 28 | Very low | 192 Ų | 192 | 161 Ų | 161 | 84% | 0.835 | 82% | 0.822 | S | S | * | * | trans | -141 | 145.9 | -156.6 | -175.7 | -177.6 | -176.6 | 177.8 | 0 | 112.5 | ||||
| 87 | A | 27.8 | Very low | 28.1 | Very low | 92 Ų | 92 | 160.2 Ų | 160.2 | 76% | 0.76 | 82% | 0.821 | S | S | * | * | trans | 66.6 | 166.6 | 171.6 | 0 | 0 | 0 | 0 | 0 | 115.3 | ||||
| 88 | T | 26.5 | Very low | 28.2 | Very low | 130 Ų | 130 | 159.5 Ų | 159.5 | 80% | 0.798 | 82% | 0.823 | S | S | * | * | cis | -139.6 | 174.7 | 15.3 | 49.9 | 0 | 0 | 0 | 0 | 113.2 | ||||
| 89 | D | 28.3 | Very low | 28.3 | Very low | 148 Ų | 148 | 156.3 Ų | 156.3 | 79% | 0.791 | 81% | 0.81 | S | S | * | * | trans | -68 | 159 | -173.7 | -40 | -95 | 0 | 0 | 0 | 117.1 | ||||
| 90 | R | 26.3 | Very low | 28.6 | Very low | 247 Ų | 247 | 158.1 Ų | 158.1 | 93% | 0.932 | 82% | 0.816 | S | S | * | * | trans | -170.3 | 136.7 | 138.8 | -112 | 176.3 | -174.6 | 114.7 | 1.9 | 114.1 | ||||
| 91 | D | 28.4 | Very low | 28.7 | Very low | 157 Ų | 157 | 155.2 Ų | 155.2 | 84% | 0.84 | 81% | 0.809 | S | S | * | * | trans | -70.8 | 152.4 | 166.8 | -70.1 | -62.8 | 0 | 0 | 0 | 113.2 | ||||
| 92 | S | 30.2 | Very low | 28.9 | Very low | 127 Ų | 127 | 154.9 Ų | 154.9 | 89% | 0.888 | 81% | 0.808 | S | S | * | * | trans | -165.7 | 145.5 | 141 | -84 | 0 | 0 | 0 | 0 | 112.4 | ||||
| 93 | M | 35.2 | Very low | 29.4 | Very low | 174 Ų | 174 | 155.7 Ų | 155.7 | 86% | 0.857 | 80% | 0.803 | S | S | * | * | trans | -85.9 | 155.8 | 177.7 | -57.3 | -177.3 | 74.3 | 0 | 0 | 112.4 | ||||
| 94 | Q | 32.4 | Very low | 29.5 | Very low | 172 Ų | 172 | 154.7 Ų | 154.7 | 80% | 0.804 | 80% | 0.796 | S | S | * | * | trans | -133.8 | 131.5 | 153.3 | -78 | -172.1 | -24.3 | 0 | 0 | 111.7 | ||||
| 95 | Q | 31.6 | Very low | 29.7 | Very low | 179 Ų | 179 | 152.2 Ų | 152.2 | 84% | 0.836 | 79% | 0.788 | S | S | * | * | trans | -96.1 | 152.3 | 160 | -66.3 | 178 | -24.1 | 0 | 0 | 108.3 | ||||
| 96 | H | 31.1 | Very low | 29.9 | Very low | 167 Ų | 167 | 150.4 Ų | 150.4 | 77% | 0.773 | 78% | 0.782 | S | S | * | * | trans | -131.5 | 133.2 | 164.8 | -92.1 | -82.8 | 0 | 0 | 0 | 114.1 | ||||
| 97 | S | 29.2 | Very low | 30.1 | Very low | 109 Ų | 109 | 150.8 Ų | 150.8 | 76% | 0.762 | 78% | 0.784 | S | S | * | * | trans | -90.5 | 170.1 | 177.5 | 33.3 | 0 | 0 | 0 | 0 | 110.6 | ||||
| 98 | N | 29.3 | Very low | 30.1 | Very low | 144 Ų | 144 | 151.5 Ų | 151.5 | 77% | 0.77 | 78% | 0.783 | S | S | * | * | cis | 177.8 | -175.2 | -8.3 | 171.6 | 26.8 | 0 | 0 | 0 | 107.7 | ||||
| 99 | V | 30.8 | Very low | 30.1 | Very low | 108 Ų | 108 | 149.8 Ų | 149.8 | 66% | 0.655 | 78% | 0.777 | S | S | * | * | trans | 81.8 | 139.4 | 159.9 | -166 | 0 | 0 | 0 | 0 | 114.6 | ||||
| 100 | K | 30.8 | Very low | 30.1 | Very low | 189 Ų | 189 | 151.4 Ų | 151.4 | 82% | 0.822 | 78% | 0.78 | S | S | * | * | cis | -155.4 | 158.4 | 23.4 | -138.6 | 152.2 | -179.2 | 176.4 | 0 | 109.4 | ||||
| 101 | V | 29.7 | Very low | 30.3 | Very low | 111 Ų | 111 | 145.4 Ų | 145.4 | 67% | 0.673 | 77% | 0.77 | S | S | * | * | cis | -163.7 | -128.4 | -22.8 | 66.8 | 0 | 0 | 0 | 0 | 111.5 | ||||
| 102 | E | 30.1 | Very low | 30.3 | Very low | 150 Ų | 150 | 145.6 Ų | 145.6 | 70% | 0.701 | 77% | 0.771 | S | S | * | * | trans | -69.8 | 155.2 | -172.4 | -69.4 | 130.8 | 156 | 0 | 0 | 116.5 | ||||
| 103 | Q | 33.8 | Very low | 30.8 | Very low | 141 Ų | 141 | 145.8 Ų | 145.8 | 66% | 0.659 | 77% | 0.767 | S | S | * | * | cis | 99.2 | 124.9 | 23.1 | 179.1 | 177.8 | -22.9 | 0 | 0 | 115.3 | ||||
| 104 | F | 28.2 | Very low | 30.9 | Very low | 174 Ų | 174 | 144.5 Ų | 144.5 | 76% | 0.763 | 76% | 0.763 | S | S | * | * | 171.4 | 178 | 129.8 | -92.8 | -64.2 | 0 | 0 | 0 | 111.1 | |||||
| 105 | L | 31.2 | Very low | 31.6 | Very low | 129 Ų | 129 | 139.2 Ų | 139.2 | 68% | 0.675 | 76% | 0.755 | S | S | * | * | -151.5 | 131.2 | -102.5 | -179.2 | 155.5 | 0 | 0 | 0 | 113.2 | |||||
| 106 | S | 29.9 | Very low | 32.5 | Very low | 119 Ų | 119 | 136 Ų | 136 | 83% | 0.832 | 76% | 0.759 | S | S | * | * | trans | -157 | 156.6 | 161.5 | 53.3 | 0 | 0 | 0 | 0 | 113 | ||||
| 107 | K | 30.4 | Very low | 33.9 | Very low | 199 Ų | 199 | 133.3 Ų | 133.3 | 87% | 0.865 | 75% | 0.745 | S | S | * | * | trans | -117 | 170.1 | -177.9 | -57.1 | 173 | 175.8 | 174.5 | 0 | 109 | ||||
| 108 | S | 28.6 | Very low | 36 | Very low | 108 Ų | 108 | 130.8 Ų | 130.8 | 76% | 0.755 | 73% | 0.728 | S | S | * | * | cis | -144.4 | -176.1 | 3.9 | 57.3 | 0 | 0 | 0 | 0 | 108.3 | ||||
| 109 | S | 26 | Very low | 38.4 | Very low | 94 Ų | 94 | 127.1 Ų | 127.1 | 66% | 0.657 | 72% | 0.723 | S | S | * | * | cis | -166.2 | 158.9 | 42.1 | -65.2 | 0 | 0 | 0 | 0 | 112.8 | ||||
| 110 | Q | 29.1 | Very low | 40.8 | Very low | 182 Ų | 182 | 130 Ų | 130 | 85% | 0.85 | 73% | 0.727 | S | S | * | * | trans | 43.9 | 107 | 152.3 | -72.7 | 179.4 | -35.5 | 0 | 0 | 121.4 | ||||
| 111 | V | 30.5 | Very low | 43.1 | Very low | 121 Ų | 121 | 126 Ų | 126 | 73% | 0.733 | 71% | 0.711 | S | S | * | * | 37.4 | 109.7 | 122.5 | -174.5 | 0 | 0 | 0 | 0 | 118 | |||||
| 112 | N | 28.9 | Very low | 45.6 | Very low | 161 Ų | 161 | 123.8 Ų | 123.8 | 86% | 0.861 | 70% | 0.701 | S | S | * | * | -142.9 | 145 | 109.6 | -94.8 | -38.7 | 0 | 0 | 0 | 109.9 | |||||
| 113 | T | 40.8 | Very low | 48.2 | Very low | 130 Ų | 130 | 121.7 Ų | 121.7 | 80% | 0.798 | 69% | 0.694 | S | S | * | * | trans | -87.9 | 128.8 | 176.4 | 48.5 | 0 | 0 | 0 | 0 | 110.2 | ||||
| 114 | D | 37.4 | Very low | 50.6 | Low | 147 Ų | 147 | 120.4 Ų | 120.4 | 79% | 0.786 | 69% | 0.691 | S | S | * | * | trans | -141.3 | 148 | 155.8 | -111.4 | -32.2 | 0 | 0 | 0 | 109 | ||||
| 115 | G | 46.5 | Very low | 53.2 | Low | 61 Ų | 61 | 116.7 Ų | 116.7 | 63% | 0.629 | 68% | 0.679 | S | S | * | * | trans | -66.9 | 166.2 | -176.5 | 0 | 0 | 0 | 0 | 0 | 113.1 | K117 | G115-K117 VanDerWaalsContact C-N 3.28Å; G115-K117 PolarHBondContact O-N 3.14Å | ||
| 116 | A | 49.5 | Very low | 55.8 | Low | 111 Ų | 111 | 115.9 Ų | 115.9 | 92% | 0.917 | 68% | 0.675 | S | S | * | * | trans | -66.3 | 84.4 | 176.3 | 0 | 0 | 0 | 0 | 0 | 111.4 | S118 | A116-S118 PolarHBondContact O-N 3.15Š| ||
| 117 | K | 61 | Low | 58.2 | Low | 112 Ų | 112 | 115.4 Ų | 115.4 | 49% | 0.487 | 66% | 0.662 | S | S | . | * | trans | -50.7 | 129.1 | 171.7 | -67.8 | -177.1 | 176.8 | 178.4 | 0 | 109 | G115 E121 D125 | G115-K117 VanDerWaalsContact C-N 3.28Å; G115-K117 PolarHBondContact O-N 3.14Å; K117-E121 HydrophobicContact CB-CB 4.28Å; K117-D125 IonicContact NZ-OD2 2.79Å; K117-D125 PolarHBondContact NZ-OD2 2.82Å | ||
| 118 | S | 73.8 | Confident | 60.5 | Low | 56 Ų | 56 | 108.7 Ų | 108.7 | 39% | 0.392 | 65% | 0.65 | S | S | . | * | trans | -62 | 154.8 | 177.6 | 70.1 | 0 | 0 | 0 | 0 | 110.7 | A116 K120 E121 S122 | A116-S118 PolarHBondContact O-N 3.15Å; S118-K120 PolarHBondContact O-N 3.14Å; S118-E121 WeakPolarHBondContact CA-OE2 3.36Å; S118-E121 VanDerWaalsContact CB-OE2 3.25Å; S118-E121 WeakPolarHBondContact CB-OE2 3.3Å; S118-E121 PolarHBondContact N-OE2 3.04Å; S118-E121 PolarHBondContact O-N 3.04Å; S118-E121 VanDerWaalsContact OG-CD 3.3Å; S118-E121 PolarHBondContact OG-OE2 3.37Å; S118-S122 PolarHBondContact O-N 3.45Å | ||
| 119 | G | 79 | Confident | 62.8 | Low | 66 Ų | 66 | 107.5 Ų | 107.5 | 68% | 0.68 | 65% | 0.646 | S | S | * | * | H | α-helix | trans | -56.4 | -24.7 | -178.8 | 0 | 0 | 0 | 0 | 0 | 114 | L123 | G119-L123 VanDerWaalsContact O-CB 3.31Å; G119-L123 WeakPolarHBondContact O-CB 3.45Å; G119-L123 PolarHBondContact O-N 2.89Å; G119-L123 VanDerWaalsContact O-N 3.11Å |
| 120 | K | 80.9 | Confident | 64.9 | Low | 168 Ų | 168 | 109 Ų | 109 | 73% | 0.73 | 65% | 0.645 | S | S | * | * | H | α-helix | trans | -71 | -43.2 | 173.9 | -65.2 | 179.9 | -179.9 | 177.6 | 0 | 112.1 | S118 L123 L124 | S118-K120 PolarHBondContact O-N 3.14Å; K120-L123 PolarHBondContact O-N 2.83Å; K120-L124 VanDerWaalsContact O-CG 3.27Å; K120-L124 WeakPolarHBondContact O-CG 3.42Å; K120-L124 PolarHBondContact O-N 2.78Å |
| 121 | E | 80.6 | Confident | 66.7 | Low | 105 Ų | 105 | 109.1 Ų | 109.1 | 49% | 0.491 | 64% | 0.642 | S | S | . | * | H | α-helix | trans | -68.9 | -42.1 | 178.9 | -68.2 | 157 | 137.4 | 0 | 0 | 111 | K117 S118 L123 L124 D125 | K117-E121 HydrophobicContact CB-CB 4.28Å; S118-E121 WeakPolarHBondContact CA-OE2 3.36Å; S118-E121 VanDerWaalsContact CB-OE2 3.25Å; S118-E121 WeakPolarHBondContact CB-OE2 3.3Å; S118-E121 PolarHBondContact N-OE2 3.04Å; S118-E121 PolarHBondContact O-N 3.04Å; S118-E121 VanDerWaalsContact OG-CD 3.3Å; S118-E121 PolarHBondContact OG-OE2 3.37Å; E121-L123 VanDerWaalsContact C-N 3.35Å; E121-L123 PolarHBondContact O-N 3.24Å; E121-L124 PolarHBondContact O-N 3.42Å; E121-D125 PolarHBondContact O-N 3.43Å |
| 122 | S | 81 | Confident | 68.4 | Low | 66 Ų | 66 | 108.7 Ų | 108.7 | 46% | 0.462 | 64% | 0.64 | S | S | . | * | H | α-helix | trans | -58.5 | -44.3 | 172.9 | -176 | 0 | 0 | 0 | 0 | 112.2 | S118 D125 L126 | S118-S122 PolarHBondContact O-N 3.45Å; S122-D125 PolarHBondContact O-N 2.92Å; S122-L126 WeakPolarHBondContact O-CB 3.48Å; S122-L126 PolarHBondContact O-N 3.14Å; S122-L126 VanDerWaalsContact O-N 3.1Å |
| 123 | L | 86.3 | Confident | 69.2 | Low | 105 Ų | 105 | 109.3 Ų | 109.3 | 55% | 0.55 | 64% | 0.637 | S | S | . | * | H | α-helix | trans | -65 | -38.5 | 175.9 | -174.5 | 149.2 | 0 | 0 | 0 | 112.2 | G119 K120 E121 L126 L127 | G119-L123 VanDerWaalsContact O-CB 3.31Å; G119-L123 WeakPolarHBondContact O-CB 3.45Å; G119-L123 PolarHBondContact O-N 2.89Å; G119-L123 VanDerWaalsContact O-N 3.11Å; K120-L123 PolarHBondContact O-N 2.83Å; E121-L123 VanDerWaalsContact C-N 3.35Å; E121-L123 PolarHBondContact O-N 3.24Å; L123-L126 PolarHBondContact O-N 3.29Å; L123-L127 HydrophobicContact CD2-CD1 4.03Å; L123-L127 WeakPolarHBondContact O-CB 3.38Å; L123-L127 PolarHBondContact O-N 3.19Å |
| 124 | L | 82.8 | Confident | 69.6 | Low | 115 Ų | 115 | 108.3 Ų | 108.3 | 60% | 0.602 | 63% | 0.631 | S | S | * | * | H | α-helix | trans | -68.9 | -37.8 | 176.8 | -72.8 | 168.9 | 0 | 0 | 0 | 112.9 | K120 E121 L126 L127 G128 | K120-L124 VanDerWaalsContact O-CG 3.27Å; K120-L124 WeakPolarHBondContact O-CG 3.42Å; K120-L124 PolarHBondContact O-N 2.78Å; E121-L124 PolarHBondContact O-N 3.42Å; L124-L126 VanDerWaalsContact C-N 3.33Å; L124-L127 PolarHBondContact O-N 3.44Å; L124-G128 PolarHBondContact O-N 3.39Å |
| 125 | D | 83.4 | Confident | 70.1 | Confident | 96 Ų | 96 | 107.2 Ų | 107.2 | 51% | 0.513 | 63% | 0.63 | S | S | . | * | H | α-helix | trans | -59.3 | -46.1 | 172.4 | -127.5 | -23.1 | 0 | 0 | 0 | 109.9 | K117 E121 S122 G128 A129 | K117-D125 IonicContact NZ-OD2 2.79Å; K117-D125 PolarHBondContact NZ-OD2 2.82Å; E121-D125 PolarHBondContact O-N 3.43Å; S122-D125 PolarHBondContact O-N 2.92Å; D125-G128 PolarHBondContact O-N 3.49Å; D125-A129 PolarHBondContact O-N 3.35Å |
| 126 | L | 85.6 | Confident | 69.9 | Low | 111 Ų | 111 | 108.7 Ų | 108.7 | 58% | 0.581 | 63% | 0.631 | S | S | * | * | H | α-helix | trans | -66.2 | -41 | 178.8 | -157 | 162.8 | 0 | 0 | 0 | 112.1 | S122 L123 L124 G128 A129 M130 | S122-L126 WeakPolarHBondContact O-CB 3.48Å; S122-L126 PolarHBondContact O-N 3.14Å; S122-L126 VanDerWaalsContact O-N 3.1Å; L123-L126 PolarHBondContact O-N 3.29Å; L124-L126 VanDerWaalsContact C-N 3.33Å; L126-G128 VanDerWaalsContact C-N 3.34Å; L126-A129 WeakPolarHBondContact O-CB 3.5Å; L126-A129 PolarHBondContact O-N 3.34Å; L126-M130 HydrophobicContact CD2-SD 4.34Å; L126-M130 PolarHBondContact O-N 3.36Å |
| 127 | L | 80.4 | Confident | 69.9 | Low | 109 Ų | 109 | 113.3 Ų | 113.3 | 57% | 0.571 | 63% | 0.63 | S | S | * | * | H | α-helix | trans | -68.8 | -32.9 | 175.7 | -134.5 | 157.8 | 0 | 0 | 0 | 111.8 | L123 L124 M130 | L123-L127 HydrophobicContact CD2-CD1 4.03Å; L123-L127 WeakPolarHBondContact O-CB 3.38Å; L123-L127 PolarHBondContact O-N 3.19Å; L124-L127 PolarHBondContact O-N 3.44Å; L127-M130 PolarHBondContact O-N 2.94Å |
| 128 | G | 78.1 | Confident | 69 | Low | 58 Ų | 58 | 117.3 Ų | 117.3 | 60% | 0.598 | 65% | 0.647 | S | S | * | * | H | α-helix | trans | -66.4 | -36.7 | 170.3 | 0 | 0 | 0 | 0 | 0 | 113.3 | L124 D125 L126 | L124-G128 PolarHBondContact O-N 3.39Å; D125-G128 PolarHBondContact O-N 3.49Å; L126-G128 VanDerWaalsContact C-N 3.34Å |
| 129 | A | 77.4 | Confident | 67.4 | Low | 83 Ų | 83 | 126.2 Ų | 126.2 | 69% | 0.686 | 67% | 0.672 | S | S | * | * | H | α-helix | trans | -68.8 | -32.1 | 172.7 | 0 | 0 | 0 | 0 | 0 | 112.8 | D125 L126 K131 | D125-A129 PolarHBondContact O-N 3.35Å; L126-A129 WeakPolarHBondContact O-CB 3.5Å; L126-A129 PolarHBondContact O-N 3.34Å; A129-K131 PolarHBondContact O-N 3.13Å |
| 130 | M | 69.8 | Low | 65.6 | Low | 126 Ų | 126 | 130.7 Ų | 130.7 | 62% | 0.621 | 68% | 0.68 | S | S | * | * | trans | -74.3 | 59.3 | 174.9 | -88.9 | -173.8 | 57.2 | 0 | 0 | 113.6 | L126 L127 V132 | L126-M130 HydrophobicContact CD2-SD 4.34Å; L126-M130 PolarHBondContact O-N 3.36Å; L127-M130 PolarHBondContact O-N 2.94Å; M130-V132 PolarHBondContact O-N 3.09Å | ||
| 131 | K | 66.4 | Low | 63.7 | Low | 185 Ų | 185 | 132.4 Ų | 132.4 | 80% | 0.804 | 69% | 0.687 | S | S | * | * | trans | -75.1 | 79.7 | -178.5 | -167.7 | 169.8 | -175.1 | 169.5 | 0 | 113.4 | A129 Q133 | A129-K131 PolarHBondContact O-N 3.13Å; K131-Q133 PolarHBondContact O-N 3.04Å | ||
| 132 | V | 67.3 | Low | 61.5 | Low | 112 Ų | 112 | 134.7 Ų | 134.7 | 68% | 0.679 | 70% | 0.703 | S | S | * | * | trans | -63.6 | 118.9 | 175 | -178.6 | 0 | 0 | 0 | 0 | 111.2 | M130 V134 | M130-V132 PolarHBondContact O-N 3.09Å; V132-V134 HydrophobicContact CG1-CG2 4.04Å; V132-V134 PolarHBondContact O-N 3.33Å; V132-V134 VanDerWaalsContact O-N 3.09Å | ||
| 133 | Q | 45.5 | Very low | 59.3 | Low | 173 Ų | 173 | 139.5 Ų | 139.5 | 81% | 0.808 | 72% | 0.722 | S | S | * | * | trans | -80 | 85.5 | 175.7 | -66.6 | -167.8 | 17.9 | 0 | 0 | 111.9 | K131 T135 | K131-Q133 PolarHBondContact O-N 3.04Å; Q133-T135 PolarHBondContact O-N 2.95Å | ||
| 134 | V | 48.3 | Very low | 57 | Low | 110 Ų | 110 | 144.3 Ų | 144.3 | 67% | 0.667 | 74% | 0.739 | S | S | * | * | trans | -75.8 | 103.9 | 171.4 | -174.4 | 0 | 0 | 0 | 0 | 109.9 | V132 S136 | V132-V134 HydrophobicContact CG1-CG2 4.04Å; V132-V134 PolarHBondContact O-N 3.33Å; V132-V134 VanDerWaalsContact O-N 3.09Å; V134-S136 PolarHBondContact O-N 3.12Å | ||
| 135 | T | 47.9 | Very low | 54.5 | Low | 123 Ų | 123 | 144.1 Ų | 144.1 | 76% | 0.755 | 75% | 0.745 | S | S | * | * | trans | -80.3 | 35.6 | -174.6 | 47.5 | 0 | 0 | 0 | 0 | 114.6 | Q133 K137 | Q133-T135 PolarHBondContact O-N 2.95Å; T135-K137 PolarHBondContact O-N 3.01Å | ||
| 136 | S | 43.2 | Very low | 51.9 | Low | 93 Ų | 93 | 148.1 Ų | 148.1 | 65% | 0.65 | 76% | 0.758 | S | S | * | * | trans | -76.9 | 74.2 | -178.2 | 57.7 | 0 | 0 | 0 | 0 | 113.2 | V134 K138 | V134-S136 PolarHBondContact O-N 3.12Å; S136-K138 VanDerWaalsContact C-N 3.26Å; S136-K138 PolarHBondContact O-N 3.26Å | ||
| 137 | K | 48.5 | Very low | 49.4 | Very low | 208 Ų | 208 | 149.9 Ų | 149.9 | 90% | 0.904 | 76% | 0.763 | S | S | * | * | trans | -69.4 | 68.8 | 176.3 | -72.3 | -176.4 | 177.3 | 174.3 | 0 | 113.3 | T135 | T135-K137 PolarHBondContact O-N 3.01Š| ||
| 138 | K | 42.5 | Very low | 46.8 | Very low | 196 Ų | 196 | 149.9 Ų | 149.9 | 85% | 0.852 | 77% | 0.772 | S | S | * | * | trans | -96.3 | 100 | 172.9 | -160.6 | 173.2 | -173.2 | 178.3 | 0 | 110.3 | S136 L140 | S136-K138 VanDerWaalsContact C-N 3.26Å; S136-K138 PolarHBondContact O-N 3.26Å; K138-L140 PolarHBondContact O-N 3.4Å | ||
| 139 | R | 41.5 | Very low | 44.6 | Very low | 242 Ų | 242 | 154.4 Ų | 154.4 | 91% | 0.913 | 78% | 0.782 | S | S | * | * | trans | -69.8 | 123.2 | 179.4 | -72.8 | -173 | 173.7 | -168.2 | -1.7 | 111.2 | ||||
| 140 | L | 41.1 | Very low | 42 | Very low | 160 Ų | 160 | 159.3 Ų | 159.3 | 84% | 0.838 | 79% | 0.79 | S | S | * | * | trans | -71.7 | 144.1 | 166.5 | -73.7 | 165.3 | 0 | 0 | 0 | 110.4 | K138 | K138-L140 PolarHBondContact O-N 3.4Š| ||
| 141 | K | 40.1 | Very low | 40.1 | Very low | 204 Ų | 204 | 158.4 Ų | 158.4 | 89% | 0.887 | 80% | 0.796 | S | S | * | * | trans | -93.9 | 107.7 | 174.2 | -67.7 | 179.8 | 179.9 | 178 | 0 | 108.7 | ||||
| 142 | N | 33.8 | Very low | 38.6 | Very low | 153 Ų | 153 | 154.7 Ų | 154.7 | 82% | 0.818 | 80% | 0.8 | S | S | * | * | P | Polyproline II helix | trans | -82.5 | 152.3 | 173.1 | -74.2 | 7.7 | 0 | 0 | 0 | 111.4 | ||
| 143 | L | 34.8 | Very low | 36.9 | Very low | 167 Ų | 167 | 154.2 Ų | 154.2 | 87% | 0.874 | 80% | 0.802 | S | S | * | * | P | Polyproline II helix | trans | -82.5 | 149.7 | -167.6 | -63.2 | 163.4 | 0 | 0 | 0 | 112.3 | ||
| 144 | K | 38.5 | Very low | 36.1 | Very low | 206 Ų | 206 | 151.4 Ų | 151.4 | 90% | 0.896 | 81% | 0.808 | S | S | * | * | P | Polyproline II helix | trans | -76.4 | 146.6 | 166.5 | -69.3 | -172.8 | 177.6 | -174.2 | 0 | 110.7 | ||
| 145 | P | 30.3 | Very low | 35.5 | Very low | 111 Ų | 111 | 150.4 Ų | 150.4 | 72% | 0.721 | 81% | 0.811 | S | S | * | * | trans | -125.1 | 145.1 | 134.7 | 35 | -26.3 | 0 | 0 | 0 | 112.8 | ||||
| 146 | K | 29.2 | Very low | 35.5 | Very low | 181 Ų | 181 | 153.8 Ų | 153.8 | 79% | 0.787 | 82% | 0.821 | S | S | * | * | trans | 31.3 | 145.1 | 131.9 | -64.6 | 177.8 | 159.6 | -164.6 | 0 | 120 | ||||
| 147 | Q | 33.2 | Very low | 35.4 | Very low | 147 Ų | 147 | 156.2 Ų | 156.2 | 69% | 0.687 | 82% | 0.822 | S | S | * | * | cis | -170 | 166.7 | 0.4 | -122 | 169.7 | -74 | 0 | 0 | 108.8 | ||||
| 148 | S | 25.8 | Very low | 35.3 | Very low | 110 Ų | 110 | 150.5 Ų | 150.5 | 77% | 0.769 | 81% | 0.809 | S | S | * | * | trans | 57.7 | 159.7 | 158 | 41.1 | 0 | 0 | 0 | 0 | 117.8 | ||||
| 149 | L | 31.7 | Very low | 35.9 | Very low | 153 Ų | 153 | 147 Ų | 147 | 80% | 0.801 | 80% | 0.804 | S | S | * | * | cis | -162 | -174.9 | -28.8 | -169.9 | 103.7 | 0 | 0 | 0 | 103.4 | ||||
| 150 | E | 23.1 | Very low | 36.5 | Very low | 185 Ų | 185 | 139.7 Ų | 139.7 | 86% | 0.864 | 79% | 0.789 | S | S | * | * | trans | 69.5 | 152 | 179.9 | -47.5 | 178 | -175 | 0 | 0 | 113.7 | ||||
| 151 | S | 28.8 | Very low | 37.1 | Very low | 107 Ų | 107 | 133.6 Ų | 133.6 | 75% | 0.748 | 76% | 0.76 | S | S | * | * | cis | -127.9 | 159 | 0.2 | 60.3 | 0 | 0 | 0 | 0 | 111.6 | ||||
| 152 | A | 35.1 | Very low | 37.4 | Very low | 107 Ų | 107 | 130.2 Ų | 130.2 | 88% | 0.884 | 75% | 0.749 | S | S | * | * | trans | -126.5 | 106.8 | 170.6 | 0 | 0 | 0 | 0 | 0 | 109.1 | ||||
| 153 | S | 31.1 | Very low | 38.2 | Very low | 103 Ų | 103 | 130.9 Ų | 130.9 | 72% | 0.72 | 75% | 0.745 | S | S | * | * | trans | -154.3 | 69.9 | 178.4 | 61.1 | 0 | 0 | 0 | 0 | 111.3 | A155 | S153-A155 VanDerWaalsContact C-N 3.27Å; S153-A155 PolarHBondContact O-N 2.93Å | ||
| 154 | A | 30.2 | Very low | 39.2 | Very low | 113 Ų | 113 | 129.9 Ų | 129.9 | 93% | 0.934 | 74% | 0.736 | S | S | * | * | trans | -76 | 78.7 | 171.5 | 0 | 0 | 0 | 0 | 0 | 110.3 | ||||
| 155 | A | 36.3 | Very low | 39.8 | Very low | 89 Ų | 89 | 125.7 Ų | 125.7 | 74% | 0.736 | 72% | 0.718 | S | S | * | * | P | Polyproline II helix | trans | -77 | 152.5 | 167.5 | 0 | 0 | 0 | 0 | 0 | 110.5 | S153 E157 | S153-A155 VanDerWaalsContact C-N 3.27Å; S153-A155 PolarHBondContact O-N 2.93Å; A155-E157 PolarHBondContact O-N 3.2Å |
| 156 | M | 46.7 | Very low | 40.5 | Very low | 195 Ų | 195 | 123.2 Ų | 123.2 | 96% | 0.961 | 71% | 0.706 | S | S | * | * | P | Polyproline II helix | trans | -61.4 | 122.9 | -173.3 | -67.6 | 169 | 162.5 | 0 | 0 | 112.9 | ||
| 157 | E | 40.8 | Very low | 41.3 | Very low | 144 Ų | 144 | 119.1 Ų | 119.1 | 67% | 0.673 | 70% | 0.697 | S | S | * | * | P | Polyproline II helix | trans | -79.7 | 124.5 | 166.7 | -81.7 | -167.9 | -144.1 | 0 | 0 | 110.9 | A155 S161 | A155-E157 PolarHBondContact O-N 3.2Å; E157-S161 WeakPolarHBondContact OE2-CB 3.48Å; E157-S161 PolarHBondContact OE2-OG 3.19Å |
