| 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 | E | 48.8 | Very low | 48.9 | Very low | 237 Ų | 237 | 145.4 Ų | 145.4 | 100% | 1.107 | 83% | 0.832 | S | S | * | * | 0 | 156.6 | 0 | -87.1 | 172.6 | 95.7 | 0 | 0 | 110.3 | |||||
| 2 | T | 42.3 | Very low | 48.6 | Very low | 132 Ų | 132 | 145.7 Ų | 145.7 | 81% | 0.81 | 82% | 0.823 | S | S | * | * | trans | 79.5 | 84.6 | -179.9 | 73.6 | 0 | 0 | 0 | 0 | 113.8 | ||||
| 3 | S | 42.1 | Very low | 48.3 | Very low | 115 Ų | 115 | 145.8 Ų | 145.8 | 80% | 0.804 | 83% | 0.83 | S | S | * | * | 67.1 | 99.1 | 78.1 | -165.2 | 0 | 0 | 0 | 0 | 112.4 | |||||
| 4 | F | 46.7 | Very low | 47.9 | Very low | 217 Ų | 217 | 141.9 Ų | 141.9 | 95% | 0.952 | 82% | 0.816 | S | S | * | * | trans | -116.4 | 96.7 | 159.5 | -101.3 | -90.7 | 0 | 0 | 0 | 107.4 | ||||
| 5 | G | 49.3 | Very low | 47.8 | Very low | 68 Ų | 68 | 144.2 Ų | 144.2 | 70% | 0.701 | 82% | 0.823 | S | S | * | * | trans | -112.2 | 127.2 | 155.8 | 0 | 0 | 0 | 0 | 0 | 107.5 | ||||
| 6 | S | 49 | Very low | 47.5 | Very low | 118 Ų | 118 | 141 Ų | 141 | 83% | 0.825 | 81% | 0.812 | S | S | * | * | trans | -151 | 112.2 | 153.8 | -163.6 | 0 | 0 | 0 | 0 | 108.8 | ||||
| 7 | S | 55.8 | Low | 48 | Very low | 118 Ų | 118 | 145.2 Ų | 145.2 | 83% | 0.825 | 82% | 0.819 | S | S | * | * | trans | -81.5 | 130.5 | 165.6 | 52.8 | 0 | 0 | 0 | 0 | 109 | ||||
| 8 | E | 60.7 | Low | 47.5 | Very low | 174 Ų | 174 | 143.6 Ų | 143.6 | 81% | 0.813 | 81% | 0.813 | S | S | * | * | trans | -121.7 | 119.7 | 162.8 | 59 | -170.9 | 163.7 | 0 | 0 | 110.5 | ||||
| 9 | N | 49.2 | Very low | 47.7 | Very low | 144 Ų | 144 | 142.4 Ų | 142.4 | 77% | 0.77 | 81% | 0.809 | S | S | * | * | trans | -79.9 | 143.3 | 167.4 | 61.5 | 71.4 | 0 | 0 | 0 | 108.3 | ||||
| 10 | I | 48 | Very low | 47.5 | Very low | 152 Ų | 152 | 140.5 Ų | 140.5 | 78% | 0.779 | 80% | 0.801 | S | S | * | * | trans | -140.6 | 111.3 | 163.2 | -48.3 | 174.1 | 0 | 0 | 0 | 108.2 | ||||
| 11 | T | 46.2 | Very low | 47 | Very low | 124 Ų | 124 | 142.7 Ų | 142.7 | 76% | 0.761 | 80% | 0.801 | S | S | * | * | trans | -112.3 | 145.3 | 167.9 | -63.2 | 0 | 0 | 0 | 0 | 108.6 | ||||
| 12 | M | 45.3 | Very low | 46.5 | Very low | 149 Ų | 149 | 138.1 Ų | 138.1 | 73% | 0.734 | 79% | 0.789 | S | S | * | * | trans | 89.3 | 116.7 | 170.5 | -60 | -131 | 94.9 | 0 | 0 | 118 | ||||
| 13 | T | 44.4 | Very low | 46.3 | Very low | 147 Ų | 147 | 136.8 Ų | 136.8 | 90% | 0.902 | 79% | 0.785 | S | S | * | * | -166.3 | 146.7 | 95.6 | 12.3 | 0 | 0 | 0 | 0 | 112.6 | |||||
| 14 | S | 42.8 | Very low | 46.2 | Very low | 92 Ų | 92 | 139.9 Ų | 139.9 | 64% | 0.643 | 79% | 0.787 | S | S | * | * | trans | -90.9 | 147.3 | -174.3 | -171 | 0 | 0 | 0 | 0 | 111.1 | ||||
| 15 | L | 46.7 | Very low | 45.8 | Very low | 176 Ų | 176 | 137 Ų | 137 | 92% | 0.921 | 78% | 0.782 | S | S | * | * | trans | -151.7 | 117.6 | 144.6 | -150.1 | 82.2 | 0 | 0 | 0 | 111.9 | ||||
| 16 | S | 42.8 | Very low | 45.2 | Very low | 93 Ų | 93 | 137.8 Ų | 137.8 | 65% | 0.65 | 78% | 0.781 | S | S | * | * | trans | -67.8 | 144.7 | 175.7 | -49.3 | 0 | 0 | 0 | 0 | 112.7 | ||||
| 17 | K | 55.7 | Low | 44.8 | Very low | 212 Ų | 212 | 139.1 Ų | 139.1 | 92% | 0.922 | 78% | 0.779 | S | S | * | * | trans | -120 | 107.4 | 149.8 | -113.7 | 179.2 | -178.1 | 178.2 | 0 | 108.9 | ||||
| 18 | V | 40 | Very low | 44.1 | Very low | 117 Ų | 117 | 138.8 Ų | 138.8 | 71% | 0.709 | 77% | 0.773 | S | S | * | * | trans | -72.6 | 127 | 167.9 | 169.7 | 0 | 0 | 0 | 0 | 107.7 | T20 | V18-T20 VanDerWaalsContact CG1-OG1 3.28Å; V18-T20 WeakPolarHBondContact CG1-OG1 3.28Å | ||
| 19 | T | 51.4 | Low | 42.9 | Very low | 121 Ų | 121 | 138 Ų | 138 | 74% | 0.742 | 77% | 0.77 | S | S | * | * | trans | -123.1 | 116.8 | 152.3 | -154.6 | 0 | 0 | 0 | 0 | 106.9 | ||||
| 20 | T | 42.8 | Very low | 42.6 | Very low | 104 Ų | 104 | 137 Ų | 137 | 64% | 0.638 | 77% | 0.769 | S | S | * | * | trans | -100.7 | 119.6 | -177.5 | -63.7 | 0 | 0 | 0 | 0 | 107.5 | V18 | V18-T20 VanDerWaalsContact CG1-OG1 3.28Å; V18-T20 WeakPolarHBondContact CG1-OG1 3.28Å | ||
| 21 | F | 37 | Very low | 42.1 | Very low | 187 Ų | 187 | 135 Ų | 135 | 82% | 0.82 | 76% | 0.764 | S | S | * | * | trans | -135.8 | 116.2 | 150.7 | -61 | -72.9 | 0 | 0 | 0 | 109 | ||||
| 22 | V | 38.3 | Very low | 42 | Very low | 140 Ų | 140 | 137.8 Ų | 137.8 | 85% | 0.848 | 77% | 0.766 | S | S | * | * | trans | 2.4 | 130.4 | 158.7 | 163.8 | 0 | 0 | 0 | 0 | 119 | ||||
| 23 | S | 38.3 | Very low | 42.1 | Very low | 104 Ų | 104 | 136.6 Ų | 136.6 | 73% | 0.727 | 77% | 0.77 | S | S | * | * | trans | -81.5 | 140.5 | 168.3 | 169.6 | 0 | 0 | 0 | 0 | 111.7 | ||||
| 24 | E | 39.6 | Very low | 42.2 | Very low | 180 Ų | 180 | 133.8 Ų | 133.8 | 84% | 0.841 | 76% | 0.761 | S | S | * | * | -170.5 | 123.7 | 126.6 | -157.2 | 126.6 | 82.7 | 0 | 0 | 111.9 | |||||
| 25 | D | 38 | Very low | 42.1 | Very low | 157 Ų | 157 | 137.6 Ų | 137.6 | 84% | 0.84 | 77% | 0.773 | S | S | * | * | trans | 69 | 141.3 | 143.3 | -134 | 3.9 | 0 | 0 | 0 | 124.6 | ||||
| 26 | A | 36.7 | Very low | 42.1 | Very low | 84 Ų | 84 | 133.3 Ų | 133.3 | 69% | 0.694 | 76% | 0.764 | S | S | * | * | trans | 78.4 | 93 | 164.8 | 0 | 0 | 0 | 0 | 0 | 121.1 | ||||
| 27 | L | 41 | Very low | 41.8 | Very low | 147 Ų | 147 | 132.7 Ų | 132.7 | 77% | 0.77 | 76% | 0.759 | S | S | * | * | trans | -20.1 | 132.6 | 138 | -170 | 65.9 | 0 | 0 | 0 | 113.7 | E29 | L27-E29 HydrophobicContact CD1-CG 4.27Š| ||
| 28 | P | 41.3 | Very low | 41.3 | Very low | 110 Ų | 110 | 131.4 Ų | 131.4 | 71% | 0.714 | 75% | 0.754 | S | S | * | * | -133.1 | 134.9 | 71.3 | 30.1 | -10.7 | 0 | 0 | 0 | 116.2 | T30 | P28-T30 PolarHBondContact O-N 2.94Å; P28-T30 VanDerWaalsContact O-N 3.14Å | |||