| 158 | S | 47.4 | Very low | 41.8 | Very low | 88 Ų | 88 | 116.7 Ų | 116.7 | 62% | 0.615 | 69% | 0.692 | S | S | * | * | P | Polyproline II helix | trans | -71.6 | 155.1 | 175.6 | -62.8 | 0 | 0 | 0 | 0 | 113 | S160 S161 | S158-S160 PolarHBondContact O-N 3.14Å; S158-S161 WeakPolarHBondContact O-CB 3.46Å; S158-S161 PolarHBondContact O-N 3.35Å; S158-S161 VanDerWaalsContact O-N 3.07Å |
| 159 | T | 55.6 | Low | 42.5 | Very low | 122 Ų | 122 | 118 Ų | 118 | 75% | 0.748 | 69% | 0.686 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -61.5 | -8.1 | -176.3 | 46.7 | 0 | 0 | 0 | 0 | 115.9 | S161 | T159-S161 VanDerWaalsContact C-N 3.32Š|
| 160 | S | 53.1 | Low | 43 | Very low | 88 Ų | 88 | 114.1 Ų | 114.1 | 62% | 0.615 | 68% | 0.676 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -70.2 | -22.4 | 170.8 | 48.4 | 0 | 0 | 0 | 0 | 114.1 | S158 M162 | S158-S160 PolarHBondContact O-N 3.14Å; S160-M162 VanDerWaalsContact C-N 3.33Å; S160-M162 PolarHBondContact O-N 2.9Å |
| 161 | S | 53.3 | Low | 44 | Very low | 33 Ų | 33 | 109.3 Ų | 109.3 | 23% | 0.231 | 66% | 0.662 | C | S | . | * | H | α-helix | trans | -57.8 | -39 | -177.6 | 177.7 | 0 | 0 | 0 | 0 | 113.4 | E157 S158 T159 F163 K165 | E157-S161 WeakPolarHBondContact OE2-CB 3.48Å; E157-S161 PolarHBondContact OE2-OG 3.19Å; S158-S161 WeakPolarHBondContact O-CB 3.46Å; S158-S161 PolarHBondContact O-N 3.35Å; S158-S161 VanDerWaalsContact O-N 3.07Å; T159-S161 VanDerWaalsContact C-N 3.32Å; S161-F163 PolarHBondContact O-N 3.27Å; S161-K165 PolarHBondContact O-N 3.12Å |
| 162 | M | 47.2 | Very low | 44.7 | Very low | 132 Ų | 132 | 107.7 Ų | 107.7 | 65% | 0.65 | 66% | 0.656 | S | S | * | * | H | α-helix | trans | -68.4 | -36.4 | -169.9 | -68.9 | -164.3 | -75.6 | 0 | 0 | 114.5 | S160 K165 A166 | S160-M162 VanDerWaalsContact C-N 3.33Å; S160-M162 PolarHBondContact O-N 2.9Å; M162-K165 PolarHBondContact O-N 3.45Å; M162-A166 PolarHBondContact O-N 3.33Å |
| 163 | F | 50.4 | Low | 45.4 | Very low | 167 Ų | 167 | 111.2 Ų | 111.2 | 73% | 0.732 | 65% | 0.654 | S | S | * | * | H | α-helix | trans | -74.9 | -27.9 | -175.7 | -74 | -79.2 | 0 | 0 | 0 | 113.6 | S161 | S161-F163 PolarHBondContact O-N 3.27Å |
| 164 | Q | 56 | Low | 46.2 | Very low | 147 Ų | 147 | 111.1 Ų | 111.1 | 69% | 0.687 | 65% | 0.654 | S | S | * | * | H | α-helix | trans | -77.1 | -33.3 | 171.8 | -66.4 | -177 | -9.3 | 0 | 0 | 111.8 | A166 T167 V168 | Q164-A166 VanDerWaalsContact C-N 3.3Å; Q164-A166 PolarHBondContact O-N 3Å; Q164-T167 PolarHBondContact O-N 2.91Å; Q164-T167 PolarHBondContact O-OG1 2.97Å; Q164-V168 WeakPolarHBondContact O-CB 3.27Å; Q164-V168 WeakPolarHBondContact O-CG2 3.36Å; Q164-V168 PolarHBondContact O-N 3.11Å; Q164-V168 VanDerWaalsContact O-N 3.09Å |
| 165 | K | 49.8 | Very low | 47.6 | Very low | 118 Ų | 118 | 111.6 Ų | 111.6 | 51% | 0.513 | 64% | 0.636 | S | S | . | * | H | α-helix | trans | -60.2 | -39.4 | 173.8 | -122.5 | 160.8 | -172.2 | 157.7 | 0 | 111.9 | S161 M162 Q169 | S161-K165 PolarHBondContact O-N 3.12Å; M162-K165 PolarHBondContact O-N 3.45Å; K165-Q169 WeakPolarHBondContact O-CB 3.38Å; K165-Q169 WeakPolarHBondContact O-CG 3.39Å; K165-Q169 PolarHBondContact O-N 2.94Å |
| 166 | A | 46.2 | Very low | 49 | Very low | 58 Ų | 58 | 111 Ų | 111 | 48% | 0.479 | 63% | 0.631 | S | S | . | * | H | α-helix | trans | -65.3 | -44.5 | 178.5 | 0 | 0 | 0 | 0 | 0 | 113.4 | M162 Q164 Q169 A170 | M162-A166 PolarHBondContact O-N 3.33Å; Q164-A166 VanDerWaalsContact C-N 3.3Å; Q164-A166 PolarHBondContact O-N 3Å; A166-Q169 PolarHBondContact O-N 3.08Å; A166-A170 WeakPolarHBondContact O-CB 3.5Å; A166-A170 PolarHBondContact O-N 3.17Å |
| 167 | T | 46.3 | Very low | 50.4 | Low | 96 Ų | 96 | 102.5 Ų | 102.5 | 59% | 0.589 | 59% | 0.59 | S | S | * | * | H | α-helix | trans | -71.7 | -35.3 | 178.9 | 47.6 | 0 | 0 | 0 | 0 | 112.6 | Q164 A170 S171 | Q164-T167 PolarHBondContact O-N 2.91Å; Q164-T167 PolarHBondContact O-OG1 2.97Å; T167-A170 PolarHBondContact O-N 2.82Å; T167-S171 PolarHBondContact O-N 3.4Å; T167-S171 VanDerWaalsContact O-N 3.16Å; T167-S171 PolarHBondContact O-OG 3.27Å |
| 168 | V | 43.5 | Very low | 52.5 | Low | 96 Ų | 96 | 100.2 Ų | 100.2 | 58% | 0.582 | 58% | 0.582 | S | S | * | * | H | α-helix | trans | -70.9 | -33.6 | 174.6 | 174.7 | 0 | 0 | 0 | 0 | 112.2 | Q164 S171 A172 | Q164-V168 WeakPolarHBondContact O-CB 3.27Å; Q164-V168 WeakPolarHBondContact O-CG2 3.36Å; Q164-V168 PolarHBondContact O-N 3.11Å; Q164-V168 VanDerWaalsContact O-N 3.09Å; V168-S171 PolarHBondContact O-OG 2.96Å; V168-A172 PolarHBondContact O-N 3.35Å |
| 169 | Q | 40.8 | Very low | 54.4 | Low | 138 Ų | 138 | 100.8 Ų | 100.8 | 65% | 0.645 | 58% | 0.584 | S | S | * | * | H | α-helix | trans | -73.9 | -28.5 | 172.5 | -76.4 | -174.3 | -34.1 | 0 | 0 | 113 | K165 A166 A172 | K165-Q169 WeakPolarHBondContact O-CB 3.38Å; K165-Q169 WeakPolarHBondContact O-CG 3.39Å; K165-Q169 PolarHBondContact O-N 2.94Å; A166-Q169 PolarHBondContact O-N 3.08Å; Q169-A172 PolarHBondContact O-N 2.79Å |
| 170 | A | 40.6 | Very low | 56.1 | Low | 71 Ų | 71 | 101.1 Ų | 101.1 | 59% | 0.587 | 58% | 0.581 | S | S | * | * | H | α-helix | trans | -68.5 | -41.3 | 173.5 | 0 | 0 | 0 | 0 | 0 | 112.4 | A166 T167 A172 | A166-A170 WeakPolarHBondContact O-CB 3.5Å; A166-A170 PolarHBondContact O-N 3.17Å; T167-A170 PolarHBondContact O-N 2.82Å; A170-A172 VanDerWaalsContact C-N 3.26Å; A170-A172 PolarHBondContact O-N 3.17Å |
| 171 | S | 44.9 | Very low | 57.8 | Low | 83 Ų | 83 | 100.6 Ų | 100.6 | 58% | 0.58 | 57% | 0.571 | S | S | * | * | H | α-helix | trans | -73.2 | -15.1 | 177.2 | 59.4 | 0 | 0 | 0 | 0 | 114 | T167 V168 Q173 | T167-S171 PolarHBondContact O-N 3.4Å; T167-S171 VanDerWaalsContact O-N 3.16Å; T167-S171 PolarHBondContact O-OG 3.27Å; V168-S171 PolarHBondContact O-OG 2.96Å; S171-Q173 VanDerWaalsContact C-N 3.32Å; S171-Q173 PolarHBondContact O-N 2.87Å |
| 172 | A | 43.5 | Very low | 59.7 | Low | 74 Ų | 74 | 101.5 Ų | 101.5 | 61% | 0.612 | 58% | 0.575 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -77.4 | -8.4 | 177 | 0 | 0 | 0 | 0 | 0 | 114.7 | V168 Q169 A170 S174 | V168-A172 PolarHBondContact O-N 3.35Å; Q169-A172 PolarHBondContact O-N 2.79Å; A170-A172 VanDerWaalsContact C-N 3.26Å; A170-A172 PolarHBondContact O-N 3.17Å; A172-S174 PolarHBondContact O-N 3.36Å |
| 173 | Q | 49.7 | Very low | 61.8 | Low | 180 Ų | 180 | 97.9 Ų | 97.9 | 84% | 0.841 | 57% | 0.566 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -86.8 | 4.8 | -177.9 | -67.2 | -158.4 | -0.4 | 0 | 0 | 115.3 | S171 E175 | S171-Q173 VanDerWaalsContact C-N 3.32Å; S171-Q173 PolarHBondContact O-N 2.87Å; Q173-E175 PolarHBondContact O-N 3.01Å |
| 174 | S | 49.1 | Very low | 63.8 | Low | 102 Ų | 102 | 92.7 Ų | 92.7 | 71% | 0.713 | 55% | 0.554 | S | S | * | * | trans | -95.6 | 51.8 | 168.7 | 67.9 | 0 | 0 | 0 | 0 | 112.2 | A172 A176 | A172-S174 PolarHBondContact O-N 3.36Å; S174-A176 PolarHBondContact O-N 3.25Å; S174-A176 VanDerWaalsContact O-N 3.08Å | ||
| 175 | E | 57.7 | Low | 65.5 | Low | 122 Ų | 122 | 85.8 Ų | 85.8 | 57% | 0.57 | 52% | 0.522 | S | S | * | . | trans | -65.9 | 110.6 | 162.5 | -165.1 | -175.2 | 135.6 | 0 | 0 | 107.7 | Q173 K210 | Q173-E175 PolarHBondContact O-N 3.01Å; E175-K210 WeakPolarHBondContact OE1-CE 3.1Å; E175-K210 IonicContact OE1-NZ 2.68Å; E175-K210 PolarHBondContact OE1-NZ 3Å | ||
| 176 | A | 67.3 | Low | 67.5 | Low | 76 Ų | 76 | 81.7 Ų | 81.7 | 63% | 0.628 | 51% | 0.508 | S | S | * | . | P | Polyproline II helix | trans | -56.6 | 143.7 | -173.6 | 0 | 0 | 0 | 0 | 0 | 111.4 | S174 K210 | S174-A176 PolarHBondContact O-N 3.25Å; S174-A176 VanDerWaalsContact O-N 3.08Å; A176-K210 PolarHBondContact O-NZ 3.28Å; A176-K210 VanDerWaalsContact O-NZ 3.08Å |
| 177 | L | 74.9 | Confident | 69.7 | Low | 17 Ų | 17 | 81.6 Ų | 81.6 | 9% | 0.089 | 51% | 0.508 | C | S | . | . | P | Polyproline II helix | trans | -72.7 | 146 | 157.2 | -64.7 | -179.2 | 0 | 0 | 0 | 107.5 | V182 L203 L206 R207 K210 | L177-V182 HydrophobicContact CB-CG2 3.96Å; L177-L203 HydrophobicContact CD1-CD2 3.82Å; L177-L206 HydrophobicContact CD1-CB 3.87Å; L177-L206 HydrophobicContact CD1-CD1 4.35Å; L177-L206 HydrophobicContact CD2-CB 4.44Å; L177-R207 HydrophobicContact CD1-CG 4.05Å; L177-R207 HydrophobicContact CD2-CG 4.09Å; L177-R207 HydrophobicContact CG-CG 4.1Å; L177-K210 HydrophobicContact CD2-CD 4.03Å |
| 178 | D | 85.4 | Confident | 71.8 | Confident | 96 Ų | 96 | 79.1 Ų | 79.1 | 51% | 0.513 | 50% | 0.497 | S | S | . | . | P | Polyproline II helix | trans | -56 | 136 | 177 | -51.1 | -75 | 0 | 0 | 0 | 109.8 | D180 L181 V182 | D178-D180 PolarHBondContact O-N 2.98Å; D178-D180 VanDerWaalsContact O-N 3.16Å; D178-L181 HydrophobicContact CB-CD1 4.16Å; D178-L181 HydrophobicContact CB-CG 4.22Å; D178-L181 WeakPolarHBondContact O-CB 3.16Å; D178-L181 PolarHBondContact O-N 3.17Å; D178-V182 PolarHBondContact O-N 3.39Å |
| 179 | P | 87.6 | Confident | 74.1 | Confident | 101 Ų | 101 | 74.6 Ų | 74.6 | 66% | 0.656 | 47% | 0.47 | S | S | * | . | H | α-helix | trans | -59.1 | -35.3 | -170.3 | 22.6 | -33.4 | 0 | 0 | 0 | 112.2 | L181 V182 A183 | P179-L181 VanDerWaalsContact C-N 3.28Å; P179-L181 PolarHBondContact O-N 3.33Å; P179-V182 PolarHBondContact O-N 2.87Å; P179-V182 VanDerWaalsContact O-N 3.11Å; P179-A183 PolarHBondContact O-N 2.68Å |
| 180 | D | 91.6 | Very high | 76.4 | Confident | 129 Ų | 129 | 71.3 Ų | 71.3 | 69% | 0.69 | 46% | 0.462 | S | S | * | . | H | α-helix | trans | -60.8 | -34.5 | 175.6 | -60.4 | 2.2 | 0 | 0 | 0 | 112.5 | D178 A184 | D178-D180 PolarHBondContact O-N 2.98Å; D178-D180 VanDerWaalsContact O-N 3.16Å; D180-A184 VanDerWaalsContact O-CB 3.27Å; D180-A184 WeakPolarHBondContact O-CB 3.26Å; D180-A184 PolarHBondContact O-N 3.23Å |
| 181 | L | 89.2 | Confident | 78.9 | Confident | 76 Ų | 76 | 73.4 Ų | 73.4 | 40% | 0.398 | 47% | 0.467 | S | S | . | . | H | α-helix | trans | -73.8 | -31.4 | 176.1 | -64.3 | 177.2 | 0 | 0 | 0 | 111.8 | D178 P179 A185 | D178-L181 HydrophobicContact CB-CD1 4.16Å; D178-L181 HydrophobicContact CB-CG 4.22Å; D178-L181 WeakPolarHBondContact O-CB 3.16Å; D178-L181 PolarHBondContact O-N 3.17Å; P179-L181 VanDerWaalsContact C-N 3.28Å; P179-L181 PolarHBondContact O-N 3.33Å; L181-A185 VanDerWaalsContact O-CB 3.28Å; L181-A185 WeakPolarHBondContact O-CB 3.42Å; L181-A185 PolarHBondContact O-N 2.93Å |
| 182 | V | 91.5 | Very high | 81 | Confident | 53 Ų | 53 | 73.9 Ų | 73.9 | 32% | 0.321 | 46% | 0.463 | S | S | . | . | H | α-helix | trans | -72.8 | -41.6 | 173.7 | -175 | 0 | 0 | 0 | 0 | 110.5 | L177 D178 P179 A185 S186 L203 | L177-V182 HydrophobicContact CB-CG2 3.96Å; D178-V182 PolarHBondContact O-N 3.39Å; P179-V182 PolarHBondContact O-N 2.87Å; P179-V182 VanDerWaalsContact O-N 3.11Å; V182-A185 PolarHBondContact O-N 3.05Å; V182-S186 PolarHBondContact O-N 3.44Å; V182-S186 PolarHBondContact O-OG 2.73Å; V182-L203 HydrophobicContact CB-CD2 4.36Å; V182-L203 HydrophobicContact CG1-CD1 4.5Å; V182-L203 HydrophobicContact CG1-CD2 4.19Å; V182-L203 HydrophobicContact CG2-CD2 4.07Å |
| 183 | A | 92.5 | Very high | 82.9 | Confident | 56 Ų | 56 | 76.2 Ų | 76.2 | 46% | 0.463 | 47% | 0.472 | S | S | . | . | H | α-helix | trans | -59.1 | -48.5 | 171.5 | 0 | 0 | 0 | 0 | 0 | 111.1 | P179 A185 S186 A187 | P179-A183 PolarHBondContact O-N 2.68Å; A183-A185 VanDerWaalsContact C-N 3.35Å; A183-A185 PolarHBondContact O-N 3.37Å; A183-S186 PolarHBondContact O-N 3.23Å; A183-S186 PolarHBondContact O-OG 3.06Å; A183-A187 WeakPolarHBondContact O-CB 3.47Å; A183-A187 PolarHBondContact O-N 3.34Å |
| 184 | A | 92.5 | Very high | 84.8 | Confident | 57 Ų | 57 | 72 Ų | 72 | 47% | 0.471 | 46% | 0.455 | S | S | . | . | H | α-helix | trans | -62 | -38.3 | 176 | 0 | 0 | 0 | 0 | 0 | 113 | D180 A187 A188 | D180-A184 VanDerWaalsContact O-CB 3.27Å; D180-A184 WeakPolarHBondContact O-CB 3.26Å; D180-A184 PolarHBondContact O-N 3.23Å; A184-A187 PolarHBondContact O-N 3.33Å; A184-A188 WeakPolarHBondContact O-CB 3.43Å; A184-A188 PolarHBondContact O-N 2.96Å |
| 185 | A | 90.4 | Very high | 86.7 | Confident | 3 Ų | 3 | 73.6 Ų | 73.6 | 3% | 0.025 | 45% | 0.445 | C | S | . | . | H | α-helix | trans | -62.4 | -48.1 | 175.3 | 0 | 0 | 0 | 0 | 0 | 112.1 | L181 V182 A183 A188 A189 L202 L203 | L181-A185 VanDerWaalsContact O-CB 3.28Å; L181-A185 WeakPolarHBondContact O-CB 3.42Å; L181-A185 PolarHBondContact O-N 2.93Å; V182-A185 PolarHBondContact O-N 3.05Å; A183-A185 VanDerWaalsContact C-N 3.35Å; A183-A185 PolarHBondContact O-N 3.37Å; A185-A188 PolarHBondContact O-N 3.16Å; A185-A189 VanDerWaalsContact O-CB 3.31Å; A185-A189 WeakPolarHBondContact O-CB 3.47Å; A185-A189 PolarHBondContact O-N 3.07Å; A185-L202 HydrophobicContact CB-CD2 3.78Å; A185-L203 HydrophobicContact CB-CD2 3.78Å; A185-L203 HydrophobicContact CB-CG 4.15Å |
| 186 | S | 92.1 | Very high | 88.1 | Confident | 31 Ų | 31 | 72.2 Ų | 72.2 | 22% | 0.217 | 45% | 0.449 | C | S | . | . | H | α-helix | trans | -66.7 | -35.2 | 177.7 | 68.8 | 0 | 0 | 0 | 0 | 112.8 | V182 A183 A189 S190 E199 | V182-S186 PolarHBondContact O-N 3.44Å; V182-S186 PolarHBondContact O-OG 2.73Å; A183-S186 PolarHBondContact O-N 3.23Å; A183-S186 PolarHBondContact O-OG 3.06Å; S186-A189 PolarHBondContact O-N 3.21Å; S186-S190 WeakPolarHBondContact O-CB 3.47Å; S186-S190 PolarHBondContact O-N 2.98Å; S186-E199 VanDerWaalsContact CB-CD 3.43Å; S186-E199 WeakPolarHBondContact CB-OE2 3.45Å |
| 187 | A | 92.9 | Very high | 89.2 | Confident | 57 Ų | 57 | 73.9 Ų | 73.9 | 47% | 0.471 | 44% | 0.444 | S | S | . | . | H | α-helix | trans | -66.2 | -41.8 | 173.8 | 0 | 0 | 0 | 0 | 0 | 112.1 | A183 A184 S190 | A183-A187 WeakPolarHBondContact O-CB 3.47Å; A183-A187 PolarHBondContact O-N 3.34Å; A184-A187 PolarHBondContact O-N 3.33Å; A187-S190 PolarHBondContact O-OG 3.16Å |
| 188 | A | 90.3 | Very high | 89.9 | Confident | 44 Ų | 44 | 74.1 Ų | 74.1 | 36% | 0.364 | 45% | 0.448 | S | S | . | . | H | α-helix | trans | -65.8 | -46.7 | 173.2 | 0 | 0 | 0 | 0 | 0 | 111.7 | A184 A185 S190 T191 L202 | A184-A188 WeakPolarHBondContact O-CB 3.43Å; A184-A188 PolarHBondContact O-N 2.96Å; A185-A188 PolarHBondContact O-N 3.16Å; A188-S190 PolarHBondContact O-N 3.42Å; A188-T191 WeakPolarHBondContact O-CB 3.41Å; A188-T191 PolarHBondContact O-N 2.95Å; A188-T191 PolarHBondContact O-OG1 3.31Å; A188-L202 HydrophobicContact CB-CD1 4.43Å |
| 189 | A | 91 | Very high | 90.2 | Very high | 1 Ų | 1 | 71.8 Ų | 71.8 | 1% | 0.008 | 43% | 0.434 | C | S | . | . | H | α-helix | trans | -62.9 | -26.9 | 179.8 | 0 | 0 | 0 | 0 | 0 | 113.3 | A185 S186 T191 L192 R195 A198 E199 | A185-A189 VanDerWaalsContact O-CB 3.31Å; A185-A189 WeakPolarHBondContact O-CB 3.47Å; A185-A189 PolarHBondContact O-N 3.07Å; S186-A189 PolarHBondContact O-N 3.21Å; A189-T191 PolarHBondContact O-N 3.42Å; A189-L192 PolarHBondContact O-N 3.08Å; A189-L192 VanDerWaalsContact O-N 3.16Å; A189-R195 HydrophobicContact CB-CG 4.36Å; A189-A198 HydrophobicContact CB-CB 4.2Å; A189-E199 HydrophobicContact CB-CB 3.63Å; A189-E199 HydrophobicContact CB-CG 4.26Å |
| 190 | S | 90.7 | Very high | 90.3 | Very high | 68 Ų | 68 | 70.4 Ų | 70.4 | 48% | 0.476 | 43% | 0.427 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -67.4 | -13.3 | 175 | 78.3 | 0 | 0 | 0 | 0 | 114.5 | S186 A187 A188 | S186-S190 WeakPolarHBondContact O-CB 3.47Å; S186-S190 PolarHBondContact O-N 2.98Å; A187-S190 PolarHBondContact O-OG 3.16Å; A188-S190 PolarHBondContact O-N 3.42Å |
| 191 | T | 92.6 | Very high | 90.3 | Very high | 115 Ų | 115 | 69.6 Ų | 69.6 | 71% | 0.706 | 42% | 0.419 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -85.3 | -6.3 | 173.6 | 70.1 | 0 | 0 | 0 | 0 | 113.8 | A188 A189 | A188-T191 WeakPolarHBondContact O-CB 3.41Å; A188-T191 PolarHBondContact O-N 2.95Å; A188-T191 PolarHBondContact O-OG1 3.31Å; A189-T191 PolarHBondContact O-N 3.42Å |
| 192 | L | 88.3 | Confident | 90.5 | Very high | 94 Ų | 94 | 69 Ų | 69 | 49% | 0.492 | 42% | 0.416 | S | S | . | . | S | Bend | trans | -111.1 | 148 | -176.1 | -66.1 | 170.7 | 0 | 0 | 0 | 111 | A189 N194 A198 | A189-L192 PolarHBondContact O-N 3.08Å; A189-L192 VanDerWaalsContact O-N 3.16Å; L192-N194 VanDerWaalsContact C-N 3.34Å; L192-N194 PolarHBondContact O-N 3.28Å; L192-A198 HydrophobicContact CB-CB 4.38Å; L192-A198 HydrophobicContact CD1-CB 3.77Å |
| 193 | P | 84.7 | Confident | 90.4 | Very high | 123 Ų | 123 | 67.5 Ų | 67.5 | 80% | 0.799 | 41% | 0.406 | S | S | * | . | S | Bend | trans | -62.6 | -38.6 | -177.2 | 24.1 | -33.6 | 0 | 0 | 0 | 112.7 | R195 | P193-R195 VanDerWaalsContact C-N 3.35Å; P193-R195 PolarHBondContact O-N 3.03Å |
| 194 | N | 87.8 | Confident | 90.3 | Very high | 91 Ų | 91 | 70.9 Ų | 70.9 | 49% | 0.487 | 41% | 0.41 | S | S | . | . | S | Bend | trans | -94.8 | 59.3 | -179.1 | -65.8 | 31.5 | 0 | 0 | 0 | 110.9 | L192 S196 E197 A198 | L192-N194 VanDerWaalsContact C-N 3.34Å; L192-N194 PolarHBondContact O-N 3.28Å; N194-S196 PolarHBondContact O-N 2.94Å; N194-E197 HydrophobicContact CB-CB 4.28Å; N194-E197 WeakPolarHBondContact CB-OE2 3.32Å; N194-E197 PolarHBondContact ND2-OE2 3.39Å; N194-E197 PolarHBondContact O-N 3.13Å; N194-A198 WeakPolarHBondContact O-CB 3.42Å; N194-A198 PolarHBondContact O-N 2.95Å |
| 195 | R | 89.7 | Confident | 90.2 | Very high | 135 Ų | 135 | 72.8 Ų | 72.8 | 51% | 0.509 | 41% | 0.41 | S | S | . | . | H | α-helix | trans | -47.6 | -51.7 | -171.8 | 176.9 | -179 | 170.2 | 178.5 | -1.5 | 114 | A189 P193 A198 E199 | A189-R195 HydrophobicContact CB-CG 4.36Å; P193-R195 VanDerWaalsContact C-N 3.35Å; P193-R195 PolarHBondContact O-N 3.03Å; R195-A198 PolarHBondContact O-N 3.39Å; R195-E199 IonicContact NE-OE2 3.79Å; R195-E199 VanDerWaalsContact O-CB 3.28Å; R195-E199 WeakPolarHBondContact O-CB 3.5Å; R195-E199 PolarHBondContact O-N 3.23Å |
| 196 | S | 87.2 | Confident | 90.2 | Very high | 93 Ų | 93 | 75 Ų | 75 | 65% | 0.65 | 42% | 0.421 | S | S | * | . | H | α-helix | trans | -64.8 | -41.7 | -175.1 | 44.7 | 0 | 0 | 0 | 0 | 112.8 | N194 S200 | N194-S196 PolarHBondContact O-N 2.94Å; S196-S200 WeakPolarHBondContact O-CB 3.49Å; S196-S200 PolarHBondContact O-N 3.45Å; S196-S200 VanDerWaalsContact O-N 3.11Å |
| 197 | E | 90.3 | Very high | 90 | Very high | 112 Ų | 112 | 80.5 Ų | 80.5 | 52% | 0.523 | 44% | 0.437 | S | S | . | . | H | α-helix | trans | -66.5 | -50.9 | 177 | -60.8 | -179.7 | 152.3 | 0 | 0 | 110.1 | N194 E199 S200 E201 | N194-E197 HydrophobicContact CB-CB 4.28Å; N194-E197 WeakPolarHBondContact CB-OE2 3.32Å; N194-E197 PolarHBondContact ND2-OE2 3.39Å; N194-E197 PolarHBondContact O-N 3.13Å; E197-E199 VanDerWaalsContact C-N 3.34Å; E197-E199 PolarHBondContact O-N 2.91Å; E197-S200 PolarHBondContact O-N 2.88Å; E197-S200 VanDerWaalsContact O-N 3.09Å; E197-S200 PolarHBondContact O-OG 2.96Å; E197-E201 WeakPolarHBondContact O-CG 3.2Å; E197-E201 PolarHBondContact O-N 3.33Å |
| 198 | A | 89.4 | Confident | 89.7 | Confident | 21 Ų | 21 | 82.8 Ų | 82.8 | 17% | 0.174 | 44% | 0.438 | C | S | . | . | H | α-helix | trans | -59.3 | -41.2 | 179.4 | 0 | 0 | 0 | 0 | 0 | 112.8 | A189 L192 N194 R195 L202 | A189-A198 HydrophobicContact CB-CB 4.2Å; L192-A198 HydrophobicContact CB-CB 4.38Å; L192-A198 HydrophobicContact CD1-CB 3.77Å; N194-A198 WeakPolarHBondContact O-CB 3.42Å; N194-A198 PolarHBondContact O-N 2.95Å; R195-A198 PolarHBondContact O-N 3.39Å; A198-L202 VanDerWaalsContact O-CB 3.25Å; A198-L202 WeakPolarHBondContact O-CB 3.02Å; A198-L202 PolarHBondContact O-N 3.26Å |
| 199 | E | 91.5 | Very high | 89.6 | Confident | 47 Ų | 47 | 88.9 Ų | 88.9 | 22% | 0.22 | 45% | 0.451 | C | S | . | . | H | α-helix | trans | -62.5 | -45.4 | 174.5 | -165.3 | 174 | 142.2 | 0 | 0 | 110.7 | S186 A189 R195 E197 L202 L203 | S186-E199 VanDerWaalsContact CB-CD 3.43Å; S186-E199 WeakPolarHBondContact CB-OE2 3.45Å; A189-E199 HydrophobicContact CB-CB 3.63Å; A189-E199 HydrophobicContact CB-CG 4.26Å; R195-E199 IonicContact NE-OE2 3.79Å; R195-E199 VanDerWaalsContact O-CB 3.28Å; R195-E199 WeakPolarHBondContact O-CB 3.5Å; R195-E199 PolarHBondContact O-N 3.23Å; E197-E199 VanDerWaalsContact C-N 3.34Å; E197-E199 PolarHBondContact O-N 2.91Å; E199-L202 PolarHBondContact O-N 3.04Å; E199-L203 HydrophobicContact CG-CD1 4.16Å; E199-L203 WeakPolarHBondContact O-CB 3.37Å; E199-L203 WeakPolarHBondContact O-CG 3.37Å; E199-L203 PolarHBondContact O-N 3.23Å |
| 200 | S | 90.4 | Very high | 89.3 | Confident | 73 Ų | 73 | 91.2 Ų | 91.2 | 51% | 0.51 | 46% | 0.461 | S | S | . | . | H | α-helix | trans | -65.3 | -40.1 | 179.2 | 80.4 | 0 | 0 | 0 | 0 | 113.2 | S196 E197 K204 | S196-S200 WeakPolarHBondContact O-CB 3.49Å; S196-S200 PolarHBondContact O-N 3.45Å; S196-S200 VanDerWaalsContact O-N 3.11Å; E197-S200 PolarHBondContact O-N 2.88Å; E197-S200 VanDerWaalsContact O-N 3.09Å; E197-S200 PolarHBondContact O-OG 2.96Å; S200-K204 VanDerWaalsContact O-CB 3.25Å; S200-K204 WeakPolarHBondContact O-CB 3.44Å; S200-K204 PolarHBondContact O-N 3.24Å |
| 201 | E | 91.9 | Very high | 88.9 | Confident | 112 Ų | 112 | 93.5 Ų | 93.5 | 52% | 0.523 | 47% | 0.467 | S | S | . | . | H | α-helix | trans | -70.1 | -42.6 | 178 | -70.3 | -143.3 | 125.7 | 0 | 0 | 111.8 | E197 K204 Q205 | E197-E201 WeakPolarHBondContact O-CG 3.2Å; E197-E201 PolarHBondContact O-N 3.33Å; E201-K204 WeakPolarHBondContact O-CB 3.47Å; E201-K204 PolarHBondContact O-N 3.29Å; E201-Q205 WeakPolarHBondContact O-CG 3.32Å; E201-Q205 PolarHBondContact O-N 2.64Å |
| 202 | L | 91.7 | Very high | 88.1 | Confident | 62 Ų | 62 | 94 Ų | 94 | 33% | 0.325 | 47% | 0.465 | S | S | . | . | H | α-helix | trans | -65.8 | -42.2 | 179.7 | -160 | 157.7 | 0 | 0 | 0 | 110.5 | A185 A188 A198 E199 K204 Q205 L206 | A185-L202 HydrophobicContact CB-CD2 3.78Å; A188-L202 HydrophobicContact CB-CD1 4.43Å; A198-L202 VanDerWaalsContact O-CB 3.25Å; A198-L202 WeakPolarHBondContact O-CB 3.02Å; A198-L202 PolarHBondContact O-N 3.26Å; E199-L202 PolarHBondContact O-N 3.04Å; L202-K204 PolarHBondContact O-N 2.95Å; L202-Q205 PolarHBondContact O-N 3.22Å; L202-L206 HydrophobicContact CD2-CD1 3.64Å; L202-L206 HydrophobicContact CD2-CG 4Å; L202-L206 WeakPolarHBondContact O-CB 3.31Å; L202-L206 WeakPolarHBondContact O-CG 3.29Å; L202-L206 PolarHBondContact O-N 3.46Å |
| 203 | L | 91.3 | Very high | 87.7 | Confident | 23 Ų | 23 | 92.3 Ų | 92.3 | 12% | 0.12 | 46% | 0.459 | C | S | . | . | H | α-helix | trans | -63.6 | -37.7 | 172.8 | -68.6 | 172 | 0 | 0 | 0 | 112.7 | L177 V182 A185 E199 L206 R207 | L177-L203 HydrophobicContact CD1-CD2 3.82Å; V182-L203 HydrophobicContact CB-CD2 4.36Å; V182-L203 HydrophobicContact CG1-CD1 4.5Å; V182-L203 HydrophobicContact CG1-CD2 4.19Å; V182-L203 HydrophobicContact CG2-CD2 4.07Å; A185-L203 HydrophobicContact CB-CD2 3.78Å; A185-L203 HydrophobicContact CB-CG 4.15Å; E199-L203 HydrophobicContact CG-CD1 4.16Å; E199-L203 WeakPolarHBondContact O-CB 3.37Å; E199-L203 WeakPolarHBondContact O-CG 3.37Å; E199-L203 PolarHBondContact O-N 3.23Å; L203-L206 PolarHBondContact O-N 3.48Å; L203-R207 WeakPolarHBondContact O-CG 3.47Å; L203-R207 PolarHBondContact O-N 3.47Å |
| 204 | K | 90.3 | Very high | 87.2 | Confident | 126 Ų | 126 | 88 Ų | 88 | 55% | 0.548 | 43% | 0.428 | S | S | . | . | H | α-helix | trans | -64.1 | -44.4 | 174.3 | -178.9 | -177.8 | 178.2 | -174 | 0 | 111.7 | S200 E201 L202 R207 Q208 | S200-K204 VanDerWaalsContact O-CB 3.25Å; S200-K204 WeakPolarHBondContact O-CB 3.44Å; S200-K204 PolarHBondContact O-N 3.24Å; E201-K204 WeakPolarHBondContact O-CB 3.47Å; E201-K204 PolarHBondContact O-N 3.29Å; L202-K204 PolarHBondContact O-N 2.95Å; K204-R207 PolarHBondContact O-N 3.05Å; K204-Q208 WeakPolarHBondContact O-CG 3.46Å; K204-Q208 PolarHBondContact O-N 3.45Å |
| 205 | Q | 90.4 | Very high | 86.3 | Confident | 98 Ų | 98 | 86.4 Ų | 86.4 | 46% | 0.458 | 43% | 0.428 | S | S | . | . | H | α-helix | trans | -66.7 | -38 | 175.4 | -70.1 | -177.2 | 29.7 | 0 | 0 | 112.5 | E201 L202 Q208 R209 | E201-Q205 WeakPolarHBondContact O-CG 3.32Å; E201-Q205 PolarHBondContact O-N 2.64Å; L202-Q205 PolarHBondContact O-N 3.22Å; Q205-Q208 PolarHBondContact O-N 3.18Å; Q205-R209 WeakPolarHBondContact O-CB 3.46Å; Q205-R209 WeakPolarHBondContact O-CG 3.18Å; Q205-R209 PolarHBondContact O-N 3.06Å |
| 206 | L | 90 | Very high | 85.2 | Confident | 50 Ų | 50 | 87.8 Ų | 87.8 | 26% | 0.262 | 44% | 0.44 | S | S | . | . | H | α-helix | trans | -62.4 | -43.9 | 174 | -77.2 | 175.3 | 0 | 0 | 0 | 111.7 | L177 L202 L203 R209 K210 | L177-L206 HydrophobicContact CD1-CB 3.87Å; L177-L206 HydrophobicContact CD1-CD1 4.35Å; L177-L206 HydrophobicContact CD2-CB 4.44Å; L202-L206 HydrophobicContact CD2-CD1 3.64Å; L202-L206 HydrophobicContact CD2-CG 4Å; L202-L206 WeakPolarHBondContact O-CB 3.31Å; L202-L206 WeakPolarHBondContact O-CG 3.29Å; L202-L206 PolarHBondContact O-N 3.46Å; L203-L206 PolarHBondContact O-N 3.48Å; L206-R209 PolarHBondContact O-N 3.1Å; L206-K210 WeakPolarHBondContact O-CB 3.43Å; L206-K210 PolarHBondContact O-N 3.01Å |
| 207 | R | 88.2 | Confident | 84.2 | Confident | 146 Ų | 146 | 91.3 Ų | 91.3 | 55% | 0.551 | 44% | 0.444 | S | S | * | . | H | α-helix | trans | -60.6 | -45.7 | 174 | -70.8 | 172.5 | -171.2 | 168 | 4.5 | 111.7 | L177 L203 K204 R209 K210 L211 | L177-R207 HydrophobicContact CD1-CG 4.05Å; L177-R207 HydrophobicContact CD2-CG 4.09Å; L177-R207 HydrophobicContact CG-CG 4.1Å; L203-R207 WeakPolarHBondContact O-CG 3.47Å; L203-R207 PolarHBondContact O-N 3.47Å; K204-R207 PolarHBondContact O-N 3.05Å; R207-R209 PolarHBondContact O-N 3.44Å; R207-K210 PolarHBondContact O-N 3.19Å; R207-L211 WeakPolarHBondContact O-CG 3.4Å; R207-L211 PolarHBondContact O-N 2.73Å |
| 208 | Q | 86.9 | Confident | 82.9 | Confident | 105 Ų | 105 | 93.5 Ų | 93.5 | 49% | 0.491 | 45% | 0.451 | S | S | . | . | H | α-helix | trans | -59.5 | -45.2 | 175.4 | -73.3 | 175.2 | -20.6 | 0 | 0 | 112.3 | K204 Q205 L211 L212 | K204-Q208 WeakPolarHBondContact O-CG 3.46Å; K204-Q208 PolarHBondContact O-N 3.45Å; Q205-Q208 PolarHBondContact O-N 3.18Å; Q208-L211 PolarHBondContact O-N 3.1Å; Q208-L212 WeakPolarHBondContact O-CG 3.48Å; Q208-L212 PolarHBondContact O-N 3.29Å |
| 209 | R | 86.4 | Confident | 81.3 | Confident | 172 Ų | 172 | 94.3 Ų | 94.3 | 65% | 0.649 | 46% | 0.462 | S | S | * | . | H | α-helix | trans | -67.8 | -36.6 | 177.6 | -74.8 | -176 | 176.3 | -175.5 | 1 | 112.8 | Q205 L206 R207 T213 | Q205-R209 WeakPolarHBondContact O-CB 3.46Å; Q205-R209 WeakPolarHBondContact O-CG 3.18Å; Q205-R209 PolarHBondContact O-N 3.06Å; L206-R209 PolarHBondContact O-N 3.1Å; R207-R209 PolarHBondContact O-N 3.44Å; R209-T213 VanDerWaalsContact O-CB 3.28Å; R209-T213 WeakPolarHBondContact O-CB 3.48Å; R209-T213 PolarHBondContact O-N 3.05Å; R209-T213 PolarHBondContact O-OG1 3.48Å |
| 210 | K | 84.9 | Confident | 79.6 | Confident | 49 Ų | 49 | 97.5 Ų | 97.5 | 21% | 0.213 | 48% | 0.48 | C | S | . | . | H | α-helix | trans | -60.8 | -51.1 | 172.5 | 179.4 | 169.7 | 174.1 | 175.4 | 0 | 110.3 | E175 A176 L177 L206 R207 L212 T213 E214 | E175-K210 WeakPolarHBondContact OE1-CE 3.1Å; E175-K210 IonicContact OE1-NZ 2.68Å; E175-K210 PolarHBondContact OE1-NZ 3Å; A176-K210 PolarHBondContact O-NZ 3.28Å; A176-K210 VanDerWaalsContact O-NZ 3.08Å; L177-K210 HydrophobicContact CD2-CD 4.03Å; L206-K210 WeakPolarHBondContact O-CB 3.43Å; L206-K210 PolarHBondContact O-N 3.01Å; R207-K210 PolarHBondContact O-N 3.19Å; K210-L212 PolarHBondContact O-N 2.82Å; K210-T213 PolarHBondContact O-N 3.33Å; K210-E214 WeakPolarHBondContact CE-OE1 3.3Å; K210-E214 WeakPolarHBondContact CG-OE1 3.36Å; K210-E214 WeakPolarHBondContact O-CB 2.77Å; K210-E214 WeakPolarHBondContact O-CG 3.44Å; K210-E214 PolarHBondContact O-N 3.17Å |
| 211 | L | 81.9 | Confident | 78.2 | Confident | 116 Ų | 116 | 99.2 Ų | 99.2 | 61% | 0.607 | 49% | 0.488 | S | S | * | . | H | α-helix | trans | -58.5 | -44.6 | 176.9 | -70.3 | 169.4 | 0 | 0 | 0 | 113.1 | R207 Q208 E214 A215 | R207-L211 WeakPolarHBondContact O-CG 3.4Å; R207-L211 PolarHBondContact O-N 2.73Å; Q208-L211 PolarHBondContact O-N 3.1Å; L211-E214 PolarHBondContact O-N 2.98Å; L211-A215 PolarHBondContact O-N 3.1Å |
| 212 | L | 77.6 | Confident | 76.6 | Confident | 125 Ų | 125 | 100.5 Ų | 100.5 | 65% | 0.654 | 50% | 0.498 | S | S | * | . | H | α-helix | trans | -64.4 | -43.3 | 176.1 | -72.3 | 170.3 | 0 | 0 | 0 | 112.2 | Q208 K210 E214 A215 Q216 | Q208-L212 WeakPolarHBondContact O-CG 3.48Å; Q208-L212 PolarHBondContact O-N 3.29Å; K210-L212 PolarHBondContact O-N 2.82Å; L212-E214 VanDerWaalsContact C-N 3.28Å; L212-E214 PolarHBondContact O-N 3.46Å; L212-A215 PolarHBondContact O-N 3.44Å; L212-Q216 WeakPolarHBondContact O-CB 3.32Å; L212-Q216 PolarHBondContact O-N 3.48Å |
| 213 | T | 78.5 | Confident | 75.1 | Confident | 60 Ų | 60 | 101.5 Ų | 101.5 | 37% | 0.368 | 50% | 0.504 | S | S | . | . | H | α-helix | trans | -64.5 | -35.4 | 176.9 | -55.7 | 0 | 0 | 0 | 0 | 111.2 | R209 K210 K217 | R209-T213 VanDerWaalsContact O-CB 3.28Å; R209-T213 WeakPolarHBondContact O-CB 3.48Å; R209-T213 PolarHBondContact O-N 3.05Å; R209-T213 PolarHBondContact O-OG1 3.48Å; K210-T213 PolarHBondContact O-N 3.33Å; T213-K217 HydrophobicContact CG2-CD 4.21Å; T213-K217 WeakPolarHBondContact O-CB 3.41Å; T213-K217 VanDerWaalsContact O-CG 3.25Å; T213-K217 WeakPolarHBondContact O-CG 3.18Å; T213-K217 PolarHBondContact O-N 2.92Å |
| 214 | E | 73.8 | Confident | 73.8 | Confident | 32 Ų | 32 | 105.5 Ų | 105.5 | 15% | 0.15 | 53% | 0.525 | C | S | . | . | H | α-helix | trans | -73.3 | -40.3 | 175.5 | -80.4 | -178.5 | -134.9 | 0 | 0 | 113.2 | K210 L211 L212 Q216 K217 K218 | K210-E214 WeakPolarHBondContact CE-OE1 3.3Å; K210-E214 WeakPolarHBondContact CG-OE1 3.36Å; K210-E214 WeakPolarHBondContact O-CB 2.77Å; K210-E214 WeakPolarHBondContact O-CG 3.44Å; K210-E214 PolarHBondContact O-N 3.17Å; L211-E214 PolarHBondContact O-N 2.98Å; L212-E214 VanDerWaalsContact C-N 3.28Å; L212-E214 PolarHBondContact O-N 3.46Å; E214-Q216 VanDerWaalsContact C-N 3.28Å; E214-Q216 PolarHBondContact O-N 3.17Å; E214-K217 CarbonylContact O-C 3.55Å; E214-K217 PolarHBondContact O-N 3.5Å; E214-K217 VanDerWaalsContact O-N 3.16Å; E214-K218 HydrophobicContact CB-CD 4.33Å; E214-K218 WeakPolarHBondContact O-CB 3.29Å; E214-K218 WeakPolarHBondContact O-CG 3.47Å; E214-K218 PolarHBondContact O-N 2.92Å; E214-K218 IonicContact OE2-NZ 2.78Å; E214-K218 PolarHBondContact OE2-NZ 3.01Å |
| 215 | A | 69.7 | Low | 72.5 | Confident | 58 Ų | 58 | 102 Ų | 102 | 48% | 0.479 | 53% | 0.525 | S | S | . | . | H | α-helix | trans | -58.4 | -44.2 | 171.5 | 0 | 0 | 0 | 0 | 0 | 110.7 | L211 L212 K217 K218 G219 | L211-A215 PolarHBondContact O-N 3.1Å; L212-A215 PolarHBondContact O-N 3.44Å; A215-K217 VanDerWaalsContact C-N 3.34Å; A215-K217 PolarHBondContact O-N 3.35Å; A215-K218 PolarHBondContact O-N 3.34Å; A215-G219 PolarHBondContact O-N 3.32Å |
| 216 | Q | 66.4 | Low | 71.2 | Confident | 164 Ų | 164 | 101.5 Ų | 101.5 | 77% | 0.766 | 53% | 0.528 | S | S | * | . | H | α-helix | trans | -62.5 | -36.5 | 174.8 | -167.6 | 179 | 14 | 0 | 0 | 112.8 | L212 E214 | L212-Q216 WeakPolarHBondContact O-CB 3.32Å; L212-Q216 PolarHBondContact O-N 3.48Å; E214-Q216 VanDerWaalsContact C-N 3.28Å; E214-Q216 PolarHBondContact O-N 3.17Å |
| 217 | K | 65.8 | Low | 69.8 | Low | 167 Ų | 167 | 104.9 Ų | 104.9 | 73% | 0.726 | 55% | 0.545 | S | S | * | . | H | α-helix | trans | -78.1 | -29.1 | 175.6 | -75.8 | 171.3 | 179.2 | 175.6 | 0 | 114.1 | T213 E214 A215 G219 | T213-K217 HydrophobicContact CG2-CD 4.21Å; T213-K217 WeakPolarHBondContact O-CB 3.41Å; T213-K217 VanDerWaalsContact O-CG 3.25Å; T213-K217 WeakPolarHBondContact O-CG 3.18Å; T213-K217 PolarHBondContact O-N 2.92Å; E214-K217 CarbonylContact O-C 3.55Å; E214-K217 PolarHBondContact O-N 3.5Å; E214-K217 VanDerWaalsContact O-N 3.16Å; A215-K217 VanDerWaalsContact C-N 3.34Å; A215-K217 PolarHBondContact O-N 3.35Å; K217-G219 VanDerWaalsContact C-N 3.32Å |
| 218 | K | 63.3 | Low | 68.6 | Low | 158 Ų | 158 | 103.5 Ų | 103.5 | 69% | 0.687 | 55% | 0.549 | S | S | * | . | H | α-helix | trans | -80.9 | -11.5 | -177.1 | -75.6 | 165.1 | 175.8 | 165.7 | 0 | 112.8 | E214 A215 | E214-K218 HydrophobicContact CB-CD 4.33Å; E214-K218 WeakPolarHBondContact O-CB 3.29Å; E214-K218 WeakPolarHBondContact O-CG 3.47Å; E214-K218 PolarHBondContact O-N 2.92Å; E214-K218 IonicContact OE2-NZ 2.78Å; E214-K218 PolarHBondContact OE2-NZ 3.01Å; A215-K218 PolarHBondContact O-N 3.34Å |
| 219 | G | 56.4 | Low | 67.6 | Low | 38 Ų | 38 | 102.3 Ų | 102.3 | 39% | 0.392 | 56% | 0.556 | S | S | . | * | T | Hydrogen-bonded Turn | trans | 107.3 | 42.6 | 149.8 | 0 | 0 | 0 | 0 | 0 | 117.2 | A215 K217 V221 | A215-G219 PolarHBondContact O-N 3.32Å; K217-G219 VanDerWaalsContact C-N 3.32Å; G219-V221 PolarHBondContact O-N 3.16Å |
| 220 | D | 55.9 | Low | 66.3 | Low | 113 Ų | 113 | 100.6 Ų | 100.6 | 60% | 0.604 | 56% | 0.56 | S | S | * | * | trans | -78.3 | 39.9 | 178.4 | -120.7 | 28.5 | 0 | 0 | 0 | 114.1 | N222 N223 | D220-N222 PolarHBondContact O-N 3.47Å; D220-N222 VanDerWaalsContact O-N 3.09Å; D220-N223 VanDerWaalsContact CG-ND2 3.33Å; D220-N223 PolarHBondContact O-N 3.47Å; D220-N223 VanDerWaalsContact O-N 3.13Å; D220-N223 PolarHBondContact OD2-ND2 3.48Å | ||
| 221 | V | 60.3 | Low | 64.9 | Low | 110 Ų | 110 | 104.4 Ų | 104.4 | 67% | 0.667 | 58% | 0.58 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -60.4 | -20.2 | -178.9 | -74.5 | 0 | 0 | 0 | 0 | 113.7 | G219 | G219-V221 PolarHBondContact O-N 3.16Š|
| 222 | N | 59.5 | Low | 63.9 | Low | 138 Ų | 138 | 108.5 Ų | 108.5 | 74% | 0.738 | 59% | 0.593 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -74.5 | -26 | 178.7 | -62.2 | -20.2 | 0 | 0 | 0 | 113 | D220 | D220-N222 PolarHBondContact O-N 3.47Å; D220-N222 VanDerWaalsContact O-N 3.09Å |
| 223 | N | 59 | Low | 62.9 | Low | 84 Ų | 84 | 108.2 Ų | 108.2 | 45% | 0.449 | 60% | 0.597 | S | S | . | * | T | Hydrogen-bonded Turn | trans | -85.7 | -11.6 | -175.8 | -72.4 | -28.9 | 0 | 0 | 0 | 113.5 | D220 G225 V226 L227 | D220-N223 VanDerWaalsContact CG-ND2 3.33Å; D220-N223 PolarHBondContact O-N 3.47Å; D220-N223 VanDerWaalsContact O-N 3.13Å; D220-N223 PolarHBondContact OD2-ND2 3.48Å; N223-G225 VanDerWaalsContact C-N 3.31Å; N223-G225 PolarHBondContact O-N 3.48Å; N223-V226 PolarHBondContact O-N 2.87Å; N223-L227 PolarHBondContact O-N 2.87Å |
| 224 | L | 63.9 | Low | 61.2 | Low | 107 Ų | 107 | 108.6 Ų | 108.6 | 56% | 0.56 | 61% | 0.612 | S | S | * | * | H | α-helix | trans | -64 | -34.7 | 178.1 | -131 | 170.9 | 0 | 0 | 0 | 112.3 | L227 L228 | L224-L227 PolarHBondContact O-N 3.21Å; L224-L228 HydrophobicContact CD2-CD1 3.47Å; L224-L228 VanDerWaalsContact CD2-CD1 3.47Å; L224-L228 WeakPolarHBondContact O-CD1 3.25Å; L224-L228 PolarHBondContact O-N 3.47Å; L224-L228 VanDerWaalsContact O-N 3.11Å |
| 225 | G | 63.4 | Low | 60 | Low | 53 Ų | 53 | 116.7 Ų | 116.7 | 55% | 0.546 | 65% | 0.647 | S | S | . | * | H | α-helix | trans | -67.5 | -37.3 | 177.6 | 0 | 0 | 0 | 0 | 0 | 113.6 | N223 L228 A229 | N223-G225 VanDerWaalsContact C-N 3.31Å; N223-G225 PolarHBondContact O-N 3.48Å; G225-L228 PolarHBondContact O-N 3.22Å; G225-A229 PolarHBondContact O-N 3.36Å; G225-A229 VanDerWaalsContact O-N 3.15Å |
| 226 | V | 63 | Low | 58.9 | Low | 87 Ų | 87 | 125.2 Ų | 125.2 | 53% | 0.527 | 67% | 0.667 | S | S | . | * | H | α-helix | trans | -67.9 | -44 | 175.7 | -174.5 | 0 | 0 | 0 | 0 | 110 | N223 L228 A229 D230 | N223-V226 PolarHBondContact O-N 2.87Å; V226-L228 VanDerWaalsContact C-N 3.3Å; V226-L228 PolarHBondContact O-N 3.38Å; V226-A229 WeakPolarHBondContact O-CB 3.45Å; V226-A229 PolarHBondContact O-N 3.39Å; V226-D230 PolarHBondContact O-N 2.89Å |
| 227 | L | 61.6 | Low | 58.2 | Low | 120 Ų | 120 | 123.6 Ų | 123.6 | 63% | 0.628 | 67% | 0.673 | S | S | * | * | H | α-helix | trans | -62 | -33 | 177.6 | -116.5 | 166.4 | 0 | 0 | 0 | 113.3 | N223 L224 M231 | N223-L227 PolarHBondContact O-N 2.87Å; L224-L227 PolarHBondContact O-N 3.21Å; L227-M231 WeakPolarHBondContact O-CG 3.38Å |
| 228 | L | 61.9 | Low | 57.2 | Low | 118 Ų | 118 | 118.8 Ų | 118.8 | 62% | 0.618 | 67% | 0.671 | S | S | * | * | H | α-helix | trans | -74.8 | -30.3 | 171.5 | -96.4 | 83.9 | 0 | 0 | 0 | 113.4 | L224 G225 V226 M231 | L224-L228 HydrophobicContact CD2-CD1 3.47Å; L224-L228 VanDerWaalsContact CD2-CD1 3.47Å; L224-L228 WeakPolarHBondContact O-CD1 3.25Å; L224-L228 PolarHBondContact O-N 3.47Å; L224-L228 VanDerWaalsContact O-N 3.11Å; G225-L228 PolarHBondContact O-N 3.22Å; V226-L228 VanDerWaalsContact C-N 3.3Å; V226-L228 PolarHBondContact O-N 3.38Å; L228-M231 PolarHBondContact O-N 2.85Å |
| 229 | A | 66.1 | Low | 56.6 | Low | 79 Ų | 79 | 123.1 Ų | 123.1 | 65% | 0.653 | 68% | 0.683 | S | S | * | * | H | α-helix | trans | -68.1 | -40 | -178.6 | 0 | 0 | 0 | 0 | 0 | 112.3 | G225 V226 M231 | G225-A229 PolarHBondContact O-N 3.36Å; G225-A229 VanDerWaalsContact O-N 3.15Å; V226-A229 WeakPolarHBondContact O-CB 3.45Å; V226-A229 PolarHBondContact O-N 3.39Å; A229-M231 VanDerWaalsContact C-N 3.32Å; A229-M231 PolarHBondContact O-N 3.19Å |
| 230 | D | 59.8 | Low | 56.3 | Low | 136 Ų | 136 | 130.1 Ų | 130.1 | 73% | 0.727 | 71% | 0.705 | S | S | * | * | S | Bend | trans | -79 | -11.6 | -179.9 | -71.5 | -25.6 | 0 | 0 | 0 | 113.7 | V226 K232 | V226-D230 PolarHBondContact O-N 2.89Å; D230-K232 VanDerWaalsContact C-N 3.27Å; D230-K232 PolarHBondContact O-N 3.13Å |
| 231 | M | 55.5 | Low | 55.8 | Low | 129 Ų | 129 | 131.6 Ų | 131.6 | 64% | 0.635 | 71% | 0.713 | S | S | * | * | trans | -73.5 | 74.9 | 175.1 | -80.8 | -166.6 | 71.3 | 0 | 0 | 112.4 | L227 L228 A229 V233 | L227-M231 WeakPolarHBondContact O-CG 3.38Å; L228-M231 PolarHBondContact O-N 2.85Å; A229-M231 VanDerWaalsContact C-N 3.32Å; A229-M231 PolarHBondContact O-N 3.19Å; M231-V233 VanDerWaalsContact C-N 3.3Å; M231-V233 PolarHBondContact O-N 3.2Å | ||
| 232 | K | 60.9 | Low | 55.2 | Low | 202 Ų | 202 | 131.2 Ų | 131.2 | 88% | 0.878 | 72% | 0.721 | S | S | * | * | trans | -70.5 | 76.1 | 177.9 | -165.9 | 172.2 | -174.5 | 172.3 | 0 | 112.7 | D230 G234 | D230-K232 VanDerWaalsContact C-N 3.27Å; D230-K232 PolarHBondContact O-N 3.13Å; K232-G234 PolarHBondContact O-N 2.82Å | ||
| 233 | V | 55.6 | Low | 54.9 | Low | 120 Ų | 120 | 133.9 Ų | 133.9 | 73% | 0.727 | 72% | 0.721 | S | S | * | * | trans | -59.2 | 120.7 | 178.7 | 179.1 | 0 | 0 | 0 | 0 | 111.3 | M231 K235 | M231-V233 VanDerWaalsContact C-N 3.3Å; M231-V233 PolarHBondContact O-N 3.2Å; V233-K235 PolarHBondContact O-N 3.2Å | ||
| 234 | G | 44.2 | Very low | 54.2 | Low | 67 Ų | 67 | 135 Ų | 135 | 69% | 0.691 | 73% | 0.734 | S | S | * | * | trans | -66.6 | 93.7 | 179.6 | 0 | 0 | 0 | 0 | 0 | 113 | K232 R236 | K232-G234 PolarHBondContact O-N 2.82Å; G234-R236 PolarHBondContact O-N 3.26Å | ||
| 235 | K | 48.4 | Very low | 53.5 | Low | 202 Ų | 202 | 136.6 Ų | 136.6 | 88% | 0.878 | 75% | 0.748 | S | S | * | * | trans | -66.3 | 81.3 | -178.2 | -171.7 | -178.7 | -178.6 | 178.7 | 0 | 112.7 | V233 S237 | V233-K235 PolarHBondContact O-N 3.2Å; K235-S237 PolarHBondContact O-N 3.33Å | ||
| 236 | R | 45.8 | Very low | 52.9 | Low | 238 Ų | 238 | 141.3 Ų | 141.3 | 90% | 0.898 | 76% | 0.76 | S | S | * | * | trans | -62.2 | 126 | 167.9 | -69 | -173.3 | 177.6 | -171.2 | -0.6 | 109.5 | G234 G238 | G234-R236 PolarHBondContact O-N 3.26Å; R236-G238 PolarHBondContact O-N 3.03Å | ||