| 29 | E | 35.4 | Very low | 41.8 | Very low | 158 Ų | 158 | 133.2 Ų | 133.2 | 74% | 0.738 | 75% | 0.752 | S | S | * | * | trans | -55.7 | 113.5 | 157 | -75.8 | -176.4 | 126.5 | 0 | 0 | 108.4 | L27 T31 | L27-E29 HydrophobicContact CD1-CG 4.27Å; E29-T31 PolarHBondContact O-N 3.14Å | ||
| 30 | T | 42.3 | Very low | 41.1 | Very low | 124 Ų | 124 | 134.7 Ų | 134.7 | 76% | 0.761 | 76% | 0.755 | S | S | * | * | trans | -76 | 79.2 | 162.9 | 66.6 | 0 | 0 | 0 | 0 | 107.2 | P28 F32 | P28-T30 PolarHBondContact O-N 2.94Å; P28-T30 VanDerWaalsContact O-N 3.14Å; T30-F32 PolarHBondContact O-N 3.16Å; T30-F32 VanDerWaalsContact O-N 3.16Å | ||
| 31 | T | 37.4 | Very low | 40.9 | Very low | 110 Ų | 110 | 136 Ų | 136 | 68% | 0.675 | 76% | 0.764 | S | S | * | * | trans | -58.8 | 114.9 | 166.7 | -54.9 | 0 | 0 | 0 | 0 | 107.7 | E29 | E29-T31 PolarHBondContact O-N 3.14Š| ||
| 32 | F | 44.7 | Very low | 41 | Very low | 181 Ų | 181 | 133.6 Ų | 133.6 | 79% | 0.794 | 76% | 0.758 | S | S | * | * | trans | -53.7 | 135.6 | 166.5 | -74.1 | -86.5 | 0 | 0 | 0 | 108.7 | T30 A34 | T30-F32 PolarHBondContact O-N 3.16Å; T30-F32 VanDerWaalsContact O-N 3.16Å; F32-A34 PolarHBondContact O-N 3.36Å | ||
| 33 | P | 47.8 | Very low | 40.9 | Very low | 125 Ų | 125 | 132.4 Ų | 132.4 | 81% | 0.812 | 75% | 0.753 | S | S | * | * | trans | -60.2 | 111.1 | -179.9 | 22.3 | -29.8 | 0 | 0 | 0 | 109 | L35 | P33-L35 PolarHBondContact O-N 2.91Š| ||
| 34 | A | 45.3 | Very low | 40.6 | Very low | 87 Ų | 87 | 136 Ų | 136 | 72% | 0.719 | 76% | 0.758 | S | S | * | * | trans | -54.6 | 130.9 | 170.3 | 0 | 0 | 0 | 0 | 0 | 108.1 | F32 A36 | F32-A34 PolarHBondContact O-N 3.36Å; A34-A36 PolarHBondContact O-N 3.34Å | ||
| 35 | L | 42 | Very low | 40.1 | Very low | 172 Ų | 172 | 133.2 Ų | 133.2 | 90% | 0.901 | 75% | 0.754 | S | S | * | * | trans | -49.2 | 112.6 | 171.7 | -88.3 | 165.2 | 0 | 0 | 0 | 108 | P33 S37 | P33-L35 PolarHBondContact O-N 2.91Å; L35-S37 PolarHBondContact O-N 2.92Å; L35-S37 VanDerWaalsContact O-N 3.11Å | ||
| 36 | A | 45.6 | Very low | 40.2 | Very low | 87 Ų | 87 | 130.8 Ų | 130.8 | 72% | 0.719 | 75% | 0.749 | S | S | * | * | trans | -50.9 | 122 | -178.5 | 0 | 0 | 0 | 0 | 0 | 109.2 | A34 F38 | A34-A36 PolarHBondContact O-N 3.34Å; A36-F38 PolarHBondContact O-N 3.28Å; A36-F38 VanDerWaalsContact O-N 3.09Å | ||
| 37 | S | 38.4 | Very low | 39.9 | Very low | 80 Ų | 80 | 134.5 Ų | 134.5 | 56% | 0.559 | 75% | 0.752 | S | S | * | * | trans | -47.3 | 111.2 | 167.9 | 178.2 | 0 | 0 | 0 | 0 | 109.7 | L35 K39 | L35-S37 PolarHBondContact O-N 2.92Å; L35-S37 VanDerWaalsContact O-N 3.11Å; S37-K39 PolarHBondContact O-N 3.38Å; S37-K39 WeakPolarHBondContact OG-CB 3.28Å; S37-K39 WeakPolarHBondContact OG-CG 3.32Å | ||
| 38 | F | 43.7 | Very low | 39.7 | Very low | 184 Ų | 184 | 136.8 Ų | 136.8 | 81% | 0.807 | 76% | 0.759 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -72.3 | 43.1 | 173 | 28.8 | -98.4 | 0 | 0 | 0 | 111.9 | A36 | A36-F38 PolarHBondContact O-N 3.28Å; A36-F38 VanDerWaalsContact O-N 3.09Å |
| 39 | K | 50.3 | Low | 39.3 | Very low | 156 Ų | 156 | 139.7 Ų | 139.7 | 68% | 0.678 | 76% | 0.76 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -109.2 | -18.8 | -178.7 | -60.1 | -83.5 | 179 | 172 | 0 | 112.3 | S37 T41 | S37-K39 PolarHBondContact O-N 3.38Å; S37-K39 WeakPolarHBondContact OG-CB 3.28Å; S37-K39 WeakPolarHBondContact OG-CG 3.32Å; K39-T41 PolarHBondContact O-N 2.87Å |
| 40 | D | 38.2 | Very low | 39.5 | Very low | 151 Ų | 151 | 141.7 Ų | 141.7 | 81% | 0.807 | 77% | 0.769 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -93.9 | 80.6 | 174.7 | -74.3 | -39.2 | 0 | 0 | 0 | 110.6 | ||
| 41 | T | 38.3 | Very low | 39.1 | Very low | 133 Ų | 133 | 145.3 Ų | 145.3 | 82% | 0.816 | 77% | 0.77 | S | S | * | * | T | Hydrogen-bonded Turn | trans | 173.7 | 51.8 | 139.6 | -56.8 | 0 | 0 | 0 | 0 | 109.1 | K39 | K39-T41 PolarHBondContact O-N 2.87Š|
| 42 | I | 38.7 | Very low | 38.9 | Very low | 136 Ų | 136 | 147.8 Ų | 147.8 | 70% | 0.697 | 78% | 0.775 | S | S | * | * | trans | -131.1 | 108 | 162 | -52.4 | 179.9 | 0 | 0 | 0 | 107.4 | Q44 | I42-Q44 PolarHBondContact O-N 3.38Š| ||
| 43 | P | 36 | Very low | 38.9 | Very low | 114 Ų | 114 | 146.1 Ų | 146.1 | 74% | 0.74 | 77% | 0.774 | S | S | * | * | trans | -63.3 | 106.6 | 156.6 | -11.5 | 26.5 | 0 | 0 | 0 | 107.1 | T45 | P43-T45 PolarHBondContact O-N 2.94Š| ||
| 44 | Q | 32.3 | Very low | 38.6 | Very low | 181 Ų | 181 | 148.7 Ų | 148.7 | 85% | 0.846 | 77% | 0.768 | S | S | * | * | trans | -61.2 | 101.6 | 160.1 | -83.5 | -105.3 | 3.9 | 0 | 0 | 107.6 | I42 | I42-Q44 PolarHBondContact O-N 3.38Š| ||
| 45 | T | 28.8 | Very low | 38.2 | Very low | 121 Ų | 121 | 150.9 Ų | 150.9 | 74% | 0.742 | 77% | 0.767 | S | S | * | * | trans | -118.5 | 108.5 | 152.3 | 53.4 | 0 | 0 | 0 | 0 | 107.4 | P43 E47 | P43-T45 PolarHBondContact O-N 2.94Å; T45-E47 PolarHBondContact O-N 3.39Å | ||
| 46 | S | 39.8 | Very low | 38.1 | Very low | 106 Ų | 106 | 152.5 Ų | 152.5 | 74% | 0.741 | 76% | 0.763 | S | S | * | * | trans | -43.9 | 116 | 153.8 | 50.8 | 0 | 0 | 0 | 0 | 109.4 | ||||
| 47 | E | 30.1 | Very low | 38.3 | Very low | 162 Ų | 162 | 157 Ų | 157 | 76% | 0.757 | 77% | 0.766 | S | S | * | * | trans | -170.1 | 122.6 | 143.6 | -105.2 | 175.8 | -156.3 | 0 | 0 | 110.2 | T45 K49 | T45-E47 PolarHBondContact O-N 3.39Å; E47-K49 PolarHBondContact O-N 3.38Å | ||
| 48 | Q | 38.5 | Very low | 38.2 | Very low | 194 Ų | 194 | 159.6 Ų | 159.6 | 91% | 0.907 | 77% | 0.773 | S | S | * | * | trans | -74.7 | 101.5 | 178.3 | 176.5 | -173.3 | -31 | 0 | 0 | 109.5 | ||||
| 49 | K | 33.1 | Very low | 37.9 | Very low | 171 Ų | 171 | 160.5 Ų | 160.5 | 74% | 0.743 | 78% | 0.777 | S | S | * | * | trans | -146.8 | 120.1 | 164.4 | -60 | -170.4 | -172.2 | 173.3 | 0 | 111.8 | E47 | E47-K49 PolarHBondContact O-N 3.38Š| ||