| 237 | S | 52.2 | Low | 52.6 | Low | 130 Ų | 130 | 143.9 Ų | 143.9 | 91% | 0.909 | 77% | 0.766 | S | S | * | * | trans | -79.8 | 77.9 | -175.1 | 53.2 | 0 | 0 | 0 | 0 | 112.1 | K235 | K235-S237 PolarHBondContact O-N 3.33Š| ||
| 238 | G | 45.8 | Very low | 52.2 | Low | 65 Ų | 65 | 144.5 Ų | 144.5 | 67% | 0.67 | 77% | 0.769 | S | S | * | * | trans | -134.6 | 84.6 | 174.7 | 0 | 0 | 0 | 0 | 0 | 111.6 | R236 Q240 | R236-G238 PolarHBondContact O-N 3.03Å; G238-Q240 PolarHBondContact O-N 3.15Å; G238-Q240 VanDerWaalsContact O-N 3.13Å | ||
| 239 | R | 49.1 | Very low | 51.7 | Low | 249 Ų | 249 | 147 Ų | 147 | 94% | 0.94 | 77% | 0.771 | S | S | * | * | trans | -75.4 | 97 | 171.6 | -88 | -173.2 | 169.6 | -177.5 | -3.1 | 109.8 | ||||
| 240 | Q | 50 | Low | 50.7 | Low | 185 Ų | 185 | 151.9 Ų | 151.9 | 86% | 0.864 | 78% | 0.777 | S | S | * | * | trans | -108 | 146 | 148.5 | -71 | -175.8 | -18.9 | 0 | 0 | 108.1 | G238 A242 | G238-Q240 PolarHBondContact O-N 3.15Å; G238-Q240 VanDerWaalsContact O-N 3.13Å; Q240-A242 PolarHBondContact O-N 3.11Å | ||
| 241 | N | 47 | Very low | 50.4 | Low | 145 Ų | 145 | 150 Ų | 150 | 78% | 0.775 | 77% | 0.767 | S | S | * | * | trans | -77.2 | 96.2 | -163.2 | -65.3 | -30 | 0 | 0 | 0 | 111.8 | W243 | N241-W243 VanDerWaalsContact C-N 3.3Å; N241-W243 PolarHBondContact O-N 3.48Å | ||
| 242 | A | 47.2 | Very low | 50.3 | Low | 101 Ų | 101 | 151.6 Ų | 151.6 | 84% | 0.835 | 78% | 0.778 | S | S | * | * | trans | -69.2 | 88.4 | 163.5 | 0 | 0 | 0 | 0 | 0 | 109.4 | Q240 | Q240-A242 PolarHBondContact O-N 3.11Š| ||
| 243 | W | 52.3 | Low | 50.4 | Low | 194 Ų | 194 | 149.5 Ų | 149.5 | 74% | 0.735 | 78% | 0.777 | S | S | * | * | trans | -62.1 | 147.6 | 166.7 | -82.2 | -14.5 | 0 | 0 | 0 | 110.4 | N241 T245 | N241-W243 VanDerWaalsContact C-N 3.3Å; N241-W243 PolarHBondContact O-N 3.48Å; W243-T245 PolarHBondContact O-N 3.46Å | ||
| 244 | P | 44.5 | Very low | 50.5 | Low | 109 Ų | 109 | 147.1 Ų | 147.1 | 71% | 0.708 | 78% | 0.776 | S | S | * | * | trans | -63 | 122.1 | 176.4 | -19.9 | 32.5 | 0 | 0 | 0 | 111.1 | N246 Q247 | P244-N246 PolarHBondContact O-N 3.34Å; P244-Q247 PolarHBondContact O-N 3.4Å | ||
| 245 | T | 50 | Low | 51.2 | Low | 140 Ų | 140 | 152.2 Ų | 152.2 | 86% | 0.859 | 78% | 0.782 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -63.3 | -4.8 | -175.1 | -38.8 | 0 | 0 | 0 | 0 | 114.6 | W243 | W243-T245 PolarHBondContact O-N 3.46Š|
| 246 | N | 50.9 | Low | 51.3 | Low | 152 Ų | 152 | 145.1 Ų | 145.1 | 81% | 0.813 | 77% | 0.766 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -108.1 | 22.2 | -172.8 | -63.6 | 2.9 | 0 | 0 | 0 | 113.5 | P244 I248 | P244-N246 PolarHBondContact O-N 3.34Å; N246-I248 PolarHBondContact O-N 3.19Å |
| 247 | Q | 55.3 | Low | 51.6 | Low | 140 Ų | 140 | 143.3 Ų | 143.3 | 65% | 0.654 | 76% | 0.761 | S | S | * | * | trans | -83.7 | 100.7 | 168.1 | -170.8 | 173.1 | 49.7 | 0 | 0 | 109.9 | P244 R249 | P244-Q247 PolarHBondContact O-N 3.4Å; Q247-R249 PolarHBondContact O-N 3.13Å; Q247-R249 VanDerWaalsContact O-N 3.17Å | ||
| 248 | I | 53.1 | Low | 51.8 | Low | 134 Ų | 134 | 142 Ų | 142 | 69% | 0.687 | 75% | 0.747 | S | S | * | * | P | Polyproline II helix | trans | -62.2 | 116.2 | 168.1 | -60.3 | 172.6 | 0 | 0 | 0 | 107.6 | N246 F250 | N246-I248 PolarHBondContact O-N 3.19Å; I248-F250 HydrophobicContact CG2-CD2 4.44Å; I248-F250 HydrophobicContact CG2-CE2 4.15Å; I248-F250 HydrophobicContact CG2-CZ 4.27Å |
| 249 | R | 52.2 | Low | 51.9 | Low | 171 Ų | 171 | 149.4 Ų | 149.4 | 65% | 0.645 | 76% | 0.755 | S | S | * | * | P | Polyproline II helix | trans | -92.4 | 138.1 | 161.6 | -68.3 | -172.8 | 172.8 | -148.7 | -3.8 | 107.8 | Q247 | Q247-R249 PolarHBondContact O-N 3.13Å; Q247-R249 VanDerWaalsContact O-N 3.17Å |
| 250 | F | 45.2 | Very low | 51.9 | Low | 180 Ų | 180 | 143.6 Ų | 143.6 | 79% | 0.789 | 74% | 0.742 | S | S | * | * | P | Polyproline II helix | trans | -91.1 | 117.3 | 172 | -69.8 | -91 | 0 | 0 | 0 | 107.6 | I248 D252 | I248-F250 HydrophobicContact CG2-CD2 4.44Å; I248-F250 HydrophobicContact CG2-CE2 4.15Å; I248-F250 HydrophobicContact CG2-CZ 4.27Å; F250-D252 PolarHBondContact O-N 3.09Å |
| 251 | D | 53.6 | Low | 52.1 | Low | 96 Ų | 96 | 146.7 Ų | 146.7 | 51% | 0.513 | 75% | 0.746 | S | S | . | * | trans | -88 | 85.6 | 177.5 | -60.6 | -36.1 | 0 | 0 | 0 | 108.9 | D253 G254 | D251-D253 PolarHBondContact O-N 2.92Å; D251-D253 VanDerWaalsContact O-N 3.14Å; D251-G254 PolarHBondContact O-N 3.41Å | ||
| 252 | D | 54 | Low | 52.2 | Low | 164 Ų | 164 | 141.3 Ų | 141.3 | 88% | 0.877 | 73% | 0.725 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -57.8 | -25.5 | -179.3 | -97.2 | -29.5 | 0 | 0 | 0 | 113.1 | F250 G254 | F250-D252 PolarHBondContact O-N 3.09Å; D252-G254 PolarHBondContact O-N 2.65Å |
| 253 | D | 61.5 | Low | 52.5 | Low | 158 Ų | 158 | 144.3 Ų | 144.3 | 85% | 0.845 | 73% | 0.725 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -71.7 | -6.1 | 178.2 | -60 | -46.8 | 0 | 0 | 0 | 113.8 | D251 Q255 | D251-D253 PolarHBondContact O-N 2.92Å; D251-D253 VanDerWaalsContact O-N 3.14Å; D253-Q255 PolarHBondContact O-N 3.07Å |
| 254 | G | 58.5 | Low | 52.5 | Low | 69 Ų | 69 | 140.4 Ų | 140.4 | 71% | 0.711 | 72% | 0.723 | S | S | * | * | trans | 68.5 | 2.1 | 174.8 | 0 | 0 | 0 | 0 | 0 | 116.1 | D251 D252 G256 | D251-G254 PolarHBondContact O-N 3.41Å; D252-G254 PolarHBondContact O-N 2.65Å; G254-G256 PolarHBondContact O-N 2.94Å | ||
| 255 | Q | 58.3 | Low | 53.2 | Low | 174 Ų | 174 | 137.6 Ų | 137.6 | 81% | 0.813 | 71% | 0.706 | S | S | * | * | trans | -91.9 | 83.4 | -177.6 | -170.2 | 149.5 | -71.5 | 0 | 0 | 111.8 | D253 | D253-Q255 PolarHBondContact O-N 3.07Š| ||
| 256 | G | 50.3 | Low | 53.5 | Low | 53 Ų | 53 | 138 Ų | 138 | 55% | 0.546 | 70% | 0.698 | S | S | . | * | trans | -55 | 148.6 | -170.5 | 0 | 0 | 0 | 0 | 0 | 116.8 | G254 V258 | G254-G256 PolarHBondContact O-N 2.94Å; G256-V258 PolarHBondContact O-N 3.07Å; G256-V258 VanDerWaalsContact O-N 3.11Å | ||
| 257 | Y | 52.2 | Low | 53.7 | Low | 200 Ų | 200 | 136.5 Ų | 136.5 | 78% | 0.784 | 69% | 0.689 | S | S | * | * | trans | -45.9 | 102 | -170.4 | -162.6 | -87.9 | 0 | 0 | 0 | 116 | R259 | Y257-R259 HydrophobicContact CD1-CG 4.39Å; Y257-R259 HydrophobicContact CE1-CG 4.14Å | ||
| 258 | V | 56.5 | Low | 53.6 | Low | 102 Ų | 102 | 131.3 Ų | 131.3 | 62% | 0.618 | 67% | 0.67 | S | S | * | * | trans | -85.8 | 129.5 | 170.4 | -176.1 | 0 | 0 | 0 | 0 | 110 | G256 D260 | G256-V258 PolarHBondContact O-N 3.07Å; G256-V258 VanDerWaalsContact O-N 3.11Å; V258-D260 PolarHBondContact O-N 3.22Å; V258-D260 VanDerWaalsContact O-N 3.08Å | ||
| 259 | R | 47.7 | Very low | 53.8 | Low | 221 Ų | 221 | 128.9 Ų | 128.9 | 83% | 0.834 | 66% | 0.659 | S | S | * | * | trans | -79.3 | 86.4 | 172.1 | -73.8 | -171.2 | 177.2 | -164.2 | 0.6 | 110.8 | Y257 R261 | Y257-R259 HydrophobicContact CD1-CG 4.39Å; Y257-R259 HydrophobicContact CE1-CG 4.14Å; R259-R261 VanDerWaalsContact C-N 3.27Å; R259-R261 PolarHBondContact O-N 3.14Å | ||
| 260 | D | 48.9 | Very low | 54.1 | Low | 127 Ų | 127 | 125.5 Ų | 125.5 | 68% | 0.679 | 66% | 0.657 | S | S | * | * | trans | -70.8 | 76.6 | 176.8 | -78.2 | -20.1 | 0 | 0 | 0 | 113.2 | V258 | V258-D260 PolarHBondContact O-N 3.22Å; V258-D260 VanDerWaalsContact O-N 3.08Å | ||
| 261 | R | 55.2 | Low | 54.7 | Low | 251 Ų | 251 | 124.5 Ų | 124.5 | 95% | 0.947 | 66% | 0.655 | S | S | * | * | trans | -177.6 | 78.3 | 149.6 | -100.6 | 157.7 | -168.6 | -119 | 0.4 | 110.3 | R259 | R259-R261 VanDerWaalsContact C-N 3.27Å; R259-R261 PolarHBondContact O-N 3.14Å | ||
| 262 | G | 48 | Very low | 54.9 | Low | 32 Ų | 32 | 127.2 Ų | 127.2 | 33% | 0.33 | 66% | 0.662 | S | S | . | * | S | Bend | trans | -150.6 | 141.3 | 170.2 | 0 | 0 | 0 | 0 | 0 | 110.1 | T264 S265 | G262-T264 PolarHBondContact O-N 3.13Å; G262-S265 PolarHBondContact O-N 2.96Å; G262-S265 PolarHBondContact O-OG 3.38Å; G262-S265 VanDerWaalsContact O-OG 3.06Å |
| 263 | I | 54.2 | Low | 55.1 | Low | 163 Ų | 163 | 129.8 Ų | 129.8 | 84% | 0.836 | 66% | 0.659 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -60 | -18 | -172.3 | -61.2 | 169 | 0 | 0 | 0 | 112.5 | S265 | I263-S265 VanDerWaalsContact C-N 3.27Å; I263-S265 PolarHBondContact O-N 2.98Å |
| 264 | T | 53.3 | Low | 55.3 | Low | 112 Ų | 112 | 132.7 Ų | 132.7 | 69% | 0.687 | 66% | 0.658 | S | S | * | * | H | α-helix | trans | -65.5 | -20.5 | 173.2 | 49 | 0 | 0 | 0 | 0 | 114.7 | G262 E266 L267 A268 | G262-T264 PolarHBondContact O-N 3.13Å; T264-E266 PolarHBondContact O-N 3.25Å; T264-L267 PolarHBondContact O-N 3Å; T264-A268 PolarHBondContact O-N 2.94Å; T264-A268 VanDerWaalsContact O-N 3.11Å |
| 265 | S | 57.8 | Low | 55.8 | Low | 50 Ų | 50 | 135.5 Ų | 135.5 | 35% | 0.35 | 66% | 0.657 | S | S | . | * | H | α-helix | trans | -67.8 | -35 | -176.8 | 63.5 | 0 | 0 | 0 | 0 | 113.3 | G262 I263 A268 N269 | G262-S265 PolarHBondContact O-N 2.96Å; G262-S265 PolarHBondContact O-OG 3.38Å; G262-S265 VanDerWaalsContact O-OG 3.06Å; I263-S265 VanDerWaalsContact C-N 3.27Å; I263-S265 PolarHBondContact O-N 2.98Å; S265-A268 WeakPolarHBondContact O-CB 3.47Å; S265-A268 PolarHBondContact O-N 3.25Å; S265-N269 PolarHBondContact O-N 2.82Å; S265-N269 PolarHBondContact O-ND2 2.87Å |
| 266 | E | 56.2 | Low | 56.8 | Low | 149 Ų | 149 | 133.9 Ų | 133.9 | 70% | 0.696 | 65% | 0.653 | S | S | * | * | H | α-helix | trans | -71.5 | -36.4 | 179.8 | -61.5 | -162.6 | -179.9 | 0 | 0 | 111.9 | T264 N269 V270 | T264-E266 PolarHBondContact O-N 3.25Å; E266-N269 WeakPolarHBondContact O-CB 3.31Å; E266-N269 PolarHBondContact O-N 2.73Å; E266-V270 PolarHBondContact O-N 2.85Å |
| 267 | L | 56.1 | Low | 58.1 | Low | 120 Ų | 120 | 140.8 Ų | 140.8 | 63% | 0.628 | 67% | 0.668 | S | S | * | * | H | α-helix | trans | -68.2 | -35.2 | 172.4 | -62.6 | 179 | 0 | 0 | 0 | 112.1 | T264 N269 V270 Q271 | T264-L267 PolarHBondContact O-N 3Å; L267-N269 PolarHBondContact O-N 3.35Å; L267-V270 WeakPolarHBondContact O-CB 3.32Å; L267-V270 PolarHBondContact O-N 3.32Å; L267-Q271 PolarHBondContact O-N 2.83Å |
| 268 | A | 54 | Low | 59.5 | Low | 31 Ų | 31 | 136.2 Ų | 136.2 | 26% | 0.256 | 66% | 0.663 | S | S | . | * | H | α-helix | trans | -61.3 | -32.5 | 172.9 | 0 | 0 | 0 | 0 | 0 | 112.1 | T264 S265 V270 Q271 K272 | T264-A268 PolarHBondContact O-N 2.94Å; T264-A268 VanDerWaalsContact O-N 3.11Å; S265-A268 WeakPolarHBondContact O-CB 3.47Å; S265-A268 PolarHBondContact O-N 3.25Å; A268-V270 VanDerWaalsContact C-N 3.29Å; A268-V270 PolarHBondContact O-N 3.4Å; A268-Q271 PolarHBondContact O-N 2.91Å; A268-K272 WeakPolarHBondContact O-CB 3.27Å; A268-K272 VanDerWaalsContact O-CG 3.27Å; A268-K272 WeakPolarHBondContact O-CG 3.37Å; A268-K272 PolarHBondContact O-N 3.27Å |
| 269 | N | 57 | Low | 60.6 | Low | 84 Ų | 84 | 134.7 Ų | 134.7 | 45% | 0.449 | 66% | 0.661 | S | S | . | * | H | α-helix | trans | -71.9 | -18.9 | 174.9 | -69.1 | -26.9 | 0 | 0 | 0 | 113.8 | S265 E266 L267 R273 | S265-N269 PolarHBondContact O-N 2.82Å; S265-N269 PolarHBondContact O-ND2 2.87Å; E266-N269 WeakPolarHBondContact O-CB 3.31Å; E266-N269 PolarHBondContact O-N 2.73Å; L267-N269 PolarHBondContact O-N 3.35Å; N269-R273 WeakPolarHBondContact O-CD 3Å; N269-R273 WeakPolarHBondContact O-CG 3.35Å; N269-R273 PolarHBondContact O-NE 2.73Å |
| 270 | V | 57.8 | Low | 62.4 | Low | 100 Ų | 100 | 134 Ų | 134 | 61% | 0.606 | 66% | 0.664 | S | S | * | * | H | α-helix | trans | -78.5 | -43.8 | 169.5 | -178.8 | 0 | 0 | 0 | 0 | 110.3 | E266 L267 A268 R273 | E266-V270 PolarHBondContact O-N 2.85Å; L267-V270 WeakPolarHBondContact O-CB 3.32Å; L267-V270 PolarHBondContact O-N 3.32Å; A268-V270 VanDerWaalsContact C-N 3.29Å; A268-V270 PolarHBondContact O-N 3.4Å; V270-R273 PolarHBondContact O-N 2.66Å |
| 271 | Q | 57.1 | Low | 64.1 | Low | 159 Ų | 159 | 134.8 Ų | 134.8 | 74% | 0.743 | 66% | 0.657 | S | S | * | * | H | α-helix | trans | -65.1 | -42 | 177.8 | -68.9 | 178.7 | -23.9 | 0 | 0 | 112.3 | L267 A268 R273 R274 | L267-Q271 PolarHBondContact O-N 2.83Å; A268-Q271 PolarHBondContact O-N 2.91Å; Q271-R273 PolarHBondContact O-N 2.78Å; Q271-R273 VanDerWaalsContact O-N 3.08Å; Q271-R274 PolarHBondContact O-N 3.32Å |
| 272 | K | 58 | Low | 65.5 | Low | 153 Ų | 153 | 129.9 Ų | 129.9 | 67% | 0.665 | 65% | 0.649 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -61.2 | -14.4 | 177.2 | -77 | 174.8 | 178.4 | -179.8 | 0 | 114.9 | A268 R274 | A268-K272 WeakPolarHBondContact O-CB 3.27Å; A268-K272 VanDerWaalsContact O-CG 3.27Å; A268-K272 WeakPolarHBondContact O-CG 3.37Å; A268-K272 PolarHBondContact O-N 3.27Å; K272-R274 VanDerWaalsContact C-N 3.32Å; K272-R274 PolarHBondContact O-N 3.31Å |
| 273 | R | 57.9 | Low | 67.3 | Low | 217 Ų | 217 | 133.8 Ų | 133.8 | 82% | 0.819 | 66% | 0.663 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -82.6 | -0.2 | -179.3 | -74.6 | 174.1 | -173.8 | -138.1 | 1.1 | 114.6 | N269 V270 Q271 | N269-R273 WeakPolarHBondContact O-CD 3Å; N269-R273 WeakPolarHBondContact O-CG 3.35Å; N269-R273 PolarHBondContact O-NE 2.73Å; V270-R273 PolarHBondContact O-N 2.66Å; Q271-R273 PolarHBondContact O-N 2.78Å; Q271-R273 VanDerWaalsContact O-N 3.08Å |
| 274 | R | 66.2 | Low | 69.1 | Low | 219 Ų | 219 | 132.1 Ų | 132.1 | 83% | 0.826 | 65% | 0.654 | S | S | * | * | trans | -129.4 | 78.7 | 179.2 | -67.3 | -174.7 | -179.4 | 174.2 | 1.1 | 112 | Q271 K272 | Q271-R274 PolarHBondContact O-N 3.32Å; K272-R274 VanDerWaalsContact C-N 3.32Å; K272-R274 PolarHBondContact O-N 3.31Å | ||
| 275 | N | 69.9 | Low | 70.7 | Confident | 129 Ų | 129 | 135.2 Ų | 135.2 | 69% | 0.69 | 66% | 0.658 | S | S | * | * | trans | -60.3 | 135.1 | 160 | -72.7 | -28 | 0 | 0 | 0 | 109 | P278 | N275-P278 HydrophobicContact CB-CG 3.78Å; N275-P278 WeakPolarHBondContact O-CD 3.04Å | ||
| 276 | I | 78.9 | Confident | 72 | Confident | 140 Ų | 140 | 137.4 Ų | 137.4 | 72% | 0.718 | 67% | 0.674 | S | S | * | * | S | Bend | trans | -77.3 | -36.8 | -174.7 | -57.8 | 171.2 | 0 | 0 | 0 | 111.3 | A279 | I276-A279 WeakPolarHBondContact O-CB 3.42Š|
| 277 | F | 77.9 | Confident | 73.1 | Confident | 197 Ų | 197 | 137.3 Ų | 137.3 | 86% | 0.864 | 67% | 0.673 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -70.6 | -32.9 | -173.1 | -57.3 | -74 | 0 | 0 | 0 | 117.6 | A279 | F277-A279 PolarHBondContact O-N 2.75Å; F277-A279 VanDerWaalsContact O-N 3.13Å |
| 278 | P | 80.9 | Confident | 73.9 | Confident | 105 Ų | 105 | 136.6 Ų | 136.6 | 68% | 0.682 | 67% | 0.674 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -76.5 | 14.9 | 176.5 | 31.9 | -37.4 | 0 | 0 | 0 | 114.6 | N275 | N275-P278 HydrophobicContact CB-CG 3.78Å; N275-P278 WeakPolarHBondContact O-CD 3.04Å |
| 279 | A | 78.9 | Confident | 74.5 | Confident | 69 Ų | 69 | 141.1 Ų | 141.1 | 57% | 0.57 | 70% | 0.698 | S | S | * | * | S | Bend | trans | -70.1 | 161.3 | 172.7 | 0 | 0 | 0 | 0 | 0 | 112.2 | I276 F277 R281 | I276-A279 WeakPolarHBondContact O-CB 3.42Å; F277-A279 PolarHBondContact O-N 2.75Å; F277-A279 VanDerWaalsContact O-N 3.13Å; A279-R281 PolarHBondContact O-N 2.82Å |
| 280 | K | 85.5 | Confident | 74.6 | Confident | 208 Ų | 208 | 142.5 Ų | 142.5 | 90% | 0.904 | 71% | 0.706 | S | S | * | * | trans | -65.7 | 100.5 | 174.8 | -176.2 | -179.7 | 178.1 | -178.5 | 0 | 110.2 | ||||
| 281 | R | 85.3 | Confident | 74.8 | Confident | 142 Ų | 142 | 146.1 Ų | 146.1 | 54% | 0.536 | 72% | 0.716 | S | S | . | * | trans | -70.4 | 164.2 | 179.1 | 74.2 | -179.2 | -178.6 | -169.9 | -3.6 | 113.1 | A279 N283 | A279-R281 PolarHBondContact O-N 2.82Å; R281-N283 WeakPolarHBondContact CG-OD1 3.45Å; R281-N283 PolarHBondContact NE-OD1 2.99Å; R281-N283 PolarHBondContact O-N 2.91Å | ||
| 282 | L | 85.3 | Confident | 74.9 | Confident | 148 Ų | 148 | 146.5 Ų | 146.5 | 78% | 0.775 | 72% | 0.718 | S | S | * | * | trans | -72.9 | 99.8 | 166.6 | -61 | 178.1 | 0 | 0 | 0 | 109.5 | I284 | L282-I284 HydrophobicContact CB-CD1 4.08Å; L282-I284 HydrophobicContact CB-CG1 4.23Å; L282-I284 HydrophobicContact CD1-CD1 4.36Å; L282-I284 PolarHBondContact O-N 2.93Å | ||
| 283 | N | 84.8 | Confident | 74.8 | Confident | 115 Ų | 115 | 141.5 Ų | 141.5 | 62% | 0.615 | 71% | 0.71 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -77.7 | 51.7 | 176.2 | -67.8 | -30.7 | 0 | 0 | 0 | 111.6 | R281 | R281-N283 WeakPolarHBondContact CG-OD1 3.45Å; R281-N283 PolarHBondContact NE-OD1 2.99Å; R281-N283 PolarHBondContact O-N 2.91Å |
| 284 | I | 92.8 | Very high | 74.7 | Confident | 127 Ų | 127 | 138.4 Ų | 138.4 | 65% | 0.651 | 71% | 0.709 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -84.8 | -44.8 | 177.9 | -62.1 | 170.4 | 0 | 0 | 0 | 109.7 | L282 | L282-I284 HydrophobicContact CB-CD1 4.08Å; L282-I284 HydrophobicContact CB-CG1 4.23Å; L282-I284 HydrophobicContact CD1-CD1 4.36Å; L282-I284 PolarHBondContact O-N 2.93Å |
| 285 | F | 86.6 | Confident | 74.3 | Confident | 177 Ų | 177 | 137.3 Ų | 137.3 | 78% | 0.776 | 71% | 0.714 | S | S | * | * | S | Bend | trans | -89.4 | 130.2 | 173.8 | -56.7 | -79.8 | 0 | 0 | 0 | 109.7 | ||
| 286 | S | 84.1 | Confident | 73.7 | Confident | 97 Ų | 97 | 135.8 Ų | 135.8 | 68% | 0.678 | 71% | 0.713 | S | S | * | * | trans | -66.5 | 163.9 | 165 | 50.3 | 0 | 0 | 0 | 0 | 110.2 | T288 | S286-T288 VanDerWaalsContact C-N 3.35Å; S286-T288 PolarHBondContact O-N 2.62Å; S286-T288 VanDerWaalsContact O-N 3.08Å | ||
| 287 | Q | 80.5 | Confident | 72.8 | Confident | 146 Ų | 146 | 133.3 Ų | 133.3 | 68% | 0.682 | 71% | 0.713 | S | S | * | * | trans | -80.8 | 89.4 | 170.4 | -73.7 | 174.4 | -76.8 | 0 | 0 | 108.5 | T289 | Q287-T289 PolarHBondContact O-N 3.33Å; Q287-T289 PolarHBondContact O-OG1 3.43Å | ||
| 288 | T | 72.5 | Confident | 72 | Confident | 105 Ų | 105 | 132.3 Ų | 132.3 | 64% | 0.644 | 72% | 0.716 | S | S | * | * | trans | -50.6 | 109.1 | 167.7 | 49.1 | 0 | 0 | 0 | 0 | 108.6 | S286 | S286-T288 VanDerWaalsContact C-N 3.35Å; S286-T288 PolarHBondContact O-N 2.62Å; S286-T288 VanDerWaalsContact O-N 3.08Å | ||
| 289 | T | 67 | Low | 71.8 | Confident | 126 Ų | 126 | 130.4 Ų | 130.4 | 77% | 0.773 | 71% | 0.709 | S | S | * | * | trans | -91.7 | -15.8 | 175.9 | -56.6 | 0 | 0 | 0 | 0 | 110.3 | Q287 E291 | Q287-T289 PolarHBondContact O-N 3.33Å; Q287-T289 PolarHBondContact O-OG1 3.43Å; T289-E291 PolarHBondContact O-N 3.3Å | ||
| 290 | D | 59 | Low | 72 | Confident | 113 Ų | 113 | 136.2 Ų | 136.2 | 60% | 0.604 | 72% | 0.722 | S | S | * | * | trans | -82.6 | 109.3 | 177.1 | -36.3 | -79.5 | 0 | 0 | 0 | 108.8 | Q292 | D290-Q292 PolarHBondContact O-N 2.95Š| ||
| 291 | E | 62.2 | Low | 72.1 | Confident | 177 Ų | 177 | 130.4 Ų | 130.4 | 83% | 0.827 | 71% | 0.705 | S | S | * | * | trans | -72.1 | 105.6 | 159.3 | -68.1 | 176.4 | -159.8 | 0 | 0 | 105.6 | T289 G293 | T289-E291 PolarHBondContact O-N 3.3Å; E291-G293 PolarHBondContact O-N 3.5Å | ||
| 292 | Q | 57.9 | Low | 72.5 | Confident | 167 Ų | 167 | 127.4 Ų | 127.4 | 78% | 0.78 | 70% | 0.703 | S | S | * | * | trans | -57.5 | 106 | 178.8 | -109.9 | 77 | 36.7 | 0 | 0 | 110 | D290 | D290-Q292 PolarHBondContact O-N 2.95Š| ||
| 293 | G | 56.6 | Low | 73 | Confident | 47 Ų | 47 | 126.6 Ų | 126.6 | 49% | 0.485 | 70% | 0.699 | S | S | . | * | trans | -76.8 | 137.2 | -175.7 | 0 | 0 | 0 | 0 | 0 | 113.3 | E291 E295 | E291-G293 PolarHBondContact O-N 3.5Å; G293-E295 VanDerWaalsContact C-N 3.26Å; G293-E295 PolarHBondContact O-N 2.78Å | ||
| 294 | D | 56.3 | Low | 73.5 | Confident | 152 Ų | 152 | 130.1 Ų | 130.1 | 81% | 0.813 | 70% | 0.703 | S | S | * | * | S | Bend | trans | 60.6 | -14.7 | 142.2 | -50.1 | -28.6 | 0 | 0 | 0 | 121.1 | S296 A297 | D294-S296 PolarHBondContact O-N 3.26Å; D294-S296 VanDerWaalsContact O-N 3.07Å; D294-A297 PolarHBondContact O-N 3.07Å |
| 295 | E | 56.7 | Low | 73.5 | Confident | 197 Ų | 197 | 128 Ų | 128 | 92% | 0.921 | 69% | 0.693 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -62.9 | -21 | -174 | -71.1 | -164.2 | 145.4 | 0 | 0 | 115 | G293 | G293-E295 VanDerWaalsContact C-N 3.26Å; G293-E295 PolarHBondContact O-N 2.78Å |
| 296 | S | 57.4 | Low | 73.9 | Confident | 97 Ų | 97 | 123.3 Ų | 123.3 | 68% | 0.678 | 68% | 0.676 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -100.7 | -4.4 | -177.4 | -146.7 | 0 | 0 | 0 | 0 | 114.6 | D294 L298 A299 | D294-S296 PolarHBondContact O-N 3.26Å; D294-S296 VanDerWaalsContact O-N 3.07Å; S296-L298 PolarHBondContact O-N 3.27Å; S296-A299 PolarHBondContact O-N 3.04Å |
| 297 | A | 60.5 | Low | 74.4 | Confident | 87 Ų | 87 | 124 Ų | 124 | 72% | 0.719 | 67% | 0.668 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -69 | -16.3 | -172.2 | 0 | 0 | 0 | 0 | 0 | 114.8 | D294 | D294-A297 PolarHBondContact O-N 3.07Š|
| 298 | L | 61.2 | Low | 75.1 | Confident | 176 Ų | 176 | 123 Ų | 123 | 92% | 0.921 | 66% | 0.661 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -96.7 | -13.2 | 177.8 | -64.6 | 173.8 | 0 | 0 | 0 | 113.3 | S296 | S296-L298 PolarHBondContact O-N 3.27Š|
| 299 | A | 77.7 | Confident | 76.1 | Confident | 65 Ų | 65 | 120.4 Ų | 120.4 | 54% | 0.537 | 65% | 0.651 | S | S | . | * | S | Bend | trans | -77.9 | 132.2 | 176.9 | 0 | 0 | 0 | 0 | 0 | 110 | S296 | S296-A299 PolarHBondContact O-N 3.04Š|
| 300 | K | 82.5 | Confident | 77.3 | Confident | 192 Ų | 192 | 118.7 Ų | 118.7 | 84% | 0.835 | 64% | 0.637 | S | S | * | * | P | Polyproline II helix | trans | -66.6 | 134.9 | 166.9 | -66.8 | -179.1 | -179.2 | 178.9 | 0 | 108 | ||
| 301 | P | 87.4 | Confident | 79 | Confident | 86 Ų | 86 | 118.7 Ų | 118.7 | 56% | 0.558 | 63% | 0.634 | S | S | * | * | P | Polyproline II helix | trans | -58.7 | 141.5 | -178.9 | 24 | -33.8 | 0 | 0 | 0 | 111.1 | D305 I306 | P301-D305 HydrophobicContact CB-CB 4.03Å; P301-I306 HydrophobicContact CB-CG1 4.24Å; P301-I306 HydrophobicContact CG-CD1 4.39Å; P301-I306 HydrophobicContact CG-CG1 4.21Å |
| 302 | T | 93.6 | Very high | 80.5 | Confident | 78 Ų | 78 | 114.1 Ų | 114.1 | 48% | 0.479 | 61% | 0.614 | S | S | . | * | P | Polyproline II helix | trans | -66.6 | 157.5 | 178.3 | -36.4 | 0 | 0 | 0 | 0 | 109.8 | W304 D305 I306 | T302-W304 PolarHBondContact O-N 2.87Å; T302-D305 WeakPolarHBondContact CA-OD2 3.38Å; T302-D305 WeakPolarHBondContact CB-OD2 3.4Å; T302-D305 PolarHBondContact N-OD2 3.2Å; T302-D305 WeakPolarHBondContact O-CB 3.37Å; T302-D305 PolarHBondContact O-N 3.17Å; T302-D305 PolarHBondContact OG1-OD2 3.22Å; T302-I306 WeakPolarHBondContact O-CG1 3.28Å; T302-I306 PolarHBondContact O-N 3.38Å |
| 303 | L | 95.3 | Very high | 82 | Confident | 132 Ų | 132 | 108.2 Ų | 108.2 | 69% | 0.691 | 59% | 0.591 | S | S | * | * | H | α-helix | trans | -52 | -39.5 | 171.4 | -179 | 60.9 | 0 | 0 | 0 | 112.2 | I306 E307 | L303-I306 PolarHBondContact O-N 3.43Å; L303-E307 WeakPolarHBondContact O-CB 3.16Å; L303-E307 PolarHBondContact O-N 3Å |
| 304 | W | 95.3 | Very high | 83.5 | Confident | 189 Ų | 189 | 112.1 Ų | 112.1 | 72% | 0.716 | 60% | 0.601 | S | S | * | * | H | α-helix | trans | -62.8 | -39.3 | 174.7 | -62.7 | 118.6 | 0 | 0 | 0 | 113.5 | T302 I306 E307 F308 | T302-W304 PolarHBondContact O-N 2.87Å; W304-I306 VanDerWaalsContact C-N 3.32Å; W304-E307 WeakPolarHBondContact CZ3-OE2 3.42Å; W304-E307 PolarHBondContact O-N 2.97Å; W304-F308 VanDerWaalsContact O-CB 3.25Å; W304-F308 WeakPolarHBondContact O-CB 3.36Å; W304-F308 PolarHBondContact O-N 3.16Å |
| 305 | D | 93.9 | Very high | 85.1 | Confident | 83 Ų | 83 | 111 Ų | 111 | 44% | 0.444 | 59% | 0.594 | S | S | . | * | H | α-helix | trans | -67.6 | -37.2 | 178.1 | -54 | -45.8 | 0 | 0 | 0 | 110.6 | P301 T302 A309 | P301-D305 HydrophobicContact CB-CB 4.03Å; T302-D305 WeakPolarHBondContact CA-OD2 3.38Å; T302-D305 WeakPolarHBondContact CB-OD2 3.4Å; T302-D305 PolarHBondContact N-OD2 3.2Å; T302-D305 WeakPolarHBondContact O-CB 3.37Å; T302-D305 PolarHBondContact O-N 3.17Å; T302-D305 PolarHBondContact OG1-OD2 3.22Å; D305-A309 VanDerWaalsContact O-CB 3.22Å; D305-A309 WeakPolarHBondContact O-CB 3.18Å; D305-A309 PolarHBondContact O-N 2.83Å |
| 306 | I | 94.3 | Very high | 86.4 | Confident | 78 Ų | 78 | 106.7 Ų | 106.7 | 40% | 0.4 | 58% | 0.581 | S | S | . | * | H | α-helix | trans | -69.5 | -44.9 | 175.8 | -62.3 | 167.1 | 0 | 0 | 0 | 110.9 | P301 T302 L303 W304 A309 N310 | P301-I306 HydrophobicContact CB-CG1 4.24Å; P301-I306 HydrophobicContact CG-CD1 4.39Å; P301-I306 HydrophobicContact CG-CG1 4.21Å; T302-I306 WeakPolarHBondContact O-CG1 3.28Å; T302-I306 PolarHBondContact O-N 3.38Å; L303-I306 PolarHBondContact O-N 3.43Å; W304-I306 VanDerWaalsContact C-N 3.32Å; I306-A309 PolarHBondContact O-N 3.34Å; I306-N310 WeakPolarHBondContact O-CB 3.43Å; I306-N310 PolarHBondContact O-N 2.98Å; I306-N310 PolarHBondContact O-ND2 2.64Å; I306-N310 VanDerWaalsContact O-ND2 3.14Å |
| 307 | E | 95.2 | Very high | 87.4 | Confident | 110 Ų | 110 | 107.5 Ų | 107.5 | 51% | 0.514 | 58% | 0.578 | S | S | . | * | H | α-helix | trans | -63.1 | -44.8 | 177 | -174.9 | 170.6 | -153.1 | 0 | 0 | 111.5 | L303 W304 N310 E311 | L303-E307 WeakPolarHBondContact O-CB 3.16Å; L303-E307 PolarHBondContact O-N 3Å; W304-E307 WeakPolarHBondContact CZ3-OE2 3.42Å; W304-E307 PolarHBondContact O-N 2.97Å; E307-N310 WeakPolarHBondContact O-CB 3.34Å; E307-N310 PolarHBondContact O-N 3.22Å; E307-E311 PolarHBondContact O-N 3.09Å |
| 308 | F | 95.2 | Very high | 88.3 | Confident | 125 Ų | 125 | 111.2 Ų | 111.2 | 55% | 0.548 | 58% | 0.58 | S | S | . | * | H | α-helix | trans | -65.2 | -40.5 | 176.1 | -175.8 | -116.3 | 0 | 0 | 0 | 112.4 | W304 N310 E311 L312 | W304-F308 VanDerWaalsContact O-CB 3.25Å; W304-F308 WeakPolarHBondContact O-CB 3.36Å; W304-F308 PolarHBondContact O-N 3.16Å; F308-N310 VanDerWaalsContact C-N 3.3Å; F308-N310 PolarHBondContact O-N 3.42Å; F308-E311 PolarHBondContact O-N 3.44Å; F308-L312 HydrophobicContact CD1-CD1 4.02Å; F308-L312 HydrophobicContact CE1-CD1 3.66Å; F308-L312 HydrophobicContact CE1-CG 4.31Å; F308-L312 HydrophobicContact CE2-CG 4.47Å; F308-L312 HydrophobicContact CZ-CD1 4.02Å; F308-L312 HydrophobicContact CZ-CD2 4.32Å; F308-L312 HydrophobicContact CZ-CG 4.25Å; F308-L312 WeakPolarHBondContact O-CG 3.44Å; F308-L312 PolarHBondContact O-N 2.87Å |
| 309 | A | 93.8 | Very high | 89.5 | Confident | 52 Ų | 52 | 111.8 Ų | 111.8 | 43% | 0.43 | 58% | 0.575 | S | S | . | * | H | α-helix | trans | -62.1 | -37.2 | 172.4 | 0 | 0 | 0 | 0 | 0 | 112.2 | D305 I306 S313 | D305-A309 VanDerWaalsContact O-CB 3.22Å; D305-A309 WeakPolarHBondContact O-CB 3.18Å; D305-A309 PolarHBondContact O-N 2.83Å; I306-A309 PolarHBondContact O-N 3.34Å; A309-S313 WeakPolarHBondContact O-CB 3.34Å; A309-S313 PolarHBondContact O-N 3.37Å |
| 310 | N | 92.1 | Very high | 89.9 | Confident | 90 Ų | 90 | 110.5 Ų | 110.5 | 48% | 0.481 | 56% | 0.561 | S | S | . | * | H | α-helix | trans | -66.1 | -43.3 | 174 | -71.7 | -31.7 | 0 | 0 | 0 | 111.7 | I306 E307 F308 S313 L314 | I306-N310 WeakPolarHBondContact O-CB 3.43Å; I306-N310 PolarHBondContact O-N 2.98Å; I306-N310 PolarHBondContact O-ND2 2.64Å; I306-N310 VanDerWaalsContact O-ND2 3.14Å; E307-N310 WeakPolarHBondContact O-CB 3.34Å; E307-N310 PolarHBondContact O-N 3.22Å; F308-N310 VanDerWaalsContact C-N 3.3Å; F308-N310 PolarHBondContact O-N 3.42Å; N310-S313 WeakPolarHBondContact O-CB 3.38Å; N310-S313 PolarHBondContact O-N 2.9Å; N310-S313 VanDerWaalsContact O-N 3.15Å; N310-S313 PolarHBondContact O-OG 2.97Å; N310-L314 WeakPolarHBondContact O-CG 3.29Å; N310-L314 PolarHBondContact O-N 3.46Å |
| 311 | E | 94.8 | Very high | 90.2 | Very high | 113 Ų | 113 | 112.4 Ų | 112.4 | 53% | 0.528 | 56% | 0.563 | S | S | . | * | H | α-helix | trans | -60 | -47.8 | 174.6 | -172.3 | -177.6 | -168.2 | 0 | 0 | 111.6 | E307 F308 S313 L314 L315 | E307-E311 PolarHBondContact O-N 3.09Å; F308-E311 PolarHBondContact O-N 3.44Å; E311-S313 PolarHBondContact O-N 3.42Å; E311-L314 PolarHBondContact O-N 3.42Å; E311-L314 VanDerWaalsContact O-N 3.08Å; E311-L315 HydrophobicContact CG-CD1 4.4Å; E311-L315 WeakPolarHBondContact O-CG 3.43Å; E311-L315 PolarHBondContact O-N 3.11Å |
| 312 | L | 92.9 | Very high | 90.5 | Very high | 81 Ų | 81 | 113 Ų | 113 | 42% | 0.424 | 56% | 0.562 | S | S | . | * | H | α-helix | trans | -58.4 | -36.9 | 173.9 | -70.2 | 176.2 | 0 | 0 | 0 | 112.2 | F308 T316 | F308-L312 HydrophobicContact CD1-CD1 4.02Å; F308-L312 HydrophobicContact CE1-CD1 3.66Å; F308-L312 HydrophobicContact CE1-CG 4.31Å; F308-L312 HydrophobicContact CE2-CG 4.47Å; F308-L312 HydrophobicContact CZ-CD1 4.02Å; F308-L312 HydrophobicContact CZ-CD2 4.32Å; F308-L312 HydrophobicContact CZ-CG 4.25Å; F308-L312 WeakPolarHBondContact O-CG 3.44Å; F308-L312 PolarHBondContact O-N 2.87Å; L312-T316 WeakPolarHBondContact O-CB 3.3Å; L312-T316 PolarHBondContact O-N 3.29Å; L312-T316 VanDerWaalsContact O-N 3.16Å; L312-T316 PolarHBondContact O-OG1 3.1Å |
| 313 | S | 88.8 | Confident | 90.6 | Very high | 42 Ų | 42 | 110.9 Ų | 110.9 | 29% | 0.294 | 56% | 0.556 | S | S | . | * | H | α-helix | trans | -64.9 | -43.8 | 174.1 | 89.4 | 0 | 0 | 0 | 0 | 111.6 | A309 N310 E311 L315 T316 N317 | A309-S313 WeakPolarHBondContact O-CB 3.34Å; A309-S313 PolarHBondContact O-N 3.37Å; N310-S313 WeakPolarHBondContact O-CB 3.38Å; N310-S313 PolarHBondContact O-N 2.9Å; N310-S313 VanDerWaalsContact O-N 3.15Å; N310-S313 PolarHBondContact O-OG 2.97Å; E311-S313 PolarHBondContact O-N 3.42Å; S313-L315 PolarHBondContact O-N 3.42Å; S313-T316 CarbonylContact O-C 3.57Å; S313-T316 PolarHBondContact O-N 2.87Å; S313-T316 VanDerWaalsContact O-N 3.08Å; S313-N317 WeakPolarHBondContact O-CB 3.34Å; S313-N317 PolarHBondContact O-N 3.06Å; S313-N317 PolarHBondContact O-ND2 3.21Å; S313-N317 VanDerWaalsContact O-ND2 3.1Å |
| 314 | L | 87.9 | Confident | 90.6 | Very high | 130 Ų | 130 | 111.4 Ų | 111.4 | 68% | 0.681 | 55% | 0.553 | S | S | * | * | H | α-helix | trans | -65.4 | -36.8 | 179.3 | -70 | 170.8 | 0 | 0 | 0 | 112.2 | N310 E311 T316 | N310-L314 WeakPolarHBondContact O-CG 3.29Å; N310-L314 PolarHBondContact O-N 3.46Å; E311-L314 PolarHBondContact O-N 3.42Å; E311-L314 VanDerWaalsContact O-N 3.08Å; L314-T316 VanDerWaalsContact C-N 3.26Å; L314-T316 PolarHBondContact O-N 3.43Å |
| 315 | L | 90.3 | Very high | 90.5 | Very high | 128 Ų | 128 | 106.7 Ų | 106.7 | 67% | 0.67 | 54% | 0.539 | S | S | * | . | H | α-helix | trans | -67.8 | -26.1 | 173.4 | -66.8 | 172.5 | 0 | 0 | 0 | 113 | E311 S313 | E311-L315 HydrophobicContact CG-CD1 4.4Å; E311-L315 WeakPolarHBondContact O-CG 3.43Å; E311-L315 PolarHBondContact O-N 3.11Å; S313-L315 PolarHBondContact O-N 3.42Å |
| 316 | T | 85.1 | Confident | 90.4 | Very high | 106 Ų | 106 | 106.8 Ų | 106.8 | 65% | 0.65 | 54% | 0.536 | S | S | * | . | H | α-helix | trans | -92.3 | -33.2 | -179 | -54.3 | 0 | 0 | 0 | 0 | 112.7 | L312 S313 L314 Q318 | L312-T316 WeakPolarHBondContact O-CB 3.3Å; L312-T316 PolarHBondContact O-N 3.29Å; L312-T316 VanDerWaalsContact O-N 3.16Å; L312-T316 PolarHBondContact O-OG1 3.1Å; S313-T316 CarbonylContact O-C 3.57Å; S313-T316 PolarHBondContact O-N 2.87Å; S313-T316 VanDerWaalsContact O-N 3.08Å; L314-T316 VanDerWaalsContact C-N 3.26Å; L314-T316 PolarHBondContact O-N 3.43Å; T316-Q318 VanDerWaalsContact C-N 3.31Å; T316-Q318 PolarHBondContact O-N 2.92Å |
| 317 | N | 78.8 | Confident | 90.4 | Very high | 114 Ų | 114 | 107.5 Ų | 107.5 | 61% | 0.61 | 54% | 0.539 | S | S | * | . | trans | -74.7 | 75.4 | -176 | -73.9 | -27.4 | 0 | 0 | 0 | 111.9 | S313 | S313-N317 WeakPolarHBondContact O-CB 3.34Å; S313-N317 PolarHBondContact O-N 3.06Å; S313-N317 PolarHBondContact O-ND2 3.21Å; S313-N317 VanDerWaalsContact O-ND2 3.1Å | ||
| 318 | Q | 78.7 | Confident | 90.4 | Very high | 165 Ų | 165 | 107 Ų | 107 | 77% | 0.771 | 54% | 0.539 | S | S | * | . | P | Polyproline II helix | trans | -68.2 | 152.9 | 168.1 | -59.4 | -173.5 | 17.6 | 0 | 0 | 110.4 | T316 | T316-Q318 VanDerWaalsContact C-N 3.31Å; T316-Q318 PolarHBondContact O-N 2.92Å |
| 319 | K | 85.4 | Confident | 90.3 | Very high | 188 Ų | 188 | 104.9 Ų | 104.9 | 82% | 0.817 | 53% | 0.531 | S | S | * | . | P | Polyproline II helix | trans | -57.3 | 133.6 | 172.2 | -179.6 | -179.9 | 178.3 | 172.8 | 0 | 109.2 | R321 | K319-R321 PolarHBondContact O-N 2.75Š|
| 320 | P | 86.1 | Confident | 90.3 | Very high | 38 Ų | 38 | 107.1 Ų | 107.1 | 25% | 0.247 | 53% | 0.528 | C | S | . | . | P | Polyproline II helix | trans | -51.6 | 126.6 | -179.8 | 17.8 | -32.1 | 0 | 0 | 0 | 111.7 | E325 E326 | P320-E325 HydrophobicContact CB-CB 3.97Å; P320-E325 HydrophobicContact CB-CG 4.01Å; P320-E326 HydrophobicContact CB-CB 4.2Å; P320-E326 HydrophobicContact CG-CB 4.31Å |
| 321 | R | 88.5 | Confident | 90.4 | Very high | 233 Ų | 233 | 105.3 Ų | 105.3 | 88% | 0.879 | 52% | 0.52 | S | S | * | . | S | Bend | trans | -84.8 | -18.8 | -175 | -176.4 | 176.6 | 174.7 | -177.1 | -1.9 | 112.2 | K319 E325 | K319-R321 PolarHBondContact O-N 2.75Å; R321-E325 WeakPolarHBondContact CB-OE2 3.28Å; R321-E325 PolarHBondContact N-OE2 3.09Å |
| 322 | N | 94.9 | Very high | 90.3 | Very high | 98 Ų | 98 | 108.3 Ų | 108.3 | 52% | 0.524 | 53% | 0.532 | S | S | . | . | S | Bend | trans | -148 | 155.3 | -178.3 | -167.2 | 6.4 | 0 | 0 | 0 | 110.8 | F324 E325 E326 | N322-F324 PolarHBondContact O-N 2.79Å; N322-E325 VanDerWaalsContact O-CB 3.3Å; N322-E325 WeakPolarHBondContact O-CB 3.5Å; N322-E325 PolarHBondContact O-N 3.22Å; N322-E326 PolarHBondContact O-N 3.33Å |
| 323 | G | 95.3 | Very high | 90.3 | Very high | 34 Ų | 34 | 108.4 Ų | 108.4 | 35% | 0.351 | 53% | 0.53 | S | S | . | . | H | α-helix | trans | -60.2 | -29.8 | 178.7 | 0 | 0 | 0 | 0 | 0 | 113.7 | E325 E326 M327 | G323-E325 VanDerWaalsContact C-N 3.27Å; G323-E325 PolarHBondContact O-N 2.95Å; G323-E326 PolarHBondContact O-N 3.48Å; G323-M327 VanDerWaalsContact O-CG 3.29Å; G323-M327 WeakPolarHBondContact O-CG 3.41Å; G323-M327 PolarHBondContact O-N 3.16Å |
| 324 | F | 94.9 | Very high | 90.5 | Very high | 143 Ų | 143 | 109.4 Ų | 109.4 | 63% | 0.627 | 55% | 0.547 | S | S | * | . | H | α-helix | trans | -64.2 | -30.5 | 171.7 | -67.4 | -57.8 | 0 | 0 | 0 | 113.3 | N322 M327 I328 | N322-F324 PolarHBondContact O-N 2.79Å; F324-M327 HydrophobicContact CD1-SD 4.26Å; F324-I328 WeakPolarHBondContact O-CB 3.24Å; F324-I328 WeakPolarHBondContact O-CD1 3.4Å; F324-I328 WeakPolarHBondContact O-CG1 3.4Å; F324-I328 PolarHBondContact O-N 2.76Å |
| 325 | E | 93.5 | Very high | 90.8 | Very high | 90 Ų | 90 | 109.9 Ų | 109.9 | 42% | 0.421 | 54% | 0.543 | S | S | . | . | H | α-helix | trans | -76.1 | -38.3 | 178.2 | -167.2 | 172.8 | -168.9 | 0 | 0 | 110.9 | P320 R321 N322 G323 I328 Q329 | P320-E325 HydrophobicContact CB-CB 3.97Å; P320-E325 HydrophobicContact CB-CG 4.01Å; R321-E325 WeakPolarHBondContact CB-OE2 3.28Å; R321-E325 PolarHBondContact N-OE2 3.09Å; N322-E325 VanDerWaalsContact O-CB 3.3Å; N322-E325 WeakPolarHBondContact O-CB 3.5Å; N322-E325 PolarHBondContact O-N 3.22Å; G323-E325 VanDerWaalsContact C-N 3.27Å; G323-E325 PolarHBondContact O-N 2.95Å; E325-I328 PolarHBondContact O-N 3.41Å; E325-Q329 WeakPolarHBondContact O-CB 3.45Å; E325-Q329 PolarHBondContact O-N 3.35Å |
| 326 | E | 92.6 | Very high | 90.9 | Very high | 84 Ų | 84 | 106.4 Ų | 106.4 | 39% | 0.393 | 53% | 0.525 | S | S | . | . | H | α-helix | trans | -62 | -43 | 169.2 | -179.5 | 169.6 | -141.5 | 0 | 0 | 111.6 | P320 N322 G323 Q329 W330 | P320-E326 HydrophobicContact CB-CB 4.2Å; P320-E326 HydrophobicContact CG-CB 4.31Å; N322-E326 PolarHBondContact O-N 3.33Å; G323-E326 PolarHBondContact O-N 3.48Å; E326-Q329 PolarHBondContact O-N 3.23Å; E326-W330 HydrophobicContact CG-CD2 4.28Å; E326-W330 HydrophobicContact CG-CH2 4.18Å; E326-W330 HydrophobicContact CG-CZ2 3.55Å; E326-W330 VanDerWaalsContact O-CG 3.3Å; E326-W330 PolarHBondContact O-N 3.28Å; E326-W330 WeakPolarHBondContact OE1-CZ2 3.27Å |
| 327 | M | 94.6 | Very high | 91.3 | Very high | 94 Ų | 94 | 108.9 Ų | 108.9 | 46% | 0.463 | 52% | 0.523 | S | S | . | . | H | α-helix | trans | -61.7 | -46.3 | 172 | -71.2 | 174.1 | 69.7 | 0 | 0 | 112.1 | G323 F324 Q329 W330 T331 L336 | G323-M327 VanDerWaalsContact O-CG 3.29Å; G323-M327 WeakPolarHBondContact O-CG 3.41Å; G323-M327 PolarHBondContact O-N 3.16Å; F324-M327 HydrophobicContact CD1-SD 4.26Å; M327-Q329 VanDerWaalsContact C-N 3.29Å; M327-Q329 PolarHBondContact O-N 3.01Å; M327-W330 PolarHBondContact O-N 3.08Å; M327-T331 PolarHBondContact O-N 3.11Å; M327-T331 PolarHBondContact O-OG1 2.78Å; M327-T331 VanDerWaalsContact O-OG1 3.1Å; M327-L336 HydrophobicContact CB-CD1 3.93Å; M327-L336 HydrophobicContact CG-CD1 4.02Å |
| 328 | I | 93.5 | Very high | 91.9 | Very high | 98 Ų | 98 | 109.4 Ų | 109.4 | 50% | 0.503 | 52% | 0.521 | S | S | . | . | H | α-helix | trans | -60.7 | -39.6 | 176.5 | -73.1 | 162 | 0 | 0 | 0 | 110.9 | F324 E325 T331 K332 | F324-I328 WeakPolarHBondContact O-CB 3.24Å; F324-I328 WeakPolarHBondContact O-CD1 3.4Å; F324-I328 WeakPolarHBondContact O-CG1 3.4Å; F324-I328 PolarHBondContact O-N 2.76Å; E325-I328 PolarHBondContact O-N 3.41Å; I328-T331 PolarHBondContact O-N 3.43Å; I328-K332 HydrophobicContact CG2-CD 4.34Å; I328-K332 WeakPolarHBondContact O-CG 3.44Å; I328-K332 PolarHBondContact O-N 2.69Å |
| 329 | Q | 93.1 | Very high | 92.6 | Very high | 82 Ų | 82 | 110.1 Ų | 110.1 | 38% | 0.383 | 52% | 0.518 | S | S | . | . | H | α-helix | trans | -62 | -49.5 | 173.4 | 178.6 | 172.8 | -3.2 | 0 | 0 | 110.9 | E325 E326 M327 T331 K332 E333 | E325-Q329 WeakPolarHBondContact O-CB 3.45Å; E325-Q329 PolarHBondContact O-N 3.35Å; E326-Q329 PolarHBondContact O-N 3.23Å; M327-Q329 VanDerWaalsContact C-N 3.29Å; M327-Q329 PolarHBondContact O-N 3.01Å; Q329-T331 VanDerWaalsContact C-N 3.31Å; Q329-T331 PolarHBondContact O-N 3.39Å; Q329-K332 WeakPolarHBondContact O-CB 3.25Å; Q329-K332 PolarHBondContact O-N 3.09Å; Q329-K332 VanDerWaalsContact O-N 3.16Å; Q329-E333 HydrophobicContact CG-CG 4.29Å; Q329-E333 VanDerWaalsContact CG-OE1 3.28Å; Q329-E333 WeakPolarHBondContact CG-OE1 3.27Å; Q329-E333 PolarHBondContact NE2-OE1 3.06Å; Q329-E333 WeakPolarHBondContact O-CB 3.22Å; Q329-E333 VanDerWaalsContact O-CG 3.27Å; Q329-E333 WeakPolarHBondContact O-CG 3.2Å; Q329-E333 PolarHBondContact O-N 2.94Å |
| 330 | W | 94.6 | Very high | 93 | Very high | 99 Ų | 99 | 107 Ų | 107 | 38% | 0.375 | 52% | 0.518 | S | S | . | . | H | α-helix | trans | -64.2 | -31.5 | 178.4 | -65.4 | -4.9 | 0 | 0 | 0 | 113.5 | E326 M327 G334 K335 L336 | E326-W330 HydrophobicContact CG-CD2 4.28Å; E326-W330 HydrophobicContact CG-CH2 4.18Å; E326-W330 HydrophobicContact CG-CZ2 3.55Å; E326-W330 VanDerWaalsContact O-CG 3.3Å; E326-W330 PolarHBondContact O-N 3.28Å; E326-W330 WeakPolarHBondContact OE1-CZ2 3.27Å; M327-W330 PolarHBondContact O-N 3.08Å; W330-G334 PolarHBondContact O-N 2.96Å; W330-K335 HydrophobicContact CB-CB 4.07Å; W330-K335 HydrophobicContact CG-CD 4.48Å; W330-K335 PolarHBondContact O-N 2.88Å; W330-L336 HydrophobicContact CB-CB 4.31Å; W330-L336 HydrophobicContact CB-CD1 3.91Å; W330-L336 HydrophobicContact CB-CG 3.76Å; W330-L336 HydrophobicContact CE3-CD1 4.04Å; W330-L336 HydrophobicContact CE3-CD2 4.34Å; W330-L336 HydrophobicContact CE3-CG 4.05Å; W330-L336 PolarHBondContact O-N 2.76Å; W330-L336 VanDerWaalsContact O-N 3.13Å |