| 50 | E | 38 | Very low | 37.6 | Very low | 200 Ų | 200 | 158.9 Ų | 158.9 | 94% | 0.935 | 78% | 0.781 | S | S | * | * | trans | -36.4 | 125.1 | 160.6 | -166.5 | 165.5 | -159.3 | 0 | 0 | 111.6 | ||||
| 51 | Y | 33.6 | Very low | 37.9 | Very low | 200 Ų | 200 | 161.2 Ų | 161.2 | 78% | 0.784 | 78% | 0.784 | S | S | * | * | trans | -135.7 | 124 | 166.6 | -155.7 | -97.8 | 0 | 0 | 0 | 110.5 | ||||
| 52 | E | 34.2 | Very low | 37.8 | Very low | 163 Ų | 163 | 164.3 Ų | 164.3 | 76% | 0.762 | 79% | 0.789 | S | S | * | * | trans | -75.8 | 149 | -165.1 | -166.7 | 170.3 | 167.9 | 0 | 0 | 112.2 | R54 | E52-R54 PolarHBondContact O-N 3.49Š| ||
| 53 | N | 44.5 | Very low | 37.5 | Very low | 146 Ų | 146 | 166 Ų | 166 | 78% | 0.781 | 80% | 0.799 | S | S | * | * | trans | -5.6 | 109.4 | 155.8 | -170.8 | 14.9 | 0 | 0 | 0 | 115.9 | ||||
| 54 | R | 41 | Very low | 37.4 | Very low | 179 Ų | 179 | 168 Ų | 168 | 68% | 0.675 | 80% | 0.803 | S | S | * | * | trans | -104.9 | 106.2 | 163.7 | -82.9 | -111.5 | -77.3 | -91.8 | -4.4 | 109.5 | E52 Y56 | E52-R54 PolarHBondContact O-N 3.49Å; R54-Y56 WeakPolarHBondContact O-CD2 3.33Å; R54-Y56 WeakPolarHBondContact O-CE2 3.35Å | ||
| 55 | D | 37.5 | Very low | 37.6 | Very low | 133 Ų | 133 | 164.9 Ų | 164.9 | 71% | 0.711 | 80% | 0.798 | S | S | * | * | trans | -54.7 | 123.1 | 168.2 | -177 | 33.2 | 0 | 0 | 0 | 111.2 | ||||
| 56 | Y | 39.8 | Very low | 37.7 | Very low | 205 Ų | 205 | 165.7 Ų | 165.7 | 80% | 0.804 | 80% | 0.803 | S | S | * | * | trans | -101.8 | 85.9 | 177.2 | -70.5 | -90.3 | 0 | 0 | 0 | 109.4 | R54 | R54-Y56 WeakPolarHBondContact O-CD2 3.33Å; R54-Y56 WeakPolarHBondContact O-CE2 3.35Å | ||
| 57 | K | 49.3 | Very low | 37.2 | Very low | 182 Ų | 182 | 165.4 Ų | 165.4 | 79% | 0.791 | 81% | 0.807 | S | S | * | * | trans | -134.7 | 70.7 | 171.5 | -84.2 | -75.3 | -179.8 | -178.8 | 0 | 110.1 | ||||
| 58 | D | 36.6 | Very low | 37.3 | Very low | 134 Ų | 134 | 166.1 Ų | 166.1 | 72% | 0.717 | 81% | 0.811 | S | S | * | * | trans | -161.4 | 74.5 | 164.7 | -156.3 | 29.2 | 0 | 0 | 0 | 113.9 | ||||
| 59 | F | 38.3 | Very low | 36.8 | Very low | 203 Ų | 203 | 167.7 Ų | 167.7 | 89% | 0.89 | 81% | 0.808 | S | S | * | * | trans | -130.3 | 3.5 | 164.4 | -75.8 | -68.9 | 0 | 0 | 0 | 113.8 | K61 | F59-K61 PolarHBondContact O-N 2.91Å; F59-K61 VanDerWaalsContact O-N 3.15Å | ||
| 60 | T | 42.5 | Very low | 36.8 | Very low | 123 Ų | 123 | 164.5 Ų | 164.5 | 76% | 0.755 | 81% | 0.808 | S | S | * | * | trans | -86.9 | 84.8 | 172 | 45.8 | 0 | 0 | 0 | 0 | 110 | ||||
| 61 | K | 45.7 | Very low | 36.7 | Very low | 199 Ų | 199 | 164 Ų | 164 | 87% | 0.865 | 81% | 0.806 | S | S | * | * | trans | 156.8 | 99.2 | 143.7 | -87.8 | 166.1 | -174.2 | -179.6 | 0 | 111 | F59 | F59-K61 PolarHBondContact O-N 2.91Å; F59-K61 VanDerWaalsContact O-N 3.15Å | ||
| 62 | Q | 36.4 | Very low | 36.6 | Very low | 199 Ų | 199 | 163.7 Ų | 163.7 | 93% | 0.93 | 81% | 0.811 | S | S | * | * | trans | -144.4 | 125.9 | 139.5 | -76.3 | -158.8 | -19.7 | 0 | 0 | 109.6 | ||||
| 63 | D | 31.1 | Very low | 36.4 | Very low | 170 Ų | 170 | 160.5 Ų | 160.5 | 91% | 0.909 | 81% | 0.812 | S | S | * | * | trans | -57 | 144.3 | 177 | -90.9 | -56.4 | 0 | 0 | 0 | 113.1 | ||||
| 64 | L | 33.8 | Very low | 35.6 | Very low | 158 Ų | 158 | 159.8 Ų | 159.8 | 83% | 0.827 | 81% | 0.814 | S | S | * | * | trans | -115.4 | 139.6 | 171.2 | -156.6 | 89.4 | 0 | 0 | 0 | 109.7 | ||||
| 65 | P | 36.2 | Very low | 35.2 | Very low | 114 Ų | 114 | 157 Ų | 157 | 74% | 0.74 | 82% | 0.82 | S | S | * | * | trans | -89.4 | 141.5 | 163.4 | 33.3 | -27.7 | 0 | 0 | 0 | 111.9 | ||||
| 66 | T | 30.7 | Very low | 35.3 | Very low | 138 Ų | 138 | 156.5 Ų | 156.5 | 85% | 0.847 | 82% | 0.824 | S | S | * | * | trans | -54.9 | 132.7 | 173.4 | -53.4 | 0 | 0 | 0 | 0 | 114.4 | ||||
| 67 | A | 29.8 | Very low | 35.2 | Very low | 100 Ų | 100 | 152.3 Ų | 152.3 | 83% | 0.826 | 83% | 0.825 | S | S | * | * | trans | -161.3 | 135.1 | 142.5 | 0 | 0 | 0 | 0 | 0 | 111.6 | ||||
| 68 | E | 33 | Very low | 34.9 | Very low | 177 Ų | 177 | 149.8 Ų | 149.8 | 83% | 0.827 | 83% | 0.827 | S | S | * | * | trans | -69.2 | 157 | -170.1 | -56.6 | 167.4 | 99.1 | 0 | 0 | 115.2 | ||||
| 69 | R | 28.1 | Very low | 34.7 | Very low | 227 Ų | 227 | 148.2 Ų | 148.2 | 86% | 0.857 | 83% | 0.833 | S | S | * | * | 159.2 | 124.4 | 104 | -168.1 | 170.3 | -171.1 | 115.5 | -2.1 | 112.2 | |||||
| 70 | S | 32.1 | Very low | 34.6 | Very low | 105 Ų | 105 | 144.4 Ų | 144.4 | 73% | 0.734 | 83% | 0.831 | S | S | * | * | trans | -57.5 | 154 | 177.4 | -41.5 | 0 | 0 | 0 | 0 | 114.9 | ||||
| 71 | Q | 35.5 | Very low | 34.3 | Very low | 189 Ų | 189 | 144.4 Ų | 144.4 | 88% | 0.883 | 84% | 0.836 | S | S | * | * | -172.3 | 129.1 | 117.8 | -98.8 | 165.9 | 14.7 | 0 | 0 | 113.1 | |||||
| 72 | E | 32.4 | Very low | 33.6 | Very low | 194 Ų | 194 | 138.7 Ų | 138.7 | 91% | 0.907 | 83% | 0.834 | S | S | * | * | trans | -81.7 | 138.4 | 179.7 | -175.6 | 174.2 | 123.3 | 0 | 0 | 110.5 | ||||
| 73 | A | 30.7 | Very low | 33.4 | Very low | 95 Ų | 95 | 133.7 Ų | 133.7 | 79% | 0.785 | 83% | 0.827 | S | S | * | * | trans | -147 | 102.8 | 169.6 | 0 | 0 | 0 | 0 | 0 | 111.5 | ||||
| 74 | T | 27.2 | Very low | 33.4 | Very low | 131 Ų | 131 | 130.7 Ų | 130.7 | 80% | 0.804 | 82% | 0.819 | S | S | * | * | trans | -3.4 | 124.8 | 149.7 | -56.5 | 0 | 0 | 0 | 0 | 118.5 | ||||
| 75 | C | 32.8 | Very low | 33.3 | Very low | 120 Ų | 120 | 131.8 Ų | 131.8 | 81% | 0.811 | 82% | 0.82 | S | S | * | * | P | Polyproline II helix | trans | -81.4 | 139.3 | 164.5 | -57.6 | 0 | 0 | 0 | 0 | 111.7 | ||
| 76 | P | 39.2 | Very low | 33 | Very low | 123 Ų | 123 | 134.1 Ų | 134.1 | 80% | 0.799 | 82% | 0.821 | S | S | * | * | P | Polyproline II helix | trans | -94.8 | 131.2 | 159.7 | 32.8 | -25.5 | 0 | 0 | 0 | 111.1 | ||
| 77 | S | 37.1 | Very low | 33.3 | Very low | 118 Ų | 118 | 133.5 Ų | 133.5 | 83% | 0.825 | 82% | 0.817 | S | S | * | * | P | Polyproline II helix | trans | -76.8 | 144.6 | 167.6 | -58.9 | 0 | 0 | 0 | 0 | 111.1 | ||
| 78 | P | 44.4 | Very low | 33.9 | Very low | 129 Ų | 129 | 133.6 Ų | 133.6 | 84% | 0.838 | 81% | 0.81 | S | S | * | * | P | Polyproline II helix | trans | -91.2 | 138.4 | 166.8 | 33.1 | -27.5 | 0 | 0 | 0 | 111.5 | ||
| 79 | A | 31.9 | Very low | 33.9 | Very low | 100 Ų | 100 | 132.6 Ų | 132.6 | 83% | 0.826 | 81% | 0.81 | S | S | * | * | P | Polyproline II helix | trans | -81.8 | 149.6 | 162.7 | 0 | 0 | 0 | 0 | 0 | 110.2 | ||
| 80 | S | 36 | Very low | 34.3 | Very low | 123 Ų | 123 | 131 Ų | 131 | 86% | 0.86 | 81% | 0.812 | S | S | * | * | trans | -158.4 | 137.4 | 146.6 | -167.4 | 0 | 0 | 0 | 0 | 112.1 | ||||
| 81 | S | 37.1 | Very low | 34.2 | Very low | 123 Ų | 123 | 131.6 Ų | 131.6 | 86% | 0.86 | 82% | 0.815 | S | S | * | * | trans | -83.1 | 168.3 | -177.2 | -47.1 | 0 | 0 | 0 | 0 | 113.5 | ||||
| 82 | G | 30.5 | Very low | 34.5 | Very low | 79 Ų | 79 | 127.6 Ų | 127.6 | 81% | 0.814 | 81% | 0.808 | S | S | * | * | trans | 141.6 | 120.1 | 144.3 | 0 | 0 | 0 | 0 | 0 | 116.8 | ||||
| 83 | A | 32.5 | Very low | 35.3 | Very low | 95 Ų | 95 | 125.9 Ų | 125.9 | 79% | 0.785 | 81% | 0.805 | S | S | * | * | trans | -74.9 | 164.7 | -175 | 0 | 0 | 0 | 0 | 0 | 116.6 | ||||
| 84 | S | 29.7 | Very low | 37 | Very low | 107 Ų | 107 | 128.4 Ų | 128.4 | 75% | 0.748 | 81% | 0.805 | S | S | * | * | 169.9 | 134.8 | 113.3 | -71.9 | 0 | 0 | 0 | 0 | 115.3 | |||||
| 85 | Q | 33.5 | Very low | 38.1 | Very low | 180 Ų | 180 | 131.8 Ų | 131.8 | 84% | 0.841 | 81% | 0.809 | S | S | * | * | trans | 52.6 | 152.8 | 142.8 | -73 | -179.9 | -10.2 | 0 | 0 | 121.4 | ||||
| 86 | E | 29.5 | Very low | 39.1 | Very low | 164 Ų | 164 | 128.5 Ų | 128.5 | 77% | 0.766 | 80% | 0.796 | S | S | * | * | cis | -170.7 | 159.9 | -11.6 | -175.9 | 169.9 | 145.3 | 0 | 0 | 105.7 | ||||
| 87 | T | 35.4 | Very low | 39.9 | Very low | 125 Ų | 125 | 130.5 Ų | 130.5 | 77% | 0.767 | 80% | 0.795 | S | S | * | * | trans | -82.9 | -168.4 | -163.3 | 59.5 | 0 | 0 | 0 | 0 | 114.5 | ||||
| 88 | P | 42.4 | Very low | 40.2 | Very low | 102 Ų | 102 | 134.4 Ų | 134.4 | 66% | 0.662 | 80% | 0.797 | S | S | * | * | cis | -137.5 | 168.2 | -5.4 | 40.3 | -21.9 | 0 | 0 | 0 | 115.9 | ||||
| 89 | N | 34.1 | Very low | 40.4 | Very low | 156 Ų | 156 | 135.9 Ų | 135.9 | 83% | 0.834 | 79% | 0.793 | S | S | * | * | trans | 174.5 | 142.8 | 134.1 | -89.5 | -38 | 0 | 0 | 0 | 113.2 | ||||
| 90 | E | 36.8 | Very low | 41.3 | Very low | 192 Ų | 192 | 136.6 Ų | 136.6 | 90% | 0.897 | 79% | 0.791 | S | S | * | * | trans | -76.6 | 150.5 | -168.2 | -59.2 | 169 | 105.1 | 0 | 0 | 114.7 | ||||
| 91 | C | 30.3 | Very low | 41.9 | Very low | 118 Ų | 118 | 139.3 Ų | 139.3 | 80% | 0.797 | 79% | 0.791 | S | S | * | * | trans | -172.1 | 111.2 | 132.9 | -159.8 | 0 | 0 | 0 | 0 | 111.8 | ||||
| 92 | S | 40.5 | Very low | 42.5 | Very low | 106 Ų | 106 | 142.3 Ų | 142.3 | 74% | 0.741 | 79% | 0.788 | S | S | * | * | trans | 26.7 | 125.1 | 156 | 62.5 | 0 | 0 | 0 | 0 | 122 | ||||
| 93 | D | 50.1 | Low | 43.8 | Very low | 158 Ų | 158 | 143.8 Ų | 143.8 | 85% | 0.845 | 78% | 0.783 | S | S | * | * | trans | -131.8 | 121.5 | 137.1 | -162 | 15.4 | 0 | 0 | 0 | 109.5 | ||||
| 94 | D | 66.1 | Low | 45 | Very low | 147 Ų | 147 | 148.5 Ų | 148.5 | 79% | 0.786 | 79% | 0.786 | S | S | * | * | trans | -97.7 | 101.4 | 179.4 | 171 | 48.3 | 0 | 0 | 0 | 107.3 | ||||
| 95 | F | 50.9 | Low | 46.6 | Very low | 202 Ų | 202 | 149 Ų | 149 | 89% | 0.886 | 78% | 0.779 | S | S | * | * | trans | -148.2 | 97.3 | 165.9 | -143.5 | -94.1 | 0 | 0 | 0 | 111.7 | ||||
| 96 | G | 53.9 | Low | 47.9 | Very low | 52 Ų | 52 | 144.1 Ų | 144.1 | 54% | 0.536 | 77% | 0.765 | S | S | . | * | trans | 80.6 | 94.1 | 139.6 | 0 | 0 | 0 | 0 | 0 | 117.9 | F98 | G96-F98 PolarHBondContact O-N 3.11Š| ||
| 97 | E | 54.4 | Low | 49.3 | Very low | 165 Ų | 165 | 146 Ų | 146 | 77% | 0.771 | 77% | 0.771 | S | S | * | * | trans | -48.9 | 119.8 | 158 | -178.8 | -179.3 | -177.5 | 0 | 0 | 112.5 | ||||
| 98 | F | 43.8 | Very low | 50.5 | Low | 200 Ų | 200 | 147.1 Ų | 147.1 | 88% | 0.877 | 77% | 0.765 | S | S | * | * | trans | -118.4 | 109.3 | 157.4 | -82.6 | -82.8 | 0 | 0 | 0 | 109.6 | G96 S100 | G96-F98 PolarHBondContact O-N 3.11Å; F98-S100 PolarHBondContact O-N 2.8Å | ||
| 99 | Q | 49.6 | Very low | 51.2 | Low | 160 Ų | 160 | 147 Ų | 147 | 75% | 0.748 | 76% | 0.759 | S | S | * | * | trans | -36.6 | 115.5 | 169.8 | -70.4 | -88.4 | 9.9 | 0 | 0 | 112.7 | E101 | Q99-E101 PolarHBondContact O-N 2.97Š| ||
| 100 | S | 51.2 | Low | 52.3 | Low | 114 Ų | 114 | 147.4 Ų | 147.4 | 80% | 0.797 | 75% | 0.753 | S | S | * | * | trans | -88.9 | 93.3 | 173.9 | 62.4 | 0 | 0 | 0 | 0 | 111.1 | F98 | F98-S100 PolarHBondContact O-N 2.8Š| ||
| 101 | E | 47.3 | Very low | 53.6 | Low | 181 Ų | 181 | 144.6 Ų | 144.6 | 85% | 0.846 | 74% | 0.744 | S | S | * | * | trans | -99.2 | 128.9 | 156.7 | -78.5 | -168.7 | 137.5 | 0 | 0 | 109.5 | Q99 P103 | Q99-E101 PolarHBondContact O-N 2.97Å; E101-P103 VanDerWaalsContact O-CD 3.25Å; E101-P103 WeakPolarHBondContact O-CD 3.5Å | ||
| 102 | K | 51 | Low | 55.1 | Low | 185 Ų | 185 | 143.6 Ų | 143.6 | 80% | 0.804 | 73% | 0.734 | S | S | * | * | trans | -80.7 | 124.2 | -178.5 | -68.8 | 168.1 | 179 | 152.2 | 0 | 110.5 | ||||