| 331 | T | 95.4 | Very high | 93.3 | Very high | 51 Ų | 51 | 109.4 Ų | 109.4 | 31% | 0.313 | 53% | 0.527 | S | S | . | . | H | α-helix | trans | -69.4 | -41.2 | 172.1 | -57.4 | 0 | 0 | 0 | 0 | 111.4 | M327 I328 Q329 E333 G334 Q338 | M327-T331 PolarHBondContact O-N 3.11Å; M327-T331 PolarHBondContact O-OG1 2.78Å; M327-T331 VanDerWaalsContact O-OG1 3.1Å; I328-T331 PolarHBondContact O-N 3.43Å; Q329-T331 VanDerWaalsContact C-N 3.31Å; Q329-T331 PolarHBondContact O-N 3.39Å; T331-E333 VanDerWaalsContact C-N 3.3Å; T331-E333 PolarHBondContact O-N 3.33Å; T331-G334 PolarHBondContact O-N 3.48Å; T331-Q338 HydrophobicContact CG2-CG 4.3Å |
| 332 | K | 91.4 | Very high | 93.5 | Very high | 177 Ų | 177 | 101.9 Ų | 101.9 | 77% | 0.77 | 50% | 0.504 | S | S | * | . | H | α-helix | trans | -64.5 | -34.1 | 173.2 | -72.8 | 173.9 | 178.6 | -177.6 | 0 | 112.8 | I328 Q329 G334 | I328-K332 HydrophobicContact CG2-CD 4.34Å; I328-K332 WeakPolarHBondContact O-CG 3.44Å; I328-K332 PolarHBondContact O-N 2.69Å; Q329-K332 WeakPolarHBondContact O-CB 3.25Å; Q329-K332 PolarHBondContact O-N 3.09Å; Q329-K332 VanDerWaalsContact O-N 3.16Å; K332-G334 VanDerWaalsContact C-N 3.26Å; K332-G334 PolarHBondContact O-N 3.41Å |
| 333 | E | 93.3 | Very high | 93.4 | Very high | 83 Ų | 83 | 104.3 Ų | 104.3 | 39% | 0.388 | 52% | 0.517 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -81.8 | 2.5 | 176.6 | -68.1 | 171.9 | 172 | 0 | 0 | 113.3 | Q329 T331 K335 | Q329-E333 HydrophobicContact CG-CG 4.29Å; Q329-E333 VanDerWaalsContact CG-OE1 3.28Å; Q329-E333 WeakPolarHBondContact CG-OE1 3.27Å; Q329-E333 PolarHBondContact NE2-OE1 3.06Å; Q329-E333 WeakPolarHBondContact O-CB 3.22Å; Q329-E333 VanDerWaalsContact O-CG 3.27Å; Q329-E333 WeakPolarHBondContact O-CG 3.2Å; Q329-E333 PolarHBondContact O-N 2.94Å; T331-E333 VanDerWaalsContact C-N 3.3Å; T331-E333 PolarHBondContact O-N 3.33Å; E333-K335 HydrophobicContact CB-CD 4.15Å; E333-K335 HydrophobicContact CB-CG 4.18Å; E333-K335 PolarHBondContact O-N 2.77Å; E333-K335 WeakPolarHBondContact OE2-CD 3.44Å; E333-K335 VanDerWaalsContact OE2-CE 3.24Å; E333-K335 WeakPolarHBondContact OE2-CE 3.25Å; E333-K335 IonicContact OE2-NZ 2.64Å; E333-K335 PolarHBondContact OE2-NZ 3.19Å |
| 334 | G | 92.3 | Very high | 93 | Very high | 63 Ų | 63 | 108.8 Ų | 108.8 | 65% | 0.649 | 53% | 0.529 | S | S | * | . | T | Hydrogen-bonded Turn | trans | 69.2 | 8 | -179.1 | 0 | 0 | 0 | 0 | 0 | 115.6 | W330 T331 K332 | W330-G334 PolarHBondContact O-N 2.96Å; T331-G334 PolarHBondContact O-N 3.48Å; K332-G334 VanDerWaalsContact C-N 3.26Å; K332-G334 PolarHBondContact O-N 3.41Å |
| 335 | K | 94.1 | Very high | 92.6 | Very high | 139 Ų | 139 | 106 Ų | 106 | 60% | 0.604 | 52% | 0.52 | S | S | * | . | S | Bend | trans | -80.2 | -28.9 | -179.6 | -64.7 | 172.7 | -176.6 | 165.1 | 0 | 113.1 | W330 E333 | W330-K335 HydrophobicContact CB-CB 4.07Å; W330-K335 HydrophobicContact CG-CD 4.48Å; W330-K335 PolarHBondContact O-N 2.88Å; E333-K335 HydrophobicContact CB-CD 4.15Å; E333-K335 HydrophobicContact CB-CG 4.18Å; E333-K335 PolarHBondContact O-N 2.77Å; E333-K335 WeakPolarHBondContact OE2-CD 3.44Å; E333-K335 VanDerWaalsContact OE2-CE 3.24Å; E333-K335 WeakPolarHBondContact OE2-CE 3.25Å; E333-K335 IonicContact OE2-NZ 2.64Å; E333-K335 PolarHBondContact OE2-NZ 3.19Å |
| 336 | L | 93.6 | Very high | 92.1 | Very high | 55 Ų | 55 | 104.7 Ų | 104.7 | 29% | 0.288 | 53% | 0.531 | S | S | . | . | S | Bend | trans | -104 | 143.5 | 170.7 | -77.4 | -179.5 | 0 | 0 | 0 | 110.6 | M327 W330 | M327-L336 HydrophobicContact CB-CD1 3.93Å; M327-L336 HydrophobicContact CG-CD1 4.02Å; W330-L336 HydrophobicContact CB-CB 4.31Å; W330-L336 HydrophobicContact CB-CD1 3.91Å; W330-L336 HydrophobicContact CB-CG 3.76Å; W330-L336 HydrophobicContact CE3-CD1 4.04Å; W330-L336 HydrophobicContact CE3-CD2 4.34Å; W330-L336 HydrophobicContact CE3-CG 4.05Å; W330-L336 PolarHBondContact O-N 2.76Å; W330-L336 VanDerWaalsContact O-N 3.13Å |
| 337 | W | 92.6 | Very high | 91.7 | Very high | 158 Ų | 158 | 105.7 Ų | 105.7 | 60% | 0.598 | 54% | 0.538 | S | S | * | . | P | Polyproline II helix | trans | -55.5 | 141 | 169.6 | -73 | 66 | 0 | 0 | 0 | 110.8 | Y339 I341 | W337-Y339 HydrophobicContact CB-CE2 4.42Å; W337-Y339 VanDerWaalsContact O-CD2 3.28Å; W337-Y339 WeakPolarHBondContact O-CD2 3.42Å; W337-Y339 WeakPolarHBondContact O-CE2 3.43Å; W337-I341 HydrophobicContact CE3-CG2 3.85Å; W337-I341 HydrophobicContact CZ3-CG2 3.91Å |
| 338 | Q | 92 | Very high | 91.1 | Very high | 125 Ų | 125 | 108.1 Ų | 108.1 | 58% | 0.584 | 55% | 0.548 | S | S | * | . | P | Polyproline II helix | trans | -76.2 | 149.3 | 171.6 | -57.7 | -173 | 27.3 | 0 | 0 | 109.7 | T331 | T331-Q338 HydrophobicContact CG2-CG 4.3Š|
| 339 | Y | 92.4 | Very high | 90.6 | Very high | 181 Ų | 181 | 110 Ų | 110 | 71% | 0.71 | 56% | 0.56 | S | S | * | * | S | Bend | trans | -121.4 | 138.6 | -177.5 | -77.2 | -95.7 | 0 | 0 | 0 | 110.8 | W337 I341 | W337-Y339 HydrophobicContact CB-CE2 4.42Å; W337-Y339 VanDerWaalsContact O-CD2 3.28Å; W337-Y339 WeakPolarHBondContact O-CD2 3.42Å; W337-Y339 WeakPolarHBondContact O-CE2 3.43Å; Y339-I341 HydrophobicContact CD1-CG1 4.08Å; Y339-I341 HydrophobicContact CE1-CD1 3.85Å; Y339-I341 HydrophobicContact CE1-CG1 3.87Å |
| 340 | P | 94.4 | Very high | 90.2 | Very high | 123 Ų | 123 | 107.5 Ų | 107.5 | 80% | 0.799 | 55% | 0.548 | S | S | * | . | S | Bend | cis | -65 | 148.7 | -2.3 | 30 | -36.3 | 0 | 0 | 0 | 112.3 | N342 | P340-N342 PolarHBondContact O-N 3.08Š|
| 341 | I | 93.1 | Very high | 89.7 | Confident | 88 Ų | 88 | 106.8 Ų | 106.8 | 45% | 0.451 | 56% | 0.563 | S | S | . | * | P | Polyproline II helix | trans | -65.7 | 117.5 | -179 | -64.6 | 171.6 | 0 | 0 | 0 | 108.6 | W337 Y339 | W337-I341 HydrophobicContact CE3-CG2 3.85Å; W337-I341 HydrophobicContact CZ3-CG2 3.91Å; Y339-I341 HydrophobicContact CD1-CG1 4.08Å; Y339-I341 HydrophobicContact CE1-CD1 3.85Å; Y339-I341 HydrophobicContact CE1-CG1 3.87Å |
| 342 | N | 92.2 | Very high | 89.4 | Confident | 75 Ų | 75 | 108.9 Ų | 108.9 | 40% | 0.401 | 58% | 0.579 | S | S | . | * | P | Polyproline II helix | trans | -97.1 | 138.7 | 161.4 | -173.7 | 5.7 | 0 | 0 | 0 | 108.8 | P340 E344 I345 | P340-N342 PolarHBondContact O-N 3.08Å; N342-E344 VanDerWaalsContact C-N 3.3Å; N342-E344 PolarHBondContact ND2-OE2 2.94Å; N342-E344 PolarHBondContact OD1-N 3.16Å; N342-E344 VanDerWaalsContact OD1-N 3.1Å; N342-E344 PolarHBondContact OD1-OE2 3.45Å; N342-I345 HydrophobicContact CB-CD1 4.26Å; N342-I345 HydrophobicContact CB-CG1 4.02Å; N342-I345 WeakPolarHBondContact O-CD1 3.31Å; N342-I345 WeakPolarHBondContact O-CG1 3.38Å |
| 343 | N | 91.9 | Very high | 89.3 | Confident | 149 Ų | 149 | 102.3 Ų | 102.3 | 80% | 0.797 | 55% | 0.554 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -79.7 | -14.2 | 177.2 | -62.1 | -30.9 | 0 | 0 | 0 | 112.6 | ||
| 344 | E | 88.4 | Confident | 89.3 | Confident | 128 Ų | 128 | 100.8 Ų | 100.8 | 60% | 0.598 | 55% | 0.551 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -90.8 | 4.3 | -178.2 | -57 | 158 | 166.2 | 0 | 0 | 112.8 | N342 G346 L347 | N342-E344 VanDerWaalsContact C-N 3.3Å; N342-E344 PolarHBondContact ND2-OE2 2.94Å; N342-E344 PolarHBondContact OD1-N 3.16Å; N342-E344 VanDerWaalsContact OD1-N 3.1Å; N342-E344 PolarHBondContact OD1-OE2 3.45Å; E344-G346 PolarHBondContact O-N 3.44Å; E344-L347 PolarHBondContact O-N 3.08Å |
| 345 | I | 86.7 | Confident | 89.3 | Confident | 85 Ų | 85 | 105 Ų | 105 | 44% | 0.436 | 55% | 0.552 | S | S | . | * | T | Hydrogen-bonded Turn | trans | -62.2 | 124.1 | 178 | -64.1 | 172.6 | 0 | 0 | 0 | 109.3 | N342 | N342-I345 HydrophobicContact CB-CD1 4.26Å; N342-I345 HydrophobicContact CB-CG1 4.02Å; N342-I345 WeakPolarHBondContact O-CD1 3.31Å; N342-I345 WeakPolarHBondContact O-CG1 3.38Å |
| 346 | G | 82.5 | Confident | 89.2 | Confident | 62 Ų | 62 | 102.3 Ų | 102.3 | 64% | 0.639 | 54% | 0.542 | S | S | * | . | T | Hydrogen-bonded Turn | trans | 93.4 | -1 | -174.1 | 0 | 0 | 0 | 0 | 0 | 115.1 | E344 | E344-G346 PolarHBondContact O-N 3.44Š|
| 347 | L | 83.6 | Confident | 89.1 | Confident | 105 Ų | 105 | 103.3 Ų | 103.3 | 55% | 0.55 | 54% | 0.544 | S | S | . | . | trans | -102.9 | 41.1 | 168.7 | -163.8 | 68.8 | 0 | 0 | 0 | 110.8 | E344 D349 E350 A351 | E344-L347 PolarHBondContact O-N 3.08Å; L347-D349 PolarHBondContact O-N 3.1Å; L347-E350 HydrophobicContact CG-CB 4.29Å; L347-A351 VanDerWaalsContact O-CB 3.32Å; L347-A351 WeakPolarHBondContact O-CB 3.5Å; L347-A351 PolarHBondContact O-N 3.31Å | ||
| 348 | E | 82.4 | Confident | 89.1 | Confident | 144 Ų | 144 | 97.8 Ų | 97.8 | 67% | 0.673 | 53% | 0.525 | S | S | * | . | H | α-helix | trans | -70 | -31.6 | -167.8 | -66.1 | 179 | -152.5 | 0 | 0 | 113.1 | A351 S352 | E348-A351 PolarHBondContact O-N 3.15Å; E348-S352 PolarHBondContact O-N 2.7Å |
| 349 | D | 83.1 | Confident | 89 | Confident | 139 Ų | 139 | 94.8 Ų | 94.8 | 74% | 0.743 | 52% | 0.515 | S | S | * | . | H | α-helix | trans | -64.5 | -53.4 | 179.5 | -54.9 | -55.7 | 0 | 0 | 0 | 111.1 | L347 A351 S352 | L347-D349 PolarHBondContact O-N 3.1Å; D349-A351 VanDerWaalsContact C-N 3.34Å; D349-A351 PolarHBondContact O-N 2.94Å; D349-S352 WeakPolarHBondContact O-CB 3.39Å; D349-S352 PolarHBondContact O-N 3.18Å; D349-S352 PolarHBondContact O-OG 3.14Å |
| 350 | E | 84 | Confident | 89 | Confident | 29 Ų | 29 | 91.3 Ų | 91.3 | 14% | 0.136 | 50% | 0.504 | C | S | . | . | H | α-helix | trans | -74.4 | -21.1 | 177.6 | -69.5 | -67.9 | -177.5 | 0 | 0 | 113.3 | L347 S352 V353 H358 T393 V394 | L347-E350 HydrophobicContact CG-CB 4.29Å; E350-S352 PolarHBondContact O-N 2.92Å; E350-V353 PolarHBondContact O-N 2.69Å; E350-V353 VanDerWaalsContact OE2-CB 3.27Å; E350-V353 WeakPolarHBondContact OE2-CB 3.38Å; E350-V353 WeakPolarHBondContact OE2-CG2 3.34Å; E350-H358 IonicContact OE2-CE1 3.54Å; E350-H358 PolarHBondContact OE2-CE1 2.95Å; E350-H358 IonicContact OE2-NE2 3.61Å; E350-T393 HydrophobicContact CG-CG2 4.14Å; E350-T393 WeakPolarHBondContact OE1-CA 3.46Å; E350-T393 WeakPolarHBondContact OE1-CB 3.49Å; E350-V394 PolarHBondContact OE1-N 3.34Å |
| 351 | A | 85.4 | Confident | 88.9 | Confident | 83 Ų | 83 | 85.5 Ų | 85.5 | 69% | 0.686 | 47% | 0.466 | S | S | * | . | H | α-helix | trans | -64.6 | -17.6 | 169.6 | 0 | 0 | 0 | 0 | 0 | 112.8 | L347 E348 D349 | L347-A351 VanDerWaalsContact O-CB 3.32Å; L347-A351 WeakPolarHBondContact O-CB 3.5Å; L347-A351 PolarHBondContact O-N 3.31Å; E348-A351 PolarHBondContact O-N 3.15Å; D349-A351 VanDerWaalsContact C-N 3.34Å; D349-A351 PolarHBondContact O-N 2.94Å |
| 352 | S | 87.9 | Confident | 88.7 | Confident | 95 Ų | 95 | 86.2 Ų | 86.2 | 66% | 0.664 | 47% | 0.468 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -81.1 | -19.3 | 169.6 | 81.1 | 0 | 0 | 0 | 0 | 113.5 | E348 D349 E350 | E348-S352 PolarHBondContact O-N 2.7Å; D349-S352 WeakPolarHBondContact O-CB 3.39Å; D349-S352 PolarHBondContact O-N 3.18Å; D349-S352 PolarHBondContact O-OG 3.14Å; E350-S352 PolarHBondContact O-N 2.92Å |
| 353 | V | 89.8 | Confident | 88.4 | Confident | 39 Ų | 39 | 89.5 Ų | 89.5 | 24% | 0.236 | 48% | 0.478 | C | S | . | . | S | Bend | trans | -94 | 122.1 | -169 | 180 | 0 | 0 | 0 | 0 | 111 | E350 E357 V394 | E350-V353 PolarHBondContact O-N 2.69Å; E350-V353 VanDerWaalsContact OE2-CB 3.27Å; E350-V353 WeakPolarHBondContact OE2-CB 3.38Å; E350-V353 WeakPolarHBondContact OE2-CG2 3.34Å; V353-E357 HydrophobicContact CG1-CB 4.06Å; V353-V394 HydrophobicContact CG1-CB 4.45Å; V353-V394 HydrophobicContact CG1-CG2 3.83Å |
| 354 | P | 92.5 | Very high | 88 | Confident | 51 Ų | 51 | 85.2 Ų | 85.2 | 33% | 0.331 | 45% | 0.454 | S | S | . | . | trans | -69.2 | 144.3 | 179.9 | 28.2 | -35.4 | 0 | 0 | 0 | 112.2 | H356 E357 | P354-H356 WeakPolarHBondContact CG-CE1 3.5Å; P354-H356 WeakPolarHBondContact CG-NE2 3.45Å; P354-H356 PolarHBondContact O-N 3.22Å; P354-E357 PolarHBondContact O-N 2.96Å | ||
| 355 | F | 92.2 | Very high | 87.8 | Confident | 152 Ų | 152 | 79.1 Ų | 79.1 | 67% | 0.667 | 43% | 0.425 | S | S | * | . | H | α-helix | trans | -50.9 | -27.4 | -179.1 | 78.5 | -86.4 | 0 | 0 | 0 | 114.2 | E357 H358 V359 | F355-E357 VanDerWaalsContact C-N 3.26Å; F355-E357 PolarHBondContact O-N 3.42Å; F355-H358 WeakPolarHBondContact O-CB 3.4Å; F355-H358 PolarHBondContact O-N 2.93Å; F355-H358 VanDerWaalsContact O-N 3.17Å; F355-V359 WeakPolarHBondContact O-CG2 3.2Å; F355-V359 PolarHBondContact O-N 2.68Å; F355-V359 VanDerWaalsContact O-N 3.11Å |
| 356 | H | 92.7 | Very high | 87.4 | Confident | 83 Ų | 83 | 81.6 Ų | 81.6 | 38% | 0.384 | 44% | 0.435 | S | S | . | . | H | α-helix | trans | -67.3 | -23.4 | -178.5 | 63.6 | 51.5 | 0 | 0 | 0 | 113.2 | P354 F360 | P354-H356 WeakPolarHBondContact CG-CE1 3.5Å; P354-H356 WeakPolarHBondContact CG-NE2 3.45Å; P354-H356 PolarHBondContact O-N 3.22Å; H356-F360 HydrophobicContact CB-CD2 3.83Å; H356-F360 HydrophobicContact CB-CE2 4.1Å; H356-F360 WeakPolarHBondContact O-CB 3.03Å; H356-F360 WeakPolarHBondContact O-CD2 3.41Å; H356-F360 PolarHBondContact O-N 2.85Å |
| 357 | E | 91.4 | Very high | 87 | Confident | 75 Ų | 75 | 83.3 Ų | 83.3 | 35% | 0.35 | 43% | 0.43 | S | S | . | . | H | α-helix | trans | -78.7 | -33.2 | 171.1 | -69.5 | -164.4 | -136.2 | 0 | 0 | 112.7 | V353 P354 F355 V359 L361 V394 K398 | V353-E357 HydrophobicContact CG1-CB 4.06Å; P354-E357 PolarHBondContact O-N 2.96Å; F355-E357 VanDerWaalsContact C-N 3.26Å; F355-E357 PolarHBondContact O-N 3.42Å; E357-V359 VanDerWaalsContact C-N 3.28Å; E357-V359 PolarHBondContact O-N 3.31Å; E357-L361 VanDerWaalsContact O-CD2 3.32Å; E357-L361 WeakPolarHBondContact O-CD2 3.22Å; E357-V394 HydrophobicContact CB-CG1 4.15Å; E357-V394 HydrophobicContact CB-CG2 4.32Å; E357-K398 IonicContact OE2-NZ 2.66Å; E357-K398 PolarHBondContact OE2-NZ 3.43Å |
| 358 | H | 91.6 | Very high | 86.5 | Confident | 42 Ų | 42 | 80.1 Ų | 80.1 | 19% | 0.194 | 42% | 0.422 | C | S | . | . | H | α-helix | trans | -67 | -29.6 | 173.6 | -77.9 | 85.8 | 0 | 0 | 0 | 112.8 | E350 F355 A387 V394 | E350-H358 IonicContact OE2-CE1 3.54Å; E350-H358 PolarHBondContact OE2-CE1 2.95Å; E350-H358 IonicContact OE2-NE2 3.61Å; F355-H358 WeakPolarHBondContact O-CB 3.4Å; F355-H358 PolarHBondContact O-N 2.93Å; F355-H358 VanDerWaalsContact O-N 3.17Å; H358-A387 WeakPolarHBondContact O-CA 3.48Å; H358-V394 HydrophobicContact CB-CG2 4.42Å; H358-V394 VanDerWaalsContact CE1-CG2 3.43Å; H358-V394 WeakPolarHBondContact CE1-CG2 3.4Å; H358-V394 WeakPolarHBondContact ND1-CG2 3.46Å |
| 359 | V | 91.8 | Very high | 86.5 | Confident | 62 Ų | 62 | 74.1 Ų | 74.1 | 38% | 0.376 | 39% | 0.394 | S | S | . | . | H | α-helix | trans | -99.4 | -50 | -173.9 | 176.7 | 0 | 0 | 0 | 0 | 112.8 | F355 E357 L361 | F355-V359 WeakPolarHBondContact O-CG2 3.2Å; F355-V359 PolarHBondContact O-N 2.68Å; F355-V359 VanDerWaalsContact O-N 3.11Å; E357-V359 VanDerWaalsContact C-N 3.28Å; E357-V359 PolarHBondContact O-N 3.31Å; V359-L361 VanDerWaalsContact C-N 3.34Å; V359-L361 PolarHBondContact O-N 2.9Å; V359-L361 VanDerWaalsContact O-N 3.14Å |
| 360 | F | 91.9 | Very high | 86.5 | Confident | 108 Ų | 108 | 67.9 Ų | 67.9 | 47% | 0.474 | 36% | 0.36 | S | S | . | . | trans | -93.3 | 58.6 | -172.1 | -55.5 | -65.5 | 0 | 0 | 0 | 112.8 | H356 E362 | H356-F360 HydrophobicContact CB-CD2 3.83Å; H356-F360 HydrophobicContact CB-CE2 4.1Å; H356-F360 WeakPolarHBondContact O-CB 3.03Å; H356-F360 WeakPolarHBondContact O-CD2 3.41Å; H356-F360 PolarHBondContact O-N 2.85Å; F360-E362 PolarHBondContact O-N 3.02Å | ||
| 361 | L | 91.3 | Very high | 86.3 | Confident | 1 Ų | 1 | 75.9 Ų | 75.9 | 1% | 0.005 | 39% | 0.39 | C | S | . | . | G | 310 helix | trans | -69.6 | -10.2 | 175.9 | -60.5 | 167.2 | 0 | 0 | 0 | 113.2 | E357 V359 K363 H364 V383 L386 K397 I401 | E357-L361 VanDerWaalsContact O-CD2 3.32Å; E357-L361 WeakPolarHBondContact O-CD2 3.22Å; V359-L361 VanDerWaalsContact C-N 3.34Å; V359-L361 PolarHBondContact O-N 2.9Å; V359-L361 VanDerWaalsContact O-N 3.14Å; L361-K363 PolarHBondContact O-N 3.25Å; L361-K363 VanDerWaalsContact O-N 3.08Å; L361-H364 WeakPolarHBondContact O-CB 3.47Å; L361-H364 PolarHBondContact O-N 2.94Å; L361-V383 HydrophobicContact CB-CG1 3.91Å; L361-V383 HydrophobicContact CB-CG2 4Å; L361-L386 HydrophobicContact CD1-CB 3.68Å; L361-K397 HydrophobicContact CD1-CB 4.12Å; L361-K397 HydrophobicContact CD1-CD 4.06Å; L361-K397 HydrophobicContact CD2-CB 4.16Å; L361-I401 HydrophobicContact CB-CD1 4.1Å |
| 362 | E | 88.3 | Confident | 86.1 | Confident | 104 Ų | 104 | 79.5 Ų | 79.5 | 49% | 0.486 | 39% | 0.392 | S | S | . | . | G | 310 helix | trans | -53.2 | -28.6 | 179.7 | -67.1 | 172.7 | -168.1 | 0 | 0 | 113.7 | F360 H364 L365 V383 | F360-E362 PolarHBondContact O-N 3.02Å; E362-H364 VanDerWaalsContact C-N 3.26Å; E362-H364 PolarHBondContact O-N 3.03Å; E362-L365 WeakPolarHBondContact O-CA 3.43Å; E362-L365 WeakPolarHBondContact O-CB 3.45Å; E362-L365 PolarHBondContact O-N 3.16Å; E362-V383 HydrophobicContact CG-CG1 4.13Å |
| 363 | K | 86.7 | Confident | 85.9 | Confident | 143 Ų | 143 | 77 Ų | 77 | 62% | 0.622 | 38% | 0.382 | S | S | * | . | G | 310 helix | trans | -56.6 | -40.7 | 173.9 | -60.6 | 179.8 | -177.7 | 178.8 | 0 | 112 | L361 L365 E366 | L361-K363 PolarHBondContact O-N 3.25Å; L361-K363 VanDerWaalsContact O-N 3.08Å; K363-L365 PolarHBondContact O-N 3.45Å; K363-E366 PolarHBondContact O-N 3.5Å; K363-E366 VanDerWaalsContact O-N 3.12Å |
| 364 | H | 83.8 | Confident | 85.8 | Confident | 60 Ų | 60 | 79.4 Ų | 79.4 | 28% | 0.278 | 40% | 0.398 | S | S | . | . | G | 310 helix | trans | -75.9 | -3.3 | 178.2 | -57.5 | -51.9 | 0 | 0 | 0 | 113.2 | L361 E362 K398 I401 | L361-H364 WeakPolarHBondContact O-CB 3.47Å; L361-H364 PolarHBondContact O-N 2.94Å; E362-H364 VanDerWaalsContact C-N 3.26Å; E362-H364 PolarHBondContact O-N 3.03Å; H364-K398 VanDerWaalsContact NE2-CE 3.31Å; H364-K398 WeakPolarHBondContact NE2-CE 3.25Å; H364-I401 HydrophobicContact CB-CD1 4.2Å; H364-I401 HydrophobicContact CB-CG2 4.28Å |
| 365 | L | 83.4 | Confident | 85.6 | Confident | 0 Ų | 0 | 77.5 Ų | 77.5 | 0% | 0 | 39% | 0.385 | C | S | . | . | G | 310 helix | trans | -90.2 | -6 | 168.1 | -56.8 | -174.5 | 0 | 0 | 0 | 113 | E362 K363 F369 R376 M379 E380 V383 I401 | E362-L365 WeakPolarHBondContact O-CA 3.43Å; E362-L365 WeakPolarHBondContact O-CB 3.45Å; E362-L365 PolarHBondContact O-N 3.16Å; K363-L365 PolarHBondContact O-N 3.45Å; L365-F369 HydrophobicContact CD2-CD2 4.22Å; L365-F369 HydrophobicContact CD2-CE2 4.17Å; L365-R376 PolarHBondContact O-NH1 2.9Å; L365-M379 HydrophobicContact CD1-CB 4.25Å; L365-M379 HydrophobicContact CD2-CB 3.9Å; L365-M379 HydrophobicContact CD2-CE 3.77Å; L365-E380 HydrophobicContact CD1-CG 4.2Å; L365-V383 HydrophobicContact CD1-CB 4.15Å; L365-V383 HydrophobicContact CD1-CG2 3.83Å; L365-V383 HydrophobicContact CD2-CG2 3.81Å; L365-V383 HydrophobicContact CG-CG2 3.89Å; L365-I401 HydrophobicContact CD2-CG2 4.19Å |
| 366 | E | 78.9 | Confident | 85.4 | Confident | 137 Ų | 137 | 72.1 Ų | 72.1 | 64% | 0.64 | 36% | 0.36 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -83.6 | -26.3 | 169.8 | -59.6 | -170.6 | -167.4 | 0 | 0 | 111.4 | K363 G368 | K363-E366 PolarHBondContact O-N 3.5Å; K363-E366 VanDerWaalsContact O-N 3.12Å; E366-G368 VanDerWaalsContact C-N 3.26Å; E366-G368 PolarHBondContact O-N 3.39Å |
| 367 | D | 75.1 | Confident | 85.4 | Confident | 98 Ų | 98 | 73.5 Ų | 73.5 | 52% | 0.524 | 37% | 0.367 | S | S | . | . | S | Bend | trans | -77.4 | 63.6 | -179.6 | -67.2 | -45.1 | 0 | 0 | 0 | 113 | R405 | D367-R405 WeakPolarHBondContact O-CD 3.41Å; D367-R405 PolarHBondContact O-NH1 3.5Å |
| 368 | G | 72.2 | Confident | 85.4 | Confident | 38 Ų | 38 | 74.3 Ų | 74.3 | 39% | 0.392 | 37% | 0.369 | S | S | . | . | S | Bend | trans | 103.6 | 20.8 | 166.8 | 0 | 0 | 0 | 0 | 0 | 116.9 | E366 | E366-G368 VanDerWaalsContact C-N 3.26Å; E366-G368 PolarHBondContact O-N 3.39Å |