| 103 | P | 56.2 | Low | 55.8 | Low | 110 Ų | 110 | 142.6 Ų | 142.6 | 71% | 0.714 | 73% | 0.732 | S | S | * | * | trans | -105.6 | 112 | 136.7 | -10.6 | 28.4 | 0 | 0 | 0 | 110.1 | E101 I105 | E101-P103 VanDerWaalsContact O-CD 3.25Å; E101-P103 WeakPolarHBondContact O-CD 3.5Å; P103-I105 VanDerWaalsContact C-N 3.31Å; P103-I105 HydrophobicContact CB-CG2 4.19Å; P103-I105 PolarHBondContact O-N 3.42Å | ||
| 104 | K | 58.5 | Low | 55.9 | Low | 195 Ų | 195 | 140.5 Ų | 140.5 | 85% | 0.848 | 73% | 0.725 | S | S | * | * | trans | -71.6 | 86.3 | 168.5 | -68.2 | 176.8 | -179.5 | 178.2 | 0 | 108.6 | ||||
| 105 | I | 62.4 | Low | 55.2 | Low | 117 Ų | 117 | 138.4 Ų | 138.4 | 60% | 0.6 | 72% | 0.722 | S | S | * | * | trans | -95 | 104.9 | 164 | 102.4 | 87.3 | 0 | 0 | 0 | 106.1 | P103 | P103-I105 VanDerWaalsContact C-N 3.31Å; P103-I105 HydrophobicContact CB-CG2 4.19Å; P103-I105 PolarHBondContact O-N 3.42Å | ||
| 106 | S | 60.8 | Low | 55.5 | Low | 77 Ų | 77 | 138.1 Ų | 138.1 | 54% | 0.538 | 72% | 0.724 | S | S | . | * | trans | -66.3 | 134.3 | 179.9 | -177.6 | 0 | 0 | 0 | 0 | 107.9 | F108 D109 | S106-F108 PolarHBondContact O-N 3.31Å; S106-D109 PolarHBondContact O-N 3.4Å | ||
| 107 | K | 60.6 | Low | 55.1 | Low | 204 Ų | 204 | 140 Ų | 140 | 89% | 0.887 | 73% | 0.728 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -57.1 | -3.8 | -175.9 | -165.5 | 171.2 | 179.4 | 176.4 | 0 | 114.5 | ||
| 108 | F | 60.5 | Low | 55.3 | Low | 149 Ų | 149 | 142.2 Ų | 142.2 | 65% | 0.654 | 74% | 0.735 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -88.6 | -22.9 | 174.9 | -159.5 | -99.7 | 0 | 0 | 0 | 113.8 | S106 F110 L111 | S106-F108 PolarHBondContact O-N 3.31Å; F108-F110 VanDerWaalsContact C-N 3.35Å; F108-F110 PolarHBondContact O-N 3.41Å; F108-L111 PolarHBondContact O-N 3.44Å |
| 109 | D | 56.8 | Low | 55.8 | Low | 100 Ų | 100 | 141.2 Ų | 141.2 | 54% | 0.535 | 74% | 0.736 | S | S | . | * | G | 310 helix | trans | -74.2 | -24.9 | -176.1 | -68.6 | -36 | 0 | 0 | 0 | 113 | S106 L111 | S106-D109 PolarHBondContact O-N 3.4Å; D109-L111 PolarHBondContact O-N 2.9Å |
| 110 | F | 56.7 | Low | 56.4 | Low | 163 Ų | 163 | 141.1 Ų | 141.1 | 72% | 0.715 | 73% | 0.733 | S | S | * | * | G | 310 helix | trans | -63.4 | -28.3 | 177 | -174.2 | -99.5 | 0 | 0 | 0 | 112.6 | F108 | F108-F110 VanDerWaalsContact C-N 3.35Å; F108-F110 PolarHBondContact O-N 3.41Å |
| 111 | L | 63.3 | Low | 56.8 | Low | 133 Ų | 133 | 139 Ų | 139 | 70% | 0.696 | 72% | 0.718 | S | S | * | * | G | 310 helix | trans | -84.8 | -17.3 | -171.9 | -133.2 | 76.1 | 0 | 0 | 0 | 113.8 | F108 D109 | F108-L111 PolarHBondContact O-N 3.44Å; D109-L111 PolarHBondContact O-N 2.9Å |
| 112 | V | 61.6 | Low | 57.4 | Low | 97 Ų | 97 | 134.5 Ų | 134.5 | 59% | 0.588 | 71% | 0.706 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -91.4 | -16.4 | -179.1 | 158.5 | 0 | 0 | 0 | 0 | 112.4 | T114 S115 | V112-T114 VanDerWaalsContact C-N 3.3Å; V112-T114 PolarHBondContact O-N 3.5Å; V112-S115 PolarHBondContact O-OG 3.46Å |
| 113 | A | 56 | Low | 58.2 | Low | 85 Ų | 85 | 132.4 Ų | 132.4 | 70% | 0.702 | 70% | 0.7 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -77.4 | -3.4 | -172.3 | 0 | 0 | 0 | 0 | 0 | 115.5 | ||
| 114 | T | 51.3 | Low | 58.5 | Low | 115 Ų | 115 | 133 Ų | 133 | 71% | 0.706 | 69% | 0.693 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -122.7 | 8.2 | -175.9 | 44.7 | 0 | 0 | 0 | 0 | 115.4 | V112 Q116 | V112-T114 VanDerWaalsContact C-N 3.3Å; V112-T114 PolarHBondContact O-N 3.5Å; T114-Q116 PolarHBondContact O-N 3.07Å |
| 115 | S | 52.2 | Low | 59 | Low | 102 Ų | 102 | 129.7 Ų | 129.7 | 71% | 0.713 | 68% | 0.682 | S | S | * | * | trans | -80.1 | 23.3 | -176.7 | 56.1 | 0 | 0 | 0 | 0 | 115.9 | V112 | V112-S115 PolarHBondContact O-OG 3.46Š| ||
| 116 | Q | 56.8 | Low | 59.3 | Low | 197 Ų | 197 | 129.2 Ų | 129.2 | 92% | 0.921 | 68% | 0.679 | S | S | * | * | trans | -118.3 | 74.5 | 165.1 | -78.4 | -169 | 29.3 | 0 | 0 | 111.2 | T114 | T114-Q116 PolarHBondContact O-N 3.07Š| ||
| 117 | S | 46.5 | Very low | 59.6 | Low | 90 Ų | 90 | 133 Ų | 133 | 63% | 0.629 | 69% | 0.686 | S | S | * | * | trans | -130.2 | 124.5 | 150.8 | 82.3 | 0 | 0 | 0 | 0 | 108.2 | M119 | S117-M119 PolarHBondContact O-N 3.3Š| ||
| 118 | K | 58.1 | Low | 59.8 | Low | 213 Ų | 213 | 126.6 Ų | 126.6 | 93% | 0.926 | 67% | 0.667 | S | S | * | * | trans | -58.9 | 103.7 | 167.2 | -77.3 | -174.3 | 176.3 | -176.4 | 0 | 106.4 | K120 | K118-K120 PolarHBondContact O-N 3.02Å; K118-K120 VanDerWaalsContact O-N 3.09Å | ||
| 119 | M | 53.7 | Low | 60 | Low | 179 Ų | 179 | 124.9 Ų | 124.9 | 88% | 0.882 | 66% | 0.661 | S | S | * | * | trans | -60.9 | 113.3 | 170.1 | -67.5 | -177 | 178 | 0 | 0 | 107.4 | S117 S121 | S117-M119 PolarHBondContact O-N 3.3Å; M119-S121 PolarHBondContact O-N 2.96Å | ||
| 120 | K | 63.2 | Low | 60.3 | Low | 158 Ų | 158 | 125.7 Ų | 125.7 | 69% | 0.687 | 67% | 0.665 | S | S | * | * | trans | -68.7 | 125 | 169 | -148.7 | 109.7 | 114.8 | 178.2 | 0 | 106.4 | K118 S122 E124 | K118-K120 PolarHBondContact O-N 3.02Å; K118-K120 VanDerWaalsContact O-N 3.09Å; K120-S122 PolarHBondContact O-N 3.25Å; K120-E124 HydrophobicContact CG-CB 4.04Å; K120-E124 WeakPolarHBondContact CG-OE2 3.42Å | ||
| 121 | S | 59.8 | Low | 60.4 | Low | 70 Ų | 70 | 120.6 Ų | 120.6 | 49% | 0.49 | 65% | 0.653 | S | S | . | * | trans | -55.9 | 138.5 | 178.8 | -178.1 | 0 | 0 | 0 | 0 | 109.6 | M119 E123 E124 M125 | M119-S121 PolarHBondContact O-N 2.96Å; S121-E123 PolarHBondContact O-N 3.38Å; S121-E124 PolarHBondContact O-N 2.92Å; S121-M125 PolarHBondContact O-N 2.72Å | ||
| 122 | S | 60.2 | Low | 60.1 | Low | 86 Ų | 86 | 119 Ų | 119 | 60% | 0.601 | 65% | 0.649 | S | S | * | * | H | α-helix | trans | -51.9 | -24.8 | 177.2 | 48.3 | 0 | 0 | 0 | 0 | 112.6 | K120 M125 I126 | K120-S122 PolarHBondContact O-N 3.25Å; S122-M125 PolarHBondContact O-N 2.99Å; S122-I126 WeakPolarHBondContact O-CD1 3.48Å; S122-I126 VanDerWaalsContact O-CG1 3.31Å; S122-I126 WeakPolarHBondContact O-CG1 3.23Å; S122-I126 PolarHBondContact O-N 3.37Å |
| 123 | E | 67 | Low | 59.9 | Low | 141 Ų | 141 | 120.9 Ų | 120.9 | 66% | 0.659 | 65% | 0.649 | S | S | * | * | H | α-helix | trans | -69.1 | -37.1 | 175.9 | -165.3 | 161.6 | 145.7 | 0 | 0 | 114 | S121 M125 K127 | S121-E123 PolarHBondContact O-N 3.38Å; E123-M125 VanDerWaalsContact C-N 3.31Å; E123-K127 PolarHBondContact O-N 3.29Å |
| 124 | E | 63.5 | Low | 59.6 | Low | 122 Ų | 122 | 122.5 Ų | 122.5 | 57% | 0.57 | 65% | 0.646 | S | S | * | * | H | α-helix | trans | -71.7 | -30.5 | 175 | -74.6 | -146.9 | 129.3 | 0 | 0 | 112 | K120 S121 K127 S128 | K120-E124 HydrophobicContact CG-CB 4.04Å; K120-E124 WeakPolarHBondContact CG-OE2 3.42Å; S121-E124 PolarHBondContact O-N 2.92Å; E124-K127 PolarHBondContact O-N 2.93Å; E124-S128 PolarHBondContact O-N 3.13Å; E124-S128 VanDerWaalsContact O-N 3.08Å |
| 125 | M | 67.6 | Low | 59.7 | Low | 126 Ų | 126 | 123.5 Ų | 123.5 | 62% | 0.621 | 65% | 0.647 | S | S | * | * | H | α-helix | trans | -68.5 | -41.5 | 178.6 | -135.4 | 173.9 | 71.6 | 0 | 0 | 111.1 | S121 S122 E123 K127 S128 E129 | S121-M125 PolarHBondContact O-N 2.72Å; S122-M125 PolarHBondContact O-N 2.99Å; E123-M125 VanDerWaalsContact C-N 3.31Å; M125-K127 VanDerWaalsContact C-N 3.33Å; M125-K127 PolarHBondContact O-N 2.98Å; M125-S128 WeakPolarHBondContact O-CB 3.46Å; M125-S128 PolarHBondContact O-N 2.99Å; M125-E129 WeakPolarHBondContact O-CG 3.33Å; M125-E129 PolarHBondContact O-N 3.09Å |
| 126 | I | 69.7 | Low | 59.8 | Low | 107 Ų | 107 | 122.7 Ų | 122.7 | 55% | 0.549 | 64% | 0.641 | S | S | . | * | H | α-helix | trans | -67.3 | -35.1 | 176.7 | -65.2 | 163.4 | 0 | 0 | 0 | 111.1 | S122 E129 L130 | S122-I126 WeakPolarHBondContact O-CD1 3.48Å; S122-I126 VanDerWaalsContact O-CG1 3.31Å; S122-I126 WeakPolarHBondContact O-CG1 3.23Å; S122-I126 PolarHBondContact O-N 3.37Å; I126-E129 PolarHBondContact O-N 2.93Å; I126-L130 HydrophobicContact CG2-CD1 4.2Å; I126-L130 PolarHBondContact O-N 3.39Å |
| 127 | K | 67.2 | Low | 59.5 | Low | 156 Ų | 156 | 118.8 Ų | 118.8 | 68% | 0.678 | 63% | 0.63 | S | S | * | * | H | α-helix | trans | -69.5 | -36 | 177.7 | -133.7 | 171.5 | -171.4 | 173 | 0 | 113.1 | E123 E124 M125 A131 | E123-K127 PolarHBondContact O-N 3.29Å; E124-K127 PolarHBondContact O-N 2.93Å; M125-K127 VanDerWaalsContact C-N 3.33Å; M125-K127 PolarHBondContact O-N 2.98Å; K127-A131 PolarHBondContact O-N 3.29Å |
| 128 | S | 64 | Low | 59.4 | Low | 70 Ų | 70 | 122.8 Ų | 122.8 | 49% | 0.49 | 64% | 0.639 | S | S | . | * | H | α-helix | trans | -63.1 | -43.1 | 174.1 | 170.7 | 0 | 0 | 0 | 0 | 112.3 | E124 M125 T132 | E124-S128 PolarHBondContact O-N 3.13Å; E124-S128 VanDerWaalsContact O-N 3.08Å; M125-S128 WeakPolarHBondContact O-CB 3.46Å; M125-S128 PolarHBondContact O-N 2.99Å; S128-T132 PolarHBondContact O-N 3.49Å; S128-T132 PolarHBondContact O-OG1 2.81Å; S128-T132 VanDerWaalsContact O-OG1 3.07Å |
| 129 | E | 64.5 | Low | 58.7 | Low | 113 Ų | 113 | 117 Ų | 117 | 53% | 0.528 | 63% | 0.631 | S | S | . | * | H | α-helix | trans | -65.2 | -47.9 | 177.6 | -68.1 | -69.3 | 139.7 | 0 | 0 | 111 | M125 I126 A131 T132 F133 | M125-E129 WeakPolarHBondContact O-CG 3.33Å; M125-E129 PolarHBondContact O-N 3.09Å; I126-E129 PolarHBondContact O-N 2.93Å; E129-A131 PolarHBondContact O-N 2.77Å; E129-T132 WeakPolarHBondContact O-CB 3.26Å; E129-T132 PolarHBondContact O-N 2.92Å; E129-F133 VanDerWaalsContact O-CD2 3.31Å; E129-F133 WeakPolarHBondContact O-CD2 3.45Å; E129-F133 PolarHBondContact O-N 3.19Å; E129-F133 VanDerWaalsContact O-N 3.11Å |
| 130 | L | 62.6 | Low | 58.3 | Low | 116 Ų | 116 | 116.3 Ų | 116.3 | 61% | 0.607 | 63% | 0.63 | S | S | * | * | H | α-helix | trans | -62.7 | -37.5 | -178.8 | -82.5 | 163.2 | 0 | 0 | 0 | 113.8 | I126 T132 F133 D134 | I126-L130 HydrophobicContact CG2-CD1 4.2Å; I126-L130 PolarHBondContact O-N 3.39Å; L130-T132 PolarHBondContact O-N 2.65Å; L130-F133 PolarHBondContact O-N 3.42Å; L130-D134 PolarHBondContact O-N 2.95Å |
| 131 | A | 60.1 | Low | 56.9 | Low | 57 Ų | 57 | 117.2 Ų | 117.2 | 47% | 0.471 | 64% | 0.637 | S | S | . | * | H | α-helix | trans | -64.4 | -30.5 | 175.7 | 0 | 0 | 0 | 0 | 0 | 112.4 | K127 E129 L135 | K127-A131 PolarHBondContact O-N 3.29Å; E129-A131 PolarHBondContact O-N 2.77Å; A131-L135 WeakPolarHBondContact O-CD1 3.49Å |
| 132 | T | 57 | Low | 55.7 | Low | 99 Ų | 99 | 122 Ų | 122 | 61% | 0.607 | 65% | 0.651 | S | S | * | * | H | α-helix | trans | -78.9 | -33.7 | 179 | -54.3 | 0 | 0 | 0 | 0 | 111.5 | S128 E129 L130 | S128-T132 PolarHBondContact O-N 3.49Å; S128-T132 PolarHBondContact O-OG1 2.81Å; S128-T132 VanDerWaalsContact O-OG1 3.07Å; E129-T132 WeakPolarHBondContact O-CB 3.26Å; E129-T132 PolarHBondContact O-N 2.92Å; L130-T132 PolarHBondContact O-N 2.65Å |
| 133 | F | 57.7 | Low | 54.8 | Low | 136 Ų | 136 | 122.6 Ų | 122.6 | 60% | 0.596 | 65% | 0.653 | S | S | * | * | H | α-helix | trans | -68.6 | -35.6 | 175.4 | -86.2 | -78.5 | 0 | 0 | 0 | 113 | E129 L130 L135 S136 | E129-F133 VanDerWaalsContact O-CD2 3.31Å; E129-F133 WeakPolarHBondContact O-CD2 3.45Å; E129-F133 PolarHBondContact O-N 3.19Å; E129-F133 VanDerWaalsContact O-N 3.11Å; L130-F133 PolarHBondContact O-N 3.42Å; F133-L135 VanDerWaalsContact C-N 3.34Å; F133-L135 PolarHBondContact O-N 3.46Å; F133-S136 PolarHBondContact O-N 3.27Å; F133-S136 PolarHBondContact O-OG 2.87Å |
| 134 | D | 49.4 | Very low | 53.6 | Low | 120 Ų | 120 | 124.4 Ų | 124.4 | 64% | 0.642 | 66% | 0.659 | S | S | * | * | H | α-helix | trans | -69.5 | -27.6 | -176.7 | -155.8 | 34.1 | 0 | 0 | 0 | 113.4 | L130 S136 | L130-D134 PolarHBondContact O-N 2.95Å; D134-S136 VanDerWaalsContact C-N 3.3Å; D134-S136 PolarHBondContact O-N 3.31Å |