| 369 | F | 82.9 | Confident | 85.5 | Confident | 18 Ų | 18 | 72.3 Ų | 72.3 | 8% | 0.079 | 36% | 0.36 | C | S | . | . | S | Bend | trans | -111.6 | 150 | 167.1 | -60.3 | -91.2 | 0 | 0 | 0 | 110.1 | L365 V375 M379 I401 F404 R405 F408 | L365-F369 HydrophobicContact CD2-CD2 4.22Å; L365-F369 HydrophobicContact CD2-CE2 4.17Å; F369-V375 HydrophobicContact CD1-CG1 4.41Å; F369-M379 HydrophobicContact CD1-CG 3.77Å; F369-M379 HydrophobicContact CE1-CE 3.84Å; F369-M379 HydrophobicContact CE1-CG 3.68Å; F369-M379 HydrophobicContact CE1-SD 3.86Å; F369-M379 HydrophobicContact CE2-CE 4.39Å; F369-M379 HydrophobicContact CZ-CE 3.67Å; F369-M379 HydrophobicContact CZ-CG 4.41Å; F369-M379 HydrophobicContact CZ-SD 4.3Å; F369-I401 HydrophobicContact CE2-CG2 3.84Å; F369-I401 HydrophobicContact CZ-CG2 4.11Å; F369-F404 HydrophobicContact CE1-CB 4.45Å; F369-F404 HydrophobicContact CZ-CB 4.44Å; F369-R405 HydrophobicContact CE1-CB 4.34Å; F369-R405 HydrophobicContact CE2-CB 4.19Å; F369-R405 HydrophobicContact CZ-CB 3.73Å; F369-F408 HydrophobicContact CD1-CD2 4.4Å; F369-F408 AromaticContact CE1-CD2 3.96Å; F369-F408 HydrophobicContact CE1-CD2 3.96Å; F369-F408 HydrophobicContact CE1-CE2 4.23Å |
| 370 | P | 83.4 | Confident | 85.5 | Confident | 7 Ų | 7 | 72.8 Ų | 72.8 | 5% | 0.045 | 36% | 0.358 | C | S | . | . | trans | -62.7 | 149.7 | 177.6 | 28.9 | -37.5 | 0 | 0 | 0 | 111.2 | Q372 V375 R376 L422 N423 | P370-Q372 VanDerWaalsContact C-N 3.29Å; P370-Q372 PolarHBondContact O-N 3.36Å; P370-V375 HydrophobicContact CG-CB 4.17Å; P370-V375 HydrophobicContact CG-CG1 4.46Å; P370-R376 WeakPolarHBondContact O-CD 3.46Å; P370-L422 HydrophobicContact CG-CD2 3.99Å; P370-N423 WeakPolarHBondContact CA-OXT 3.34Å; P370-N423 WeakPolarHBondContact CB-O 3.28Å | ||
| 371 | R | 79.7 | Confident | 85.6 | Confident | 198 Ų | 198 | 72.5 Ų | 72.5 | 75% | 0.747 | 36% | 0.361 | S | S | * | . | S | Bend | trans | -75.7 | -18.3 | -177.6 | -74.4 | -176.3 | 169.2 | -170.5 | -5.4 | 113.6 | N423 | R371-N423 PolarHBondContact N-OXT 3.16Š|
| 372 | Q | 80.1 | Confident | 85.7 | Confident | 159 Ų | 159 | 73.7 Ų | 73.7 | 74% | 0.743 | 37% | 0.369 | S | S | * | . | S | Bend | trans | -139.4 | 165.5 | -179.5 | -61.2 | -173.4 | 4.9 | 0 | 0 | 110.7 | P370 | P370-Q372 VanDerWaalsContact C-N 3.29Å; P370-Q372 PolarHBondContact O-N 3.36Å |
| 373 | G | 84.8 | Confident | 86 | Confident | 43 Ų | 43 | 68.9 Ų | 68.9 | 44% | 0.443 | 35% | 0.346 | S | S | . | . | S | Bend | trans | 99.2 | -178.1 | 172.1 | 0 | 0 | 0 | 0 | 0 | 116.2 | V375 R376 H377 | G373-V375 PolarHBondContact O-N 3.39Å; G373-R376 PolarHBondContact O-N 3.39Å; G373-H377 PolarHBondContact O-N 3.45Å |
| 374 | P | 88.2 | Confident | 86.3 | Confident | 88 Ų | 88 | 64.6 Ų | 64.6 | 57% | 0.571 | 33% | 0.332 | S | S | * | . | H | α-helix | trans | -59.3 | -39.6 | -171.2 | -26.4 | 34.6 | 0 | 0 | 0 | 114.7 | R376 H377 F378 V420 | P374-R376 VanDerWaalsContact C-N 3.34Å; P374-R376 PolarHBondContact O-N 2.95Å; P374-H377 PolarHBondContact O-N 2.86Å; P374-F378 WeakPolarHBondContact O-CB 3.32Å; P374-F378 PolarHBondContact O-N 2.91Å; P374-V420 HydrophobicContact CB-CG1 4.37Å; P374-V420 HydrophobicContact CG-CG1 4.18Å |
| 375 | V | 86.9 | Confident | 86.9 | Confident | 11 Ų | 11 | 63.6 Ų | 63.6 | 7% | 0.067 | 34% | 0.338 | C | S | . | . | H | α-helix | trans | -63.2 | -42.2 | 179 | -179.8 | 0 | 0 | 0 | 0 | 110.7 | F369 P370 G373 F378 M379 F408 L415 V420 | F369-V375 HydrophobicContact CD1-CG1 4.41Å; P370-V375 HydrophobicContact CG-CB 4.17Å; P370-V375 HydrophobicContact CG-CG1 4.46Å; G373-V375 PolarHBondContact O-N 3.39Å; V375-F378 PolarHBondContact O-N 3.08Å; V375-M379 WeakPolarHBondContact O-CG 3.2Å; V375-M379 PolarHBondContact O-N 2.83Å; V375-F408 HydrophobicContact CG1-CD2 4.02Å; V375-F408 HydrophobicContact CG1-CE1 4.35Å; V375-F408 HydrophobicContact CG1-CE2 3.83Å; V375-F408 HydrophobicContact CG1-CG 4.39Å; V375-F408 HydrophobicContact CG1-CZ 4Å; V375-L415 HydrophobicContact CG2-CD2 4.29Å; V375-V420 HydrophobicContact CG2-CG1 3.96Å |
| 376 | R | 89.2 | Confident | 87.4 | Confident | 39 Ų | 39 | 64.4 Ų | 64.4 | 15% | 0.147 | 34% | 0.342 | C | S | . | . | H | α-helix | trans | -61.9 | -48 | 176.6 | -178.5 | 63 | -170.8 | -153.5 | 3 | 111.3 | L365 P370 G373 P374 F378 M379 E380 | L365-R376 PolarHBondContact O-NH1 2.9Å; P370-R376 WeakPolarHBondContact O-CD 3.46Å; G373-R376 PolarHBondContact O-N 3.39Å; P374-R376 VanDerWaalsContact C-N 3.34Å; P374-R376 PolarHBondContact O-N 2.95Å; R376-F378 PolarHBondContact O-N 3.28Å; R376-M379 PolarHBondContact O-N 3.43Å; R376-E380 WeakPolarHBondContact CG-OE1 3.12Å; R376-E380 IonicContact CZ-OE1 2.87Å; R376-E380 IonicContact NE-OE1 3.06Å; R376-E380 PolarHBondContact NE-OE1 3.41Å; R376-E380 IonicContact NH2-OE1 3.57Å; R376-E380 WeakPolarHBondContact O-CG 2.96Å; R376-E380 PolarHBondContact O-N 3.33Å |
| 377 | H | 91.4 | Very high | 88.2 | Confident | 113 Ų | 113 | 59.1 Ų | 59.1 | 52% | 0.523 | 32% | 0.322 | S | S | . | . | H | α-helix | trans | -62.4 | -40.1 | 178.2 | -174.9 | 53.9 | 0 | 0 | 0 | 112.7 | G373 P374 E380 L381 | G373-H377 PolarHBondContact O-N 3.45Å; P374-H377 PolarHBondContact O-N 2.86Å; H377-E380 PolarHBondContact O-N 3.36Å; H377-L381 WeakPolarHBondContact O-CG 3.47Å; H377-L381 PolarHBondContact O-N 2.98Å; H377-L381 VanDerWaalsContact O-N 3.14Å |
| 378 | F | 92.3 | Very high | 89.1 | Confident | 91 Ų | 91 | 62.3 Ų | 62.3 | 40% | 0.399 | 33% | 0.331 | S | S | . | . | H | α-helix | trans | -61.4 | -46.2 | 172.8 | 173.3 | -96.5 | 0 | 0 | 0 | 111.8 | P374 V375 R376 E380 L381 V382 F404 F408 | P374-F378 WeakPolarHBondContact O-CB 3.32Å; P374-F378 PolarHBondContact O-N 2.91Å; V375-F378 PolarHBondContact O-N 3.08Å; R376-F378 PolarHBondContact O-N 3.28Å; F378-E380 VanDerWaalsContact C-N 3.32Å; F378-E380 PolarHBondContact O-N 3.05Å; F378-L381 WeakPolarHBondContact O-CB 3.48Å; F378-L381 PolarHBondContact O-N 3.03Å; F378-L381 VanDerWaalsContact O-N 3.12Å; F378-V382 HydrophobicContact CD1-CG2 4.17Å; F378-V382 HydrophobicContact CE1-CG2 3.66Å; F378-V382 HydrophobicContact CE2-CG2 4.35Å; F378-V382 HydrophobicContact CZ-CG2 3.76Å; F378-V382 PolarHBondContact O-N 2.85Å; F378-F404 AromaticContact CE1-CD1 3.98Å; F378-F404 HydrophobicContact CE1-CD1 3.98Å; F378-F404 AromaticContact CE1-CE1 3.63Å; F378-F404 HydrophobicContact CE1-CE1 3.63Å; F378-F404 HydrophobicContact CE1-CZ 4.13Å; F378-F404 AromaticContact CZ-CE1 3.86Å; F378-F404 HydrophobicContact CZ-CE1 3.86Å; F378-F404 HydrophobicContact CZ-CZ 4.15Å; F378-F408 HydrophobicContact CD1-CZ 4.04Å; F378-F408 HydrophobicContact CE1-CZ 4.19Å |
| 379 | M | 92.5 | Very high | 90.1 | Very high | 0 Ų | 0 | 62.9 Ų | 62.9 | 0% | 0 | 33% | 0.325 | C | S | . | . | H | α-helix | trans | -67.6 | -29.9 | 179.4 | -72.6 | -56.2 | -59 | 0 | 0 | 113.3 | L365 F369 V375 R376 V382 V383 I401 F404 F408 | L365-M379 HydrophobicContact CD1-CB 4.25Å; L365-M379 HydrophobicContact CD2-CB 3.9Å; L365-M379 HydrophobicContact CD2-CE 3.77Å; F369-M379 HydrophobicContact CD1-CG 3.77Å; F369-M379 HydrophobicContact CE1-CE 3.84Å; F369-M379 HydrophobicContact CE1-CG 3.68Å; F369-M379 HydrophobicContact CE1-SD 3.86Å; F369-M379 HydrophobicContact CE2-CE 4.39Å; F369-M379 HydrophobicContact CZ-CE 3.67Å; F369-M379 HydrophobicContact CZ-CG 4.41Å; F369-M379 HydrophobicContact CZ-SD 4.3Å; V375-M379 WeakPolarHBondContact O-CG 3.2Å; V375-M379 PolarHBondContact O-N 2.83Å; R376-M379 PolarHBondContact O-N 3.43Å; M379-V382 HydrophobicContact CE-CG1 4.42Å; M379-V382 PolarHBondContact O-N 2.89Å; M379-V382 HydrophobicContact SD-CG2 4.46Å; M379-V383 WeakPolarHBondContact O-CB 3.47Å; M379-V383 PolarHBondContact O-N 3.47Å; M379-I401 HydrophobicContact CE-CG2 4.3Å; M379-F404 HydrophobicContact CE-CB 3.85Å; M379-F404 HydrophobicContact CE-CD2 4.13Å; M379-F404 HydrophobicContact CE-CG 4.18Å; M379-F404 HydrophobicContact SD-CB 3.68Å; M379-F404 HydrophobicContact SD-CD1 4.3Å; M379-F404 HydrophobicContact SD-CD2 4.13Å; M379-F404 HydrophobicContact SD-CG 3.79Å; M379-F408 HydrophobicContact CG-CE2 4.27Å; M379-F408 HydrophobicContact SD-CE2 3.98Å |
| 380 | E | 92.1 | Very high | 90.5 | Very high | 72 Ų | 72 | 67.2 Ų | 67.2 | 34% | 0.336 | 36% | 0.355 | S | S | . | . | H | α-helix | trans | -66.7 | -36.2 | 170.3 | -73.4 | 165.4 | 177.5 | 0 | 0 | 112 | L365 R376 H377 F378 T384 | L365-E380 HydrophobicContact CD1-CG 4.2Å; R376-E380 WeakPolarHBondContact CG-OE1 3.12Å; R376-E380 IonicContact CZ-OE1 2.87Å; R376-E380 IonicContact NE-OE1 3.06Å; R376-E380 PolarHBondContact NE-OE1 3.41Å; R376-E380 IonicContact NH2-OE1 3.57Å; R376-E380 WeakPolarHBondContact O-CG 2.96Å; R376-E380 PolarHBondContact O-N 3.33Å; H377-E380 PolarHBondContact O-N 3.36Å; F378-E380 VanDerWaalsContact C-N 3.32Å; F378-E380 PolarHBondContact O-N 3.05Å; E380-T384 WeakPolarHBondContact O-CB 3.37Å; E380-T384 VanDerWaalsContact O-CG2 3.29Å; E380-T384 WeakPolarHBondContact O-CG2 3.25Å; E380-T384 PolarHBondContact O-N 2.91Å; E380-T384 PolarHBondContact O-OG1 3.33Å |
| 381 | L | 94.4 | Very high | 90.9 | Very high | 102 Ų | 102 | 76.7 Ų | 76.7 | 53% | 0.534 | 39% | 0.391 | S | S | . | . | H | α-helix | trans | -67.8 | -39.3 | 171 | -66.8 | 171.3 | 0 | 0 | 0 | 112 | H377 F378 T384 G385 | H377-L381 WeakPolarHBondContact O-CG 3.47Å; H377-L381 PolarHBondContact O-N 2.98Å; H377-L381 VanDerWaalsContact O-N 3.14Å; F378-L381 WeakPolarHBondContact O-CB 3.48Å; F378-L381 PolarHBondContact O-N 3.03Å; F378-L381 VanDerWaalsContact O-N 3.12Å; L381-T384 PolarHBondContact O-OG1 3.46Å; L381-G385 PolarHBondContact O-N 2.96Å |
| 382 | V | 93.9 | Very high | 91.4 | Very high | 27 Ų | 27 | 69.1 Ų | 69.1 | 16% | 0.164 | 37% | 0.366 | C | S | . | . | H | α-helix | trans | -62.3 | -51.1 | 173 | 172.2 | 0 | 0 | 0 | 0 | 110.8 | F378 M379 G385 L386 F404 | F378-V382 HydrophobicContact CD1-CG2 4.17Å; F378-V382 HydrophobicContact CE1-CG2 3.66Å; F378-V382 HydrophobicContact CE2-CG2 4.35Å; F378-V382 HydrophobicContact CZ-CG2 3.76Å; F378-V382 PolarHBondContact O-N 2.85Å; M379-V382 HydrophobicContact CE-CG1 4.42Å; M379-V382 PolarHBondContact O-N 2.89Å; M379-V382 HydrophobicContact SD-CG2 4.46Å; V382-G385 WeakPolarHBondContact O-CA 3.44Å; V382-G385 PolarHBondContact O-N 3.13Å; V382-G385 VanDerWaalsContact O-N 3.09Å; V382-L386 HydrophobicContact CG1-CD1 3.98Å; V382-L386 HydrophobicContact CG1-CG 4.37Å; V382-L386 WeakPolarHBondContact O-CG 3.43Å; V382-L386 PolarHBondContact O-N 3.48Å; V382-F404 HydrophobicContact CG1-CD2 4.07Å; V382-F404 HydrophobicContact CG1-CE2 3.72Å; V382-F404 HydrophobicContact CG2-CE2 4.05Å; V382-F404 HydrophobicContact CG2-CZ 4.15Å |
| 383 | V | 93.8 | Very high | 92 | Very high | 2 Ų | 2 | 63.5 Ų | 63.5 | 1% | 0.012 | 34% | 0.342 | C | S | . | . | H | α-helix | trans | -63.2 | -44 | -179.7 | 151.4 | 0 | 0 | 0 | 0 | 112 | L361 E362 L365 M379 G385 L386 A387 I401 | L361-V383 HydrophobicContact CB-CG1 3.91Å; L361-V383 HydrophobicContact CB-CG2 4Å; E362-V383 HydrophobicContact CG-CG1 4.13Å; L365-V383 HydrophobicContact CD1-CB 4.15Å; L365-V383 HydrophobicContact CD1-CG2 3.83Å; L365-V383 HydrophobicContact CD2-CG2 3.81Å; L365-V383 HydrophobicContact CG-CG2 3.89Å; M379-V383 WeakPolarHBondContact O-CB 3.47Å; M379-V383 PolarHBondContact O-N 3.47Å; V383-G385 PolarHBondContact O-N 3.08Å; V383-L386 PolarHBondContact O-N 3.46Å; V383-A387 VanDerWaalsContact O-CB 3.27Å; V383-A387 WeakPolarHBondContact O-CB 3.5Å; V383-A387 PolarHBondContact O-N 3.08Å; V383-I401 HydrophobicContact CG2-CD1 3.87Å; V383-I401 HydrophobicContact CG2-CG1 4.34Å |
| 384 | T | 94.1 | Very high | 92.4 | Very high | 54 Ų | 54 | 61.7 Ų | 61.7 | 33% | 0.331 | 32% | 0.322 | S | S | . | . | H | α-helix | trans | -70.1 | -16.3 | 175.5 | 57.4 | 0 | 0 | 0 | 0 | 113.3 | E380 L381 K388 | E380-T384 WeakPolarHBondContact O-CB 3.37Å; E380-T384 VanDerWaalsContact O-CG2 3.29Å; E380-T384 WeakPolarHBondContact O-CG2 3.25Å; E380-T384 PolarHBondContact O-N 2.91Å; E380-T384 PolarHBondContact O-OG1 3.33Å; L381-T384 PolarHBondContact O-OG1 3.46Å; T384-K388 WeakPolarHBondContact O-CD 3.4Å; T384-K388 VanDerWaalsContact O-CE 3.3Å; T384-K388 WeakPolarHBondContact O-CE 3.2Å; T384-K388 VanDerWaalsContact O-CG 3.26Å; T384-K388 WeakPolarHBondContact O-CG 3.41Å |
| 385 | G | 95 | Very high | 92.5 | Very high | 38 Ų | 38 | 64.4 Ų | 64.4 | 39% | 0.392 | 33% | 0.328 | S | S | . | . | H | α-helix | trans | -76 | -51.7 | 165.3 | 0 | 0 | 0 | 0 | 0 | 112.5 | L381 V382 V383 A387 K388 N389 | L381-G385 PolarHBondContact O-N 2.96Å; V382-G385 WeakPolarHBondContact O-CA 3.44Å; V382-G385 PolarHBondContact O-N 3.13Å; V382-G385 VanDerWaalsContact O-N 3.09Å; V383-G385 PolarHBondContact O-N 3.08Å; G385-A387 VanDerWaalsContact C-N 3.32Å; G385-A387 PolarHBondContact O-N 3.22Å; G385-K388 PolarHBondContact O-N 3.21Å; G385-K388 VanDerWaalsContact O-N 3.13Å; G385-N389 PolarHBondContact O-N 2.91Å |
| 386 | L | 95.3 | Very high | 92.9 | Very high | 18 Ų | 18 | 67.4 Ų | 67.4 | 9% | 0.094 | 34% | 0.341 | C | S | . | . | H | α-helix | trans | -60.4 | -38.9 | 177.8 | -68.4 | 174.3 | 0 | 0 | 0 | 112.2 | L361 V382 V383 K388 N389 L392 K397 H400 I401 | L361-L386 HydrophobicContact CD1-CB 3.68Å; V382-L386 HydrophobicContact CG1-CD1 3.98Å; V382-L386 HydrophobicContact CG1-CG 4.37Å; V382-L386 WeakPolarHBondContact O-CG 3.43Å; V382-L386 PolarHBondContact O-N 3.48Å; V383-L386 PolarHBondContact O-N 3.46Å; L386-K388 VanDerWaalsContact C-N 3.27Å; L386-K388 PolarHBondContact O-N 3.32Å; L386-N389 PolarHBondContact O-N 3.47Å; L386-N389 VanDerWaalsContact O-N 3.17Å; L386-L392 HydrophobicContact CD2-CD1 3.94Å; L386-K397 HydrophobicContact CB-CD 4.41Å; L386-K397 HydrophobicContact CB-CG 4.25Å; L386-K397 HydrophobicContact CD2-CG 4.36Å; L386-K397 WeakPolarHBondContact O-CE 3.4Å; L386-K397 PolarHBondContact O-NZ 2.88Å; L386-H400 HydrophobicContact CD1-CB 4.14Å; L386-H400 HydrophobicContact CD2-CB 4.47Å; L386-I401 HydrophobicContact CD1-CD1 4.43Å; L386-I401 HydrophobicContact CD1-CG1 4.08Å |
| 387 | A | 94.1 | Very high | 93.1 | Very high | 26 Ų | 26 | 65.7 Ų | 65.7 | 22% | 0.215 | 33% | 0.334 | C | S | . | . | T | Hydrogen-bonded Turn | trans | -63.5 | -30.4 | 176.6 | 0 | 0 | 0 | 0 | 0 | 113.2 | H358 V383 G385 | H358-A387 WeakPolarHBondContact O-CA 3.48Å; V383-A387 VanDerWaalsContact O-CB 3.27Å; V383-A387 WeakPolarHBondContact O-CB 3.5Å; V383-A387 PolarHBondContact O-N 3.08Å; G385-A387 VanDerWaalsContact C-N 3.32Å; G385-A387 PolarHBondContact O-N 3.22Å |
| 388 | K | 94.1 | Very high | 93.1 | Very high | 164 Ų | 164 | 63.5 Ų | 63.5 | 71% | 0.713 | 32% | 0.323 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -85.6 | -5.7 | 177.4 | -69 | 169.2 | -166.6 | 154.3 | 0 | 113.6 | T384 G385 L386 P390 | T384-K388 WeakPolarHBondContact O-CD 3.4Å; T384-K388 VanDerWaalsContact O-CE 3.3Å; T384-K388 WeakPolarHBondContact O-CE 3.2Å; T384-K388 VanDerWaalsContact O-CG 3.26Å; T384-K388 WeakPolarHBondContact O-CG 3.41Å; G385-K388 PolarHBondContact O-N 3.21Å; G385-K388 VanDerWaalsContact O-N 3.13Å; L386-K388 VanDerWaalsContact C-N 3.27Å; L386-K388 PolarHBondContact O-N 3.32Å; K388-P390 WeakPolarHBondContact O-CD 3.46Å |
| 389 | N | 94.4 | Very high | 93.2 | Very high | 50 Ų | 50 | 65.4 Ų | 65.4 | 27% | 0.267 | 33% | 0.334 | S | S | . | . | trans | -91.4 | 116.1 | -176.6 | -168.1 | -13.4 | 0 | 0 | 0 | 111.6 | G385 L386 Y391 L392 K397 | G385-N389 PolarHBondContact O-N 2.91Å; L386-N389 PolarHBondContact O-N 3.47Å; L386-N389 VanDerWaalsContact O-N 3.17Å; N389-Y391 WeakPolarHBondContact OD1-CB 3.35Å; N389-Y391 WeakPolarHBondContact OD1-CD2 3.41Å; N389-Y391 PolarHBondContact OD1-N 3.35Å; N389-L392 VanDerWaalsContact ND2-CD1 3.3Å; N389-L392 WeakPolarHBondContact ND2-CD1 3.38Å; N389-L392 WeakPolarHBondContact ND2-CG 3.27Å; N389-K397 PolarHBondContact O-NZ 2.86Å | ||
| 390 | P | 91.1 | Very high | 93.3 | Very high | 109 Ų | 109 | 69.4 Ų | 69.4 | 71% | 0.708 | 35% | 0.352 | S | S | * | . | S | Bend | trans | -85.1 | -6.8 | 176.7 | -7 | 26.9 | 0 | 0 | 0 | 114.1 | K388 | K388-P390 WeakPolarHBondContact O-CD 3.46Š|
| 391 | Y | 90.6 | Very high | 93.3 | Very high | 206 Ų | 206 | 66.2 Ų | 66.2 | 81% | 0.808 | 34% | 0.337 | S | S | * | . | S | Bend | trans | -99.4 | -1.5 | -171.1 | -54.7 | -70.9 | 0 | 0 | 0 | 114.6 | N389 | N389-Y391 WeakPolarHBondContact OD1-CB 3.35Å; N389-Y391 WeakPolarHBondContact OD1-CD2 3.41Å; N389-Y391 PolarHBondContact OD1-N 3.35Å |
| 392 | L | 91.7 | Very high | 93.2 | Very high | 40 Ų | 40 | 64.4 Ų | 64.4 | 21% | 0.209 | 33% | 0.333 | C | S | . | . | S | Bend | trans | -114.6 | 138.6 | 179.5 | -65.7 | 176.7 | 0 | 0 | 0 | 110.4 | L386 N389 Q396 K397 | L386-L392 HydrophobicContact CD2-CD1 3.94Å; N389-L392 VanDerWaalsContact ND2-CD1 3.3Å; N389-L392 WeakPolarHBondContact ND2-CD1 3.38Å; N389-L392 WeakPolarHBondContact ND2-CG 3.27Å; L392-Q396 HydrophobicContact CB-CB 4.37Å; L392-Q396 HydrophobicContact CD2-CB 4.42Å; L392-K397 HydrophobicContact CB-CG 4.14Å; L392-K397 WeakPolarHBondContact O-CE 3.48Å |
| 393 | T | 92.9 | Very high | 93.3 | Very high | 41 Ų | 41 | 70 Ų | 70 | 25% | 0.252 | 35% | 0.352 | S | S | . | . | trans | -66.7 | 157.5 | 172.7 | 60.1 | 0 | 0 | 0 | 0 | 111.3 | E350 E395 Q396 K397 | E350-T393 HydrophobicContact CG-CG2 4.14Å; E350-T393 WeakPolarHBondContact OE1-CA 3.46Å; E350-T393 WeakPolarHBondContact OE1-CB 3.49Å; T393-E395 PolarHBondContact O-N 3.08Å; T393-Q396 PolarHBondContact O-N 3.34Å; T393-Q396 WeakPolarHBondContact OG1-CB 3.43Å; T393-Q396 WeakPolarHBondContact OG1-CG 3.25Å; T393-Q396 PolarHBondContact OG1-N 2.99Å; T393-Q396 VanDerWaalsContact OG1-N 3.1Å; T393-Q396 PolarHBondContact OG1-OE1 2.98Å; T393-K397 VanDerWaalsContact O-CG 3.32Å; T393-K397 WeakPolarHBondContact O-CG 3.37Å; T393-K397 PolarHBondContact O-N 3.06Å | ||
| 394 | V | 91.8 | Very high | 93.2 | Very high | 4 Ų | 4 | 71.8 Ų | 71.8 | 2% | 0.024 | 36% | 0.359 | C | S | . | . | H | α-helix | trans | -60.9 | -33.1 | 172.7 | 174.6 | 0 | 0 | 0 | 0 | 110.9 | E350 V353 E357 H358 K397 K398 | E350-V394 PolarHBondContact OE1-N 3.34Å; V353-V394 HydrophobicContact CG1-CB 4.45Å; V353-V394 HydrophobicContact CG1-CG2 3.83Å; E357-V394 HydrophobicContact CB-CG1 4.15Å; E357-V394 HydrophobicContact CB-CG2 4.32Å; H358-V394 HydrophobicContact CB-CG2 4.42Å; H358-V394 VanDerWaalsContact CE1-CG2 3.43Å; H358-V394 WeakPolarHBondContact CE1-CG2 3.4Å; H358-V394 WeakPolarHBondContact ND1-CG2 3.46Å; V394-K397 PolarHBondContact O-N 3.11Å; V394-K398 HydrophobicContact CG1-CD 3.91Å; V394-K398 HydrophobicContact CG1-CG 4.46Å; V394-K398 VanDerWaalsContact CG1-NZ 3.26Å; V394-K398 WeakPolarHBondContact O-CB 3.37Å; V394-K398 VanDerWaalsContact O-CG 3.29Å; V394-K398 WeakPolarHBondContact O-CG 3.45Å; V394-K398 PolarHBondContact O-N 3.34Å |
| 395 | E | 91.9 | Very high | 92.9 | Very high | 146 Ų | 146 | 74.2 Ų | 74.2 | 68% | 0.682 | 36% | 0.362 | S | S | * | . | H | α-helix | trans | -61.6 | -51.3 | 172.8 | -60.3 | -169.4 | 145.3 | 0 | 0 | 111.4 | T393 K397 K398 E399 | T393-E395 PolarHBondContact O-N 3.08Å; E395-K397 VanDerWaalsContact C-N 3.28Å; E395-K397 PolarHBondContact O-N 3.49Å; E395-K398 CarbonylContact O-C 3.58Å; E395-K398 WeakPolarHBondContact O-CA 3.47Å; E395-K398 WeakPolarHBondContact O-CB 3.37Å; E395-K398 PolarHBondContact O-N 3.22Å; E395-E399 WeakPolarHBondContact O-CG 3.48Å; E395-E399 PolarHBondContact O-N 3.36Å |
| 396 | Q | 93.5 | Very high | 92.8 | Very high | 74 Ų | 74 | 76.5 Ų | 76.5 | 35% | 0.346 | 37% | 0.365 | S | S | . | . | H | α-helix | trans | -59.8 | -36.7 | 175.6 | -72.5 | 159.1 | 5.2 | 0 | 0 | 112.5 | L392 T393 E399 H400 | L392-Q396 HydrophobicContact CB-CB 4.37Å; L392-Q396 HydrophobicContact CD2-CB 4.42Å; T393-Q396 PolarHBondContact O-N 3.34Å; T393-Q396 WeakPolarHBondContact OG1-CB 3.43Å; T393-Q396 WeakPolarHBondContact OG1-CG 3.25Å; T393-Q396 PolarHBondContact OG1-N 2.99Å; T393-Q396 VanDerWaalsContact OG1-N 3.1Å; T393-Q396 PolarHBondContact OG1-OE1 2.98Å; Q396-E399 PolarHBondContact O-N 3.3Å; Q396-H400 PolarHBondContact O-CD2 3.18Å; Q396-H400 PolarHBondContact O-N 3.49Å |