| 135 | L | 53.2 | Low | 52.4 | Low | 136 Ų | 136 | 130.3 Ų | 130.3 | 71% | 0.712 | 68% | 0.676 | S | S | * | * | H | α-helix | trans | -71.5 | -22.5 | 174.3 | -89.3 | 90 | 0 | 0 | 0 | 113.7 | A131 F133 V137 | A131-L135 WeakPolarHBondContact O-CD1 3.49Å; F133-L135 VanDerWaalsContact C-N 3.34Å; F133-L135 PolarHBondContact O-N 3.46Å; L135-V137 VanDerWaalsContact C-N 3.32Å; L135-V137 PolarHBondContact O-N 3.39Å |
| 136 | S | 54.7 | Low | 51.1 | Low | 84 Ų | 84 | 131.1 Ų | 131.1 | 59% | 0.587 | 68% | 0.683 | S | S | * | * | H | α-helix | trans | -77.8 | -18.2 | -176.4 | 70.8 | 0 | 0 | 0 | 0 | 113.6 | F133 D134 | F133-S136 PolarHBondContact O-N 3.27Å; F133-S136 PolarHBondContact O-OG 2.87Å; D134-S136 VanDerWaalsContact C-N 3.3Å; D134-S136 PolarHBondContact O-N 3.31Å |
| 137 | V | 49.6 | Very low | 49.7 | Very low | 116 Ų | 116 | 137.8 Ų | 137.8 | 70% | 0.703 | 70% | 0.701 | S | S | * | * | H | α-helix | trans | -90.7 | -20.9 | -178.1 | 178.5 | 0 | 0 | 0 | 0 | 112.1 | L135 | L135-V137 VanDerWaalsContact C-N 3.32Å; L135-V137 PolarHBondContact O-N 3.39Å |
| 138 | Q | 44.2 | Very low | 48.4 | Very low | 174 Ų | 174 | 134.8 Ų | 134.8 | 81% | 0.813 | 70% | 0.7 | S | S | * | * | S | Bend | trans | -94.4 | 4.6 | -173.6 | -139.2 | 167.5 | 24.5 | 0 | 0 | 114.9 | L140 | Q138-L140 VanDerWaalsContact C-N 3.34Å; Q138-L140 PolarHBondContact O-N 2.89Å |
| 139 | A | 43.5 | Very low | 47.1 | Very low | 91 Ų | 91 | 138.9 Ų | 138.9 | 75% | 0.752 | 72% | 0.716 | S | S | * | * | trans | -88.3 | 11.7 | -177.7 | 0 | 0 | 0 | 0 | 0 | 115 | ||||
| 140 | L | 44.7 | Very low | 45.8 | Very low | 165 Ų | 165 | 139.9 Ų | 139.9 | 86% | 0.864 | 73% | 0.73 | S | S | * | * | trans | -113.3 | 60.2 | 179.6 | -167.8 | 69.2 | 0 | 0 | 0 | 112.3 | Q138 | Q138-L140 VanDerWaalsContact C-N 3.34Å; Q138-L140 PolarHBondContact O-N 2.89Å | ||
| 141 | E | 34.8 | Very low | 44.8 | Very low | 177 Ų | 177 | 142 Ų | 142 | 83% | 0.827 | 74% | 0.742 | S | S | * | * | trans | -155.9 | 89.5 | 158.5 | -141.7 | -166.4 | -178.3 | 0 | 0 | 113.4 | ||||
| 142 | Q | 33.8 | Very low | 44.3 | Very low | 170 Ų | 170 | 145.6 Ų | 145.6 | 79% | 0.794 | 75% | 0.753 | S | S | * | * | trans | 56.1 | 168.2 | 146.6 | -62.3 | -73.1 | -17.7 | 0 | 0 | 120.8 | ||||
| 143 | P | 42 | Very low | 43.6 | Very low | 99 Ų | 99 | 149 Ų | 149 | 64% | 0.643 | 76% | 0.762 | S | S | * | * | cis | -129.2 | 159.3 | -27.9 | 30.6 | -11.1 | 0 | 0 | 0 | 113.9 | ||||
| 144 | F | 40.9 | Very low | 42.7 | Very low | 179 Ų | 179 | 151.4 Ų | 151.4 | 79% | 0.785 | 77% | 0.772 | S | S | * | * | trans | 27.1 | 101.6 | 145.7 | -111.9 | -95.9 | 0 | 0 | 0 | 119.8 | ||||
| 145 | R | 38.7 | Very low | 42.3 | Very low | 245 Ų | 245 | 150.5 Ų | 150.5 | 93% | 0.925 | 77% | 0.773 | S | S | * | * | trans | -141.6 | 109.9 | 147.7 | -83.6 | -70.6 | -163.8 | -131.3 | -2.9 | 109.4 | R147 | R145-R147 PolarHBondContact O-N 3.22Š| ||
| 146 | D | 41 | Very low | 42.1 | Very low | 144 Ų | 144 | 148.5 Ų | 148.5 | 77% | 0.77 | 78% | 0.776 | S | S | * | * | trans | -54.6 | 126.9 | 165.7 | -73 | -53.8 | 0 | 0 | 0 | 111.5 | ||||
| 147 | R | 41 | Very low | 41.7 | Very low | 246 Ų | 246 | 150.9 Ų | 150.9 | 93% | 0.928 | 78% | 0.781 | S | S | * | * | trans | -156.9 | 125.4 | 140.6 | -156 | 163.6 | 172.8 | 151.5 | -3.9 | 111.2 | R145 | R145-R147 PolarHBondContact O-N 3.22Š| ||
| 148 | S | 39.9 | Very low | 41.8 | Very low | 94 Ų | 94 | 150.9 Ų | 150.9 | 66% | 0.657 | 78% | 0.784 | S | S | * | * | trans | -63.5 | 165.6 | -172.9 | -33.9 | 0 | 0 | 0 | 0 | 115.9 | ||||
| 149 | N | 36.2 | Very low | 42.3 | Very low | 155 Ų | 155 | 148.2 Ų | 148.2 | 83% | 0.829 | 78% | 0.779 | S | S | * | * | trans | 81.2 | 119.1 | 164.3 | -48.2 | -46.6 | 0 | 0 | 0 | 114.2 | ||||
| 150 | T | 36.6 | Very low | 42.9 | Very low | 134 Ų | 134 | 150.8 Ų | 150.8 | 82% | 0.822 | 78% | 0.779 | S | S | * | * | cis | -150.6 | 140.8 | 37.5 | 45.8 | 0 | 0 | 0 | 0 | 112 | ||||
| 151 | L | 43.1 | Very low | 43.6 | Very low | 161 Ų | 161 | 152.1 Ų | 152.1 | 84% | 0.843 | 77% | 0.772 | S | S | * | * | trans | -62.8 | 139.4 | 167.8 | -169.3 | 169.6 | 0 | 0 | 0 | 110.5 | ||||
| 152 | N | 49.5 | Very low | 44.3 | Very low | 133 Ų | 133 | 148.2 Ų | 148.2 | 71% | 0.711 | 76% | 0.757 | S | S | * | * | trans | 71.7 | 99.2 | 175.5 | 138.2 | 60.1 | 0 | 0 | 0 | 112.1 | ||||
| 153 | E | 41.2 | Very low | 45.6 | Very low | 170 Ų | 170 | 148.8 Ų | 148.8 | 79% | 0.794 | 76% | 0.757 | S | S | * | * | -151.4 | 115.8 | 89.4 | -169.5 | 179.2 | -175.4 | 0 | 0 | 108.4 | P155 | E153-P155 WeakPolarHBondContact O-CD 3.41Š| |||
| 154 | K | 39.6 | Very low | 46.2 | Very low | 187 Ų | 187 | 151.9 Ų | 151.9 | 81% | 0.813 | 76% | 0.757 | S | S | * | * | trans | -64.7 | 115.2 | 164.2 | 178.6 | 160.4 | 177.6 | 167.5 | 0 | 104.9 | A156 | K154-A156 PolarHBondContact O-N 3.44Š| ||
| 155 | P | 40.2 | Very low | 46.8 | Very low | 100 Ų | 100 | 149.6 Ų | 149.6 | 65% | 0.649 | 75% | 0.746 | S | S | * | * | trans | -56.5 | 115.4 | 171.1 | 21.9 | -29 | 0 | 0 | 0 | 105.1 | E153 L157 | E153-P155 WeakPolarHBondContact O-CD 3.41Å; P155-L157 PolarHBondContact O-N 3.35Å | ||
| 156 | A | 48.3 | Very low | 47.7 | Very low | 94 Ų | 94 | 144.3 Ų | 144.3 | 78% | 0.777 | 74% | 0.736 | S | S | * | * | trans | -60 | 93.9 | 173.1 | 0 | 0 | 0 | 0 | 0 | 105 | K154 P158 | K154-A156 PolarHBondContact O-N 3.44Å; A156-P158 VanDerWaalsContact O-N 3.14Å | ||
| 157 | L | 48.2 | Very low | 48.4 | Very low | 135 Ų | 135 | 142.6 Ų | 142.6 | 71% | 0.707 | 73% | 0.727 | S | S | * | * | trans | -42.3 | 126.1 | 159.5 | -66.5 | 176.1 | 0 | 0 | 0 | 104.4 | P155 V159 | P155-L157 PolarHBondContact O-N 3.35Å; L157-V159 VanDerWaalsContact C-N 3.25Å; L157-V159 PolarHBondContact O-N 2.98Å | ||