| 397 | K | 93.6 | Very high | 92.7 | Very high | 2 Ų | 2 | 80.5 Ų | 80.5 | 1% | 0.009 | 38% | 0.38 | C | S | . | . | H | α-helix | trans | -66.2 | -38.5 | 175 | -65.8 | 177.4 | -162.1 | -154.9 | 0 | 111.8 | L361 L386 N389 L392 T393 V394 E395 I401 | L361-K397 HydrophobicContact CD1-CB 4.12Å; L361-K397 HydrophobicContact CD1-CD 4.06Å; L361-K397 HydrophobicContact CD2-CB 4.16Å; L386-K397 HydrophobicContact CB-CD 4.41Å; L386-K397 HydrophobicContact CB-CG 4.25Å; L386-K397 HydrophobicContact CD2-CG 4.36Å; L386-K397 WeakPolarHBondContact O-CE 3.4Å; L386-K397 PolarHBondContact O-NZ 2.88Å; N389-K397 PolarHBondContact O-NZ 2.86Å; L392-K397 HydrophobicContact CB-CG 4.14Å; L392-K397 WeakPolarHBondContact O-CE 3.48Å; T393-K397 VanDerWaalsContact O-CG 3.32Å; T393-K397 WeakPolarHBondContact O-CG 3.37Å; T393-K397 PolarHBondContact O-N 3.06Å; V394-K397 PolarHBondContact O-N 3.11Å; E395-K397 VanDerWaalsContact C-N 3.28Å; E395-K397 PolarHBondContact O-N 3.49Å; K397-I401 WeakPolarHBondContact O-CG1 3.49Å; K397-I401 PolarHBondContact O-N 3.45Å |
| 398 | K | 92.3 | Very high | 92.5 | Very high | 67 Ų | 67 | 80.6 Ų | 80.6 | 29% | 0.291 | 38% | 0.376 | S | S | . | . | H | α-helix | trans | -67.6 | -45 | 173.7 | -72.1 | 164 | -179.3 | 165 | 0 | 110.7 | E357 H364 V394 E395 H400 I401 S402 | E357-K398 IonicContact OE2-NZ 2.66Å; E357-K398 PolarHBondContact OE2-NZ 3.43Å; H364-K398 VanDerWaalsContact NE2-CE 3.31Å; H364-K398 WeakPolarHBondContact NE2-CE 3.25Å; V394-K398 HydrophobicContact CG1-CD 3.91Å; V394-K398 HydrophobicContact CG1-CG 4.46Å; V394-K398 VanDerWaalsContact CG1-NZ 3.26Å; V394-K398 WeakPolarHBondContact O-CB 3.37Å; V394-K398 VanDerWaalsContact O-CG 3.29Å; V394-K398 WeakPolarHBondContact O-CG 3.45Å; V394-K398 PolarHBondContact O-N 3.34Å; E395-K398 CarbonylContact O-C 3.58Å; E395-K398 WeakPolarHBondContact O-CA 3.47Å; E395-K398 WeakPolarHBondContact O-CB 3.37Å; E395-K398 PolarHBondContact O-N 3.22Å; K398-H400 PolarHBondContact O-N 3Å; K398-I401 PolarHBondContact O-N 3.48Å; K398-I401 VanDerWaalsContact O-N 3.16Å; K398-S402 PolarHBondContact O-N 2.91Å; K398-S402 PolarHBondContact O-OG 3.36Å |
| 399 | E | 94.4 | Very high | 92.1 | Very high | 132 Ų | 132 | 77.8 Ų | 77.8 | 62% | 0.617 | 37% | 0.365 | S | S | * | . | H | α-helix | trans | -57.2 | -44.9 | 174.7 | -72 | 179.1 | 154.6 | 0 | 0 | 112.7 | E395 Q396 I401 S402 W403 | E395-E399 WeakPolarHBondContact O-CG 3.48Å; E395-E399 PolarHBondContact O-N 3.36Å; Q396-E399 PolarHBondContact O-N 3.3Å; E399-I401 VanDerWaalsContact C-N 3.32Å; E399-I401 PolarHBondContact O-N 2.92Å; E399-S402 PolarHBondContact O-N 3.05Å; E399-W403 WeakPolarHBondContact O-CB 3.21Å; E399-W403 PolarHBondContact O-N 3.5Å |
| 400 | H | 94.4 | Very high | 91.9 | Very high | 83 Ų | 83 | 81.8 Ų | 81.8 | 38% | 0.384 | 38% | 0.382 | S | S | . | . | H | α-helix | trans | -59.7 | -39.6 | 175.9 | -82.7 | -57.3 | 0 | 0 | 0 | 112.7 | L386 Q396 K398 F404 | L386-H400 HydrophobicContact CD1-CB 4.14Å; L386-H400 HydrophobicContact CD2-CB 4.47Å; Q396-H400 PolarHBondContact O-CD2 3.18Å; Q396-H400 PolarHBondContact O-N 3.49Å; K398-H400 PolarHBondContact O-N 3Å; H400-F404 WeakPolarHBondContact O-CD2 3.27Å; H400-F404 PolarHBondContact O-N 3.16Å |
| 401 | I | 92.6 | Very high | 91.8 | Very high | 5 Ų | 5 | 80.8 Ų | 80.8 | 3% | 0.026 | 37% | 0.366 | C | S | . | . | H | α-helix | trans | -69.4 | -44 | 177.7 | -65.1 | 165.5 | 0 | 0 | 0 | 110.5 | L361 H364 L365 F369 M379 V383 L386 K397 K398 E399 W403 F404 R405 | L361-I401 HydrophobicContact CB-CD1 4.1Å; H364-I401 HydrophobicContact CB-CD1 4.2Å; H364-I401 HydrophobicContact CB-CG2 4.28Å; L365-I401 HydrophobicContact CD2-CG2 4.19Å; F369-I401 HydrophobicContact CE2-CG2 3.84Å; F369-I401 HydrophobicContact CZ-CG2 4.11Å; M379-I401 HydrophobicContact CE-CG2 4.3Å; V383-I401 HydrophobicContact CG2-CD1 3.87Å; V383-I401 HydrophobicContact CG2-CG1 4.34Å; L386-I401 HydrophobicContact CD1-CD1 4.43Å; L386-I401 HydrophobicContact CD1-CG1 4.08Å; K397-I401 WeakPolarHBondContact O-CG1 3.49Å; K397-I401 PolarHBondContact O-N 3.45Å; K398-I401 PolarHBondContact O-N 3.48Å; K398-I401 VanDerWaalsContact O-N 3.16Å; E399-I401 VanDerWaalsContact C-N 3.32Å; E399-I401 PolarHBondContact O-N 2.92Å; I401-W403 VanDerWaalsContact C-N 3.32Å; I401-W403 PolarHBondContact O-N 3.47Å; I401-F404 PolarHBondContact O-N 3.18Å; I401-R405 PolarHBondContact O-N 3.35Å |
| 402 | S | 92 | Very high | 91.4 | Very high | 65 Ų | 65 | 75.4 Ų | 75.4 | 46% | 0.455 | 35% | 0.349 | S | S | . | . | H | α-helix | trans | -58.7 | -41.7 | 174.3 | -61.7 | 0 | 0 | 0 | 0 | 112.3 | K398 E399 F404 R405 D406 | K398-S402 PolarHBondContact O-N 2.91Å; K398-S402 PolarHBondContact O-OG 3.36Å; E399-S402 PolarHBondContact O-N 3.05Å; S402-F404 VanDerWaalsContact C-N 3.34Å; S402-F404 PolarHBondContact O-N 3.44Å; S402-R405 WeakPolarHBondContact O-CB 3.4Å; S402-R405 PolarHBondContact O-N 2.74Å; S402-R405 VanDerWaalsContact O-N 3.16Å; S402-D406 PolarHBondContact O-N 3.03Å |
| 403 | W | 95.1 | Very high | 90.9 | Very high | 145 Ų | 145 | 81 Ų | 81 | 55% | 0.549 | 37% | 0.374 | S | S | . | . | H | α-helix | trans | -61.3 | -40.7 | 176.5 | -177.2 | 87.6 | 0 | 0 | 0 | 112.4 | E399 I401 D406 Y407 | E399-W403 WeakPolarHBondContact O-CB 3.21Å; E399-W403 PolarHBondContact O-N 3.5Å; I401-W403 VanDerWaalsContact C-N 3.32Å; I401-W403 PolarHBondContact O-N 3.47Å; W403-D406 PolarHBondContact O-N 2.99Å; W403-Y407 AromaticContact CH2-CD2 3.94Å; W403-Y407 HydrophobicContact CH2-CD2 3.94Å; W403-Y407 HydrophobicContact CH2-CG 4.22Å; W403-Y407 HydrophobicContact CZ2-CD2 4.22Å; W403-Y407 HydrophobicContact CZ3-CG 4.42Å; W403-Y407 VanDerWaalsContact O-CB 3.29Å; W403-Y407 WeakPolarHBondContact O-CB 3.28Å; W403-Y407 PolarHBondContact O-N 2.88Å |
| 404 | F | 91.9 | Very high | 90.6 | Very high | 39 Ų | 39 | 82.9 Ų | 82.9 | 17% | 0.171 | 39% | 0.385 | C | S | . | . | H | α-helix | trans | -64.9 | -39.4 | 174.2 | -82.9 | -66.6 | 0 | 0 | 0 | 112.3 | F369 F378 M379 V382 H400 I401 S402 Y407 F408 | F369-F404 HydrophobicContact CE1-CB 4.45Å; F369-F404 HydrophobicContact CZ-CB 4.44Å; F378-F404 AromaticContact CE1-CD1 3.98Å; F378-F404 HydrophobicContact CE1-CD1 3.98Å; F378-F404 AromaticContact CE1-CE1 3.63Å; F378-F404 HydrophobicContact CE1-CE1 3.63Å; F378-F404 HydrophobicContact CE1-CZ 4.13Å; F378-F404 AromaticContact CZ-CE1 3.86Å; F378-F404 HydrophobicContact CZ-CE1 3.86Å; F378-F404 HydrophobicContact CZ-CZ 4.15Å; M379-F404 HydrophobicContact CE-CB 3.85Å; M379-F404 HydrophobicContact CE-CD2 4.13Å; M379-F404 HydrophobicContact CE-CG 4.18Å; M379-F404 HydrophobicContact SD-CB 3.68Å; M379-F404 HydrophobicContact SD-CD1 4.3Å; M379-F404 HydrophobicContact SD-CD2 4.13Å; M379-F404 HydrophobicContact SD-CG 3.79Å; V382-F404 HydrophobicContact CG1-CD2 4.07Å; V382-F404 HydrophobicContact CG1-CE2 3.72Å; V382-F404 HydrophobicContact CG2-CE2 4.05Å; V382-F404 HydrophobicContact CG2-CZ 4.15Å; H400-F404 WeakPolarHBondContact O-CD2 3.27Å; H400-F404 PolarHBondContact O-N 3.16Å; I401-F404 PolarHBondContact O-N 3.18Å; S402-F404 VanDerWaalsContact C-N 3.34Å; S402-F404 PolarHBondContact O-N 3.44Å; F404-Y407 PolarHBondContact O-N 3.47Å; F404-F408 HydrophobicContact CB-CD2 4.49Å; F404-F408 HydrophobicContact CB-CE2 4.21Å; F404-F408 HydrophobicContact CD1-CE2 4.25Å; F404-F408 WeakPolarHBondContact O-CD2 3.28Å; F404-F408 PolarHBondContact O-N 2.87Å |
| 405 | R | 89.1 | Confident | 90 | Very high | 104 Ų | 104 | 83.9 Ų | 83.9 | 39% | 0.392 | 39% | 0.39 | S | S | . | . | H | α-helix | trans | -59.2 | -51 | 174.5 | 172.6 | 174.3 | 161.5 | 171.9 | -5.8 | 111 | D367 F369 I401 S402 Y407 F408 H409 | D367-R405 WeakPolarHBondContact O-CD 3.41Å; D367-R405 PolarHBondContact O-NH1 3.5Å; F369-R405 HydrophobicContact CE1-CB 4.34Å; F369-R405 HydrophobicContact CE2-CB 4.19Å; F369-R405 HydrophobicContact CZ-CB 3.73Å; I401-R405 PolarHBondContact O-N 3.35Å; S402-R405 WeakPolarHBondContact O-CB 3.4Å; S402-R405 PolarHBondContact O-N 2.74Å; S402-R405 VanDerWaalsContact O-N 3.16Å; R405-Y407 VanDerWaalsContact C-N 3.29Å; R405-Y407 PolarHBondContact O-N 3.09Å; R405-F408 PolarHBondContact O-N 3.11Å; R405-H409 WeakPolarHBondContact CD-NE2 3.37Å; R405-H409 WeakPolarHBondContact CG-NE2 3.31Å; R405-H409 PolarHBondContact NE-NE2 3.42Å; R405-H409 PolarHBondContact O-CD2 3.11Å; R405-H409 PolarHBondContact O-N 2.92Å |
| 406 | D | 92.4 | Very high | 89.3 | Confident | 86 Ų | 86 | 80.5 Ų | 80.5 | 46% | 0.46 | 38% | 0.377 | S | S | . | . | H | α-helix | trans | -63.1 | -35.4 | 178.3 | -69.2 | -15.6 | 0 | 0 | 0 | 112.4 | S402 W403 Q410 | S402-D406 PolarHBondContact O-N 3.03Å; W403-D406 PolarHBondContact O-N 2.99Å; D406-Q410 WeakPolarHBondContact O-CB 3.4Å; D406-Q410 VanDerWaalsContact O-CG 3.25Å; D406-Q410 WeakPolarHBondContact O-CG 3.47Å; D406-Q410 PolarHBondContact O-N 3.29Å; D406-Q410 PolarHBondContact O-NE2 2.92Å |
| 407 | Y | 92.2 | Very high | 88.7 | Confident | 102 Ų | 102 | 84.9 Ų | 84.9 | 40% | 0.4 | 40% | 0.397 | S | S | . | . | H | α-helix | trans | -64.8 | -44.2 | 175 | 177.8 | -92.8 | 0 | 0 | 0 | 112.6 | W403 F404 R405 Q410 K411 | W403-Y407 AromaticContact CH2-CD2 3.94Å; W403-Y407 HydrophobicContact CH2-CD2 3.94Å; W403-Y407 HydrophobicContact CH2-CG 4.22Å; W403-Y407 HydrophobicContact CZ2-CD2 4.22Å; W403-Y407 HydrophobicContact CZ3-CG 4.42Å; W403-Y407 VanDerWaalsContact O-CB 3.29Å; W403-Y407 WeakPolarHBondContact O-CB 3.28Å; W403-Y407 PolarHBondContact O-N 2.88Å; F404-Y407 PolarHBondContact O-N 3.47Å; R405-Y407 VanDerWaalsContact C-N 3.29Å; R405-Y407 PolarHBondContact O-N 3.09Å; Y407-Q410 PolarHBondContact O-N 2.68Å; Y407-K411 HydrophobicContact CE1-CG 4.29Å; Y407-K411 HydrophobicContact CE2-CG 4.37Å; Y407-K411 WeakPolarHBondContact O-CB 3.4Å; Y407-K411 WeakPolarHBondContact O-CG 3.43Å; Y407-K411 PolarHBondContact O-N 3.06Å |
| 408 | F | 89.6 | Confident | 87.8 | Confident | 28 Ų | 28 | 87.8 Ų | 87.8 | 12% | 0.123 | 42% | 0.421 | C | S | . | . | H | α-helix | trans | -69.5 | -38.5 | 178 | -69.1 | -56.5 | 0 | 0 | 0 | 112.1 | F369 V375 F378 M379 F404 R405 Q410 K411 E412 L415 | F369-F408 HydrophobicContact CD1-CD2 4.4Å; F369-F408 AromaticContact CE1-CD2 3.96Å; F369-F408 HydrophobicContact CE1-CD2 3.96Å; F369-F408 HydrophobicContact CE1-CE2 4.23Å; V375-F408 HydrophobicContact CG1-CD2 4.02Å; V375-F408 HydrophobicContact CG1-CE1 4.35Å; V375-F408 HydrophobicContact CG1-CE2 3.83Å; V375-F408 HydrophobicContact CG1-CG 4.39Å; V375-F408 HydrophobicContact CG1-CZ 4Å; F378-F408 HydrophobicContact CD1-CZ 4.04Å; F378-F408 HydrophobicContact CE1-CZ 4.19Å; M379-F408 HydrophobicContact CG-CE2 4.27Å; M379-F408 HydrophobicContact SD-CE2 3.98Å; F404-F408 HydrophobicContact CB-CD2 4.49Å; F404-F408 HydrophobicContact CB-CE2 4.21Å; F404-F408 HydrophobicContact CD1-CE2 4.25Å; F404-F408 WeakPolarHBondContact O-CD2 3.28Å; F404-F408 PolarHBondContact O-N 2.87Å; R405-F408 PolarHBondContact O-N 3.11Å; F408-Q410 VanDerWaalsContact C-N 3.29Å; F408-Q410 PolarHBondContact O-N 2.87Å; F408-K411 CarbonylContact O-C 3.38Å; F408-K411 PolarHBondContact O-N 3.41Å; F408-E412 PolarHBondContact O-N 3.48Å; F408-L415 HydrophobicContact CB-CD1 4.35Å; F408-L415 HydrophobicContact CD1-CD1 4.1Å |
| 409 | H | 85.9 | Confident | 86.6 | Confident | 105 Ų | 105 | 89.9 Ų | 89.9 | 49% | 0.486 | 44% | 0.436 | S | S | . | . | H | α-helix | trans | -58.2 | -40.2 | 170.1 | -70.3 | -48.6 | 0 | 0 | 0 | 111.8 | R405 K411 | R405-H409 WeakPolarHBondContact CD-NE2 3.37Å; R405-H409 WeakPolarHBondContact CG-NE2 3.31Å; R405-H409 PolarHBondContact NE-NE2 3.42Å; R405-H409 PolarHBondContact O-CD2 3.11Å; R405-H409 PolarHBondContact O-N 2.92Å; H409-K411 PolarHBondContact O-N 3.24Å |
| 410 | Q | 90.4 | Very high | 85.1 | Confident | 135 Ų | 135 | 85.2 Ų | 85.2 | 63% | 0.631 | 42% | 0.416 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -72 | -4.4 | 174.7 | -72.8 | 171.2 | 52.4 | 0 | 0 | 114.7 | D406 Y407 F408 | D406-Q410 WeakPolarHBondContact O-CB 3.4Å; D406-Q410 VanDerWaalsContact O-CG 3.25Å; D406-Q410 WeakPolarHBondContact O-CG 3.47Å; D406-Q410 PolarHBondContact O-N 3.29Å; D406-Q410 PolarHBondContact O-NE2 2.92Å; Y407-Q410 PolarHBondContact O-N 2.68Å; F408-Q410 VanDerWaalsContact C-N 3.29Å; F408-Q410 PolarHBondContact O-N 2.87Å |
| 411 | K | 88.9 | Confident | 83.3 | Confident | 87 Ų | 87 | 88.1 Ų | 88.1 | 38% | 0.378 | 43% | 0.425 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -131.7 | 14.7 | -174.8 | -66.3 | -73.4 | 150.3 | -99 | 0 | 113.1 | Y407 F408 H409 E413 V414 L415 | Y407-K411 HydrophobicContact CE1-CG 4.29Å; Y407-K411 HydrophobicContact CE2-CG 4.37Å; Y407-K411 WeakPolarHBondContact O-CB 3.4Å; Y407-K411 WeakPolarHBondContact O-CG 3.43Å; Y407-K411 PolarHBondContact O-N 3.06Å; F408-K411 CarbonylContact O-C 3.38Å; F408-K411 PolarHBondContact O-N 3.41Å; H409-K411 PolarHBondContact O-N 3.24Å; K411-E413 VanDerWaalsContact C-N 3.26Å; K411-E413 PolarHBondContact O-N 3.37Å; K411-V414 HydrophobicContact CD-CG2 4.44Å; K411-V414 PolarHBondContact O-N 2.91Å; K411-L415 PolarHBondContact O-N 3.23Å; K411-L415 VanDerWaalsContact O-N 3.14Å |
| 412 | E | 82.4 | Confident | 81.5 | Confident | 94 Ų | 94 | 90.2 Ų | 90.2 | 44% | 0.439 | 44% | 0.436 | S | S | . | . | H | α-helix | trans | -53.8 | -39.1 | 178 | -177.3 | 171.4 | 173.3 | 0 | 0 | 112.7 | F408 V414 L415 N416 L422 | F408-E412 PolarHBondContact O-N 3.48Å; E412-V414 VanDerWaalsContact C-N 3.32Å; E412-V414 PolarHBondContact O-N 2.95Å; E412-L415 PolarHBondContact O-N 2.87Å; E412-N416 WeakPolarHBondContact O-CB 3.32Å; E412-N416 VanDerWaalsContact O-CG 3.32Å; E412-N416 PolarHBondContact O-N 3.35Å; E412-N416 PolarHBondContact O-ND2 3Å; E412-L422 HydrophobicContact CG-CD1 4.16Å |
| 413 | E | 82.8 | Confident | 79.3 | Confident | 158 Ų | 158 | 95 Ų | 95 | 74% | 0.738 | 46% | 0.456 | S | S | * | . | H | α-helix | trans | -53.1 | -46.5 | 173.4 | -62.2 | 178.4 | 152.9 | 0 | 0 | 112.3 | K411 N416 E417 | K411-E413 VanDerWaalsContact C-N 3.26Å; K411-E413 PolarHBondContact O-N 3.37Å; E413-N416 PolarHBondContact O-N 2.75Å; E413-E417 WeakPolarHBondContact O-CG 3.46Å; E413-E417 PolarHBondContact O-N 3.34Å |
| 414 | V | 85.4 | Confident | 78.5 | Confident | 80 Ų | 80 | 92.5 Ų | 92.5 | 49% | 0.485 | 45% | 0.451 | S | S | . | . | H | α-helix | trans | -75.3 | -28.3 | -177.9 | -175 | 0 | 0 | 0 | 0 | 111.8 | K411 E412 A418 | K411-V414 HydrophobicContact CD-CG2 4.44Å; K411-V414 PolarHBondContact O-N 2.91Å; E412-V414 VanDerWaalsContact C-N 3.32Å; E412-V414 PolarHBondContact O-N 2.95Å; V414-A418 WeakPolarHBondContact O-CB 3.43Å; V414-A418 PolarHBondContact O-N 2.98Å |
| 415 | L | 79.6 | Confident | 77.8 | Confident | 24 Ų | 24 | 95.3 Ų | 95.3 | 13% | 0.126 | 47% | 0.466 | C | S | . | . | H | α-helix | trans | -71.4 | -39 | 173.5 | -66 | 172.5 | 0 | 0 | 0 | 111.2 | V375 F408 K411 E412 A418 V420 L422 | V375-L415 HydrophobicContact CG2-CD2 4.29Å; F408-L415 HydrophobicContact CB-CD1 4.35Å; F408-L415 HydrophobicContact CD1-CD1 4.1Å; K411-L415 PolarHBondContact O-N 3.23Å; K411-L415 VanDerWaalsContact O-N 3.14Å; E412-L415 PolarHBondContact O-N 2.87Å; L415-A418 PolarHBondContact O-N 3.49Å; L415-V420 HydrophobicContact CD2-CB 4.49Å; L415-V420 HydrophobicContact CD2-CG1 4.43Å; L415-V420 PolarHBondContact O-N 2.74Å; L415-L422 HydrophobicContact CD1-CD1 3.88Å; L415-L422 HydrophobicContact CD1-CD2 4.16Å; L415-L422 HydrophobicContact CD1-CG 4.15Å |
| 416 | N | 77.3 | Confident | 77.2 | Confident | 76 Ų | 76 | 94.8 Ų | 94.8 | 41% | 0.406 | 47% | 0.47 | S | S | . | . | H | α-helix | trans | -67.1 | -38.4 | 174 | -71 | -34.5 | 0 | 0 | 0 | 112.1 | E412 E413 A418 D419 | E412-N416 WeakPolarHBondContact O-CB 3.32Å; E412-N416 VanDerWaalsContact O-CG 3.32Å; E412-N416 PolarHBondContact O-N 3.35Å; E412-N416 PolarHBondContact O-ND2 3Å; E413-N416 PolarHBondContact O-N 2.75Å; N416-A418 PolarHBondContact O-N 2.94Å; N416-D419 PolarHBondContact O-N 2.93Å |
| 417 | E | 80.9 | Confident | 76.3 | Confident | 166 Ų | 166 | 95.3 Ų | 95.3 | 78% | 0.776 | 47% | 0.471 | S | S | * | . | H | α-helix | trans | -62.1 | -22.9 | 171.3 | -76.3 | -177.7 | 168.7 | 0 | 0 | 113.7 | E413 | E413-E417 WeakPolarHBondContact O-CG 3.46Å; E413-E417 PolarHBondContact O-N 3.34Å |
| 418 | A | 74.7 | Confident | 75.3 | Confident | 62 Ų | 62 | 94.9 Ų | 94.9 | 51% | 0.512 | 48% | 0.475 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -97 | 5.8 | -177 | 0 | 0 | 0 | 0 | 0 | 114.2 | V414 L415 N416 V420 | V414-A418 WeakPolarHBondContact O-CB 3.43Å; V414-A418 PolarHBondContact O-N 2.98Å; L415-A418 PolarHBondContact O-N 3.49Å; N416-A418 PolarHBondContact O-N 2.94Å; A418-V420 HydrophobicContact CB-CB 4.49Å; A418-V420 HydrophobicContact CB-CG2 3.89Å; A418-V420 PolarHBondContact O-N 3.38Å; A418-V420 VanDerWaalsContact O-N 3.15Å |
| 419 | D | 66.1 | Low | 74.3 | Confident | 111 Ų | 111 | 99.3 Ų | 99.3 | 59% | 0.594 | 50% | 0.499 | S | S | * | . | T | Hydrogen-bonded Turn | trans | 53.1 | 22.9 | -167.6 | -77.6 | -45.3 | 0 | 0 | 0 | 113.8 | N416 Y421 | N416-D419 PolarHBondContact O-N 2.93Å; D419-Y421 VanDerWaalsContact C-N 3.35Å; D419-Y421 HydrophobicContact CB-CE2 4.48Å; D419-Y421 PolarHBondContact O-N 3.16Å; D419-Y421 VanDerWaalsContact O-N 3.16Å; D419-Y421 PolarHBondContact OD1-OH 3.24Å |
| 420 | V | 64.4 | Low | 73.5 | Confident | 34 Ų | 34 | 98.9 Ų | 98.9 | 21% | 0.206 | 50% | 0.5 | C | S | . | . | trans | -90.7 | 72.4 | 177.5 | -175.4 | 0 | 0 | 0 | 0 | 109 | P374 V375 L415 A418 L422 | P374-V420 HydrophobicContact CB-CG1 4.37Å; P374-V420 HydrophobicContact CG-CG1 4.18Å; V375-V420 HydrophobicContact CG2-CG1 3.96Å; L415-V420 HydrophobicContact CD2-CB 4.49Å; L415-V420 HydrophobicContact CD2-CG1 4.43Å; L415-V420 PolarHBondContact O-N 2.74Å; A418-V420 HydrophobicContact CB-CB 4.49Å; A418-V420 HydrophobicContact CB-CG2 3.89Å; A418-V420 PolarHBondContact O-N 3.38Å; A418-V420 VanDerWaalsContact O-N 3.15Å; V420-L422 PolarHBondContact O-N 3.24Å | ||
| 421 | Y | 56.4 | Low | 72.2 | Confident | 145 Ų | 145 | 96.2 Ų | 96.2 | 57% | 0.569 | 49% | 0.489 | S | S | * | . | trans | -59.1 | 127.8 | -177 | -62.7 | -63.6 | 0 | 0 | 0 | 113 | D419 N423 | D419-Y421 VanDerWaalsContact C-N 3.35Å; D419-Y421 HydrophobicContact CB-CE2 4.48Å; D419-Y421 PolarHBondContact O-N 3.16Å; D419-Y421 VanDerWaalsContact O-N 3.16Å; D419-Y421 PolarHBondContact OD1-OH 3.24Å; Y421-N423 PolarHBondContact O-N 3.23Å; Y421-N423 VanDerWaalsContact O-N 3.14Å | ||
| 422 | L | 54.8 | Low | 70.8 | Confident | 49 Ų | 49 | 96.9 Ų | 96.9 | 26% | 0.257 | 50% | 0.499 | S | S | . | . | trans | -79.8 | 80.5 | 169.3 | -69.4 | 169 | 0 | 0 | 0 | 110.4 | P370 E412 L415 V420 | P370-L422 HydrophobicContact CG-CD2 3.99Å; E412-L422 HydrophobicContact CG-CD1 4.16Å; L415-L422 HydrophobicContact CD1-CD1 3.88Å; L415-L422 HydrophobicContact CD1-CD2 4.16Å; L415-L422 HydrophobicContact CD1-CG 4.15Å; V420-L422 PolarHBondContact O-N 3.24Å | ||
| 423 | N | 45.3 | Very low | 69.8 | Low | 164 Ų | 164 | 97.2 Ų | 97.2 | 88% | 0.877 | 50% | 0.504 | S | S | * | . | trans | -134.7 | 0 | 167.9 | -70.7 | -74.8 | 0 | 0 | 0 | 111.1 | P370 R371 Y421 | P370-N423 WeakPolarHBondContact CA-OXT 3.34Å; P370-N423 WeakPolarHBondContact CB-O 3.28Å; R371-N423 PolarHBondContact N-OXT 3.16Å; Y421-N423 PolarHBondContact O-N 3.23Å; Y421-N423 VanDerWaalsContact O-N 3.14Å |
Retrieved 423 of 423 residues in 511.9 ms
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