| 158 | P | 50.1 | Low | 49.1 | Very low | 116 Ų | 116 | 135.4 Ų | 135.4 | 75% | 0.753 | 71% | 0.71 | S | S | * | * | trans | -52.2 | 108.3 | 170 | 20.4 | -29 | 0 | 0 | 0 | 104.5 | A156 I160 | A156-P158 VanDerWaalsContact O-N 3.14Å; P158-I160 VanDerWaalsContact C-N 3.29Å; P158-I160 PolarHBondContact O-N 3.33Å | ||
| 159 | V | 54.7 | Low | 49.8 | Very low | 117 Ų | 117 | 132.5 Ų | 132.5 | 71% | 0.709 | 70% | 0.695 | S | S | * | * | trans | -54.4 | 111.2 | 174.3 | 174.4 | 0 | 0 | 0 | 0 | 101.4 | L157 R161 | L157-V159 VanDerWaalsContact C-N 3.25Å; L157-V159 PolarHBondContact O-N 2.98Å; V159-R161 HydrophobicContact CG1-CB 4.08Å; V159-R161 PolarHBondContact O-N 3.19Å | ||
| 160 | I | 57.5 | Low | 50.7 | Low | 146 Ų | 146 | 131 Ų | 131 | 75% | 0.749 | 68% | 0.683 | S | S | * | * | trans | -62.2 | 76.6 | 164.4 | -60.3 | 168.9 | 0 | 0 | 0 | 102.6 | P158 D162 | P158-I160 VanDerWaalsContact C-N 3.29Å; P158-I160 PolarHBondContact O-N 3.33Å; I160-D162 PolarHBondContact O-N 3.37Å | ||
| 161 | R | 57.8 | Low | 51.6 | Low | 192 Ų | 192 | 128.9 Ų | 128.9 | 73% | 0.725 | 67% | 0.67 | S | S | * | * | trans | -75.1 | 90.7 | 179.1 | 177.2 | -179.8 | -70.7 | -172.7 | -2.8 | 102.4 | V159 | V159-R161 HydrophobicContact CG1-CB 4.08Å; V159-R161 PolarHBondContact O-N 3.19Å | ||
| 162 | D | 50.8 | Low | 52.5 | Low | 95 Ų | 95 | 126.9 Ų | 126.9 | 51% | 0.508 | 66% | 0.656 | S | S | . | * | trans | 41.3 | 90.5 | 158.4 | -67 | -42.9 | 0 | 0 | 0 | 113.8 | I160 Y164 K165 | I160-D162 PolarHBondContact O-N 3.37Å; D162-Y164 PolarHBondContact O-N 3.14Å; D162-K165 HydrophobicContact CB-CB 4.08Å; D162-K165 PolarHBondContact O-N 3.3Å | ||
| 163 | K | 61.3 | Low | 53.2 | Low | 182 Ų | 182 | 124.9 Ų | 124.9 | 79% | 0.791 | 64% | 0.643 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -56.7 | -2.3 | 148.8 | -61.6 | -74.5 | -175 | -176.6 | 0 | 112.4 | ||
| 164 | Y | 52.9 | Low | 54.7 | Low | 165 Ų | 165 | 121.6 Ų | 121.6 | 65% | 0.647 | 63% | 0.63 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -110.4 | 3.4 | -178.6 | -62.3 | -69.2 | 0 | 0 | 0 | 113.8 | D162 D166 L167 | D162-Y164 PolarHBondContact O-N 3.14Å; Y164-D166 PolarHBondContact O-N 3.35Å; Y164-L167 HydrophobicContact CD1-CD1 3.56Å; Y164-L167 HydrophobicContact CD1-CG 4.49Å; Y164-L167 HydrophobicContact CE1-CD1 4.43Å; Y164-L167 HydrophobicContact CG-CD1 4.33Å; Y164-L167 WeakPolarHBondContact O-CB 3.3Å; Y164-L167 PolarHBondContact O-N 3.44Å; Y164-L167 VanDerWaalsContact O-N 3.15Å |
| 165 | K | 54.9 | Low | 56.6 | Low | 130 Ų | 130 | 119 Ų | 119 | 57% | 0.565 | 62% | 0.621 | S | S | * | * | G | 310 helix | trans | -64.8 | -20.8 | 178.3 | -157.4 | 176 | 73.2 | -179.4 | 0 | 112.5 | D162 L167 T168 | D162-K165 HydrophobicContact CB-CB 4.08Å; D162-K165 PolarHBondContact O-N 3.3Å; K165-L167 VanDerWaalsContact C-N 3.35Å; K165-T168 PolarHBondContact O-OG1 2.88Å |
| 166 | D | 57.7 | Low | 58.6 | Low | 134 Ų | 134 | 121.8 Ų | 121.8 | 72% | 0.717 | 62% | 0.619 | S | S | * | * | G | 310 helix | trans | -83.8 | -11.3 | -179.5 | -54.5 | -29.5 | 0 | 0 | 0 | 112.4 | Y164 T168 G169 | Y164-D166 PolarHBondContact O-N 3.35Å; D166-T168 PolarHBondContact O-N 3.43Å; D166-G169 PolarHBondContact O-N 3.3Å |
| 167 | L | 55.5 | Low | 60.4 | Low | 109 Ų | 109 | 122.6 Ų | 122.6 | 57% | 0.571 | 60% | 0.603 | S | S | * | * | G | 310 helix | trans | -72.9 | -13.5 | 170.9 | -68.8 | 174.2 | 0 | 0 | 0 | 113 | Y164 K165 G169 | Y164-L167 HydrophobicContact CD1-CD1 3.56Å; Y164-L167 HydrophobicContact CD1-CG 4.49Å; Y164-L167 HydrophobicContact CE1-CD1 4.43Å; Y164-L167 HydrophobicContact CG-CD1 4.33Å; Y164-L167 WeakPolarHBondContact O-CB 3.3Å; Y164-L167 PolarHBondContact O-N 3.44Å; Y164-L167 VanDerWaalsContact O-N 3.15Å; K165-L167 VanDerWaalsContact C-N 3.35Å; L167-G169 PolarHBondContact O-N 2.97Å |
| 168 | T | 54.9 | Low | 62.2 | Low | 95 Ų | 95 | 118.9 Ų | 118.9 | 58% | 0.583 | 59% | 0.592 | S | S | * | * | H | α-helix | trans | -73.2 | -14.7 | 170.6 | -6.3 | 0 | 0 | 0 | 0 | 112.5 | K165 D166 | K165-T168 PolarHBondContact O-OG1 2.88Å; D166-T168 PolarHBondContact O-N 3.43Å |
| 169 | G | 55.8 | Low | 64 | Low | 33 Ų | 33 | 121.1 Ų | 121.1 | 34% | 0.34 | 59% | 0.586 | S | S | . | * | H | α-helix | trans | -72.5 | -29.2 | 176.8 | 0 | 0 | 0 | 0 | 0 | 113.8 | D166 L167 V171 E172 E173 | D166-G169 PolarHBondContact O-N 3.3Å; L167-G169 PolarHBondContact O-N 2.97Å; G169-V171 PolarHBondContact O-N 2.7Å; G169-E172 PolarHBondContact O-N 2.95Å; G169-E173 WeakPolarHBondContact O-CB 3.37Å; G169-E173 PolarHBondContact O-N 3.33Å |
| 170 | E | 53.5 | Low | 65.8 | Low | 122 Ų | 122 | 120.3 Ų | 120.3 | 57% | 0.57 | 57% | 0.574 | S | S | * | * | H | α-helix | trans | -63.5 | -40 | 178.5 | -66.1 | -91.2 | 159.7 | 0 | 0 | 111.6 | N174 | E170-N174 VanDerWaalsContact O-CB 3.29Å; E170-N174 WeakPolarHBondContact O-CB 3.34Å; E170-N174 PolarHBondContact O-N 2.73Å; E170-N174 PolarHBondContact O-OD1 3.41Å |
| 171 | V | 55.5 | Low | 67.4 | Low | 90 Ų | 90 | 121.6 Ų | 121.6 | 55% | 0.545 | 57% | 0.57 | S | S | . | * | H | α-helix | trans | -67.7 | -41.4 | 177 | 179.6 | 0 | 0 | 0 | 0 | 110.7 | G169 N174 E175 | G169-V171 PolarHBondContact O-N 2.7Å; V171-N174 PolarHBondContact O-N 3.16Å; V171-E175 WeakPolarHBondContact O-CG 3.11Å; V171-E175 PolarHBondContact O-N 3.26Å |
| 172 | E | 62.3 | Low | 69 | Low | 120 Ų | 120 | 119.6 Ų | 119.6 | 56% | 0.561 | 57% | 0.569 | S | S | * | * | H | α-helix | trans | -72.3 | -29.7 | -179.3 | -167.1 | 165.8 | -153.7 | 0 | 0 | 112.6 | G169 R176 | G169-E172 PolarHBondContact O-N 2.95Å; E172-R176 WeakPolarHBondContact O-CB 3.46Å; E172-R176 WeakPolarHBondContact O-CG 3.37Å; E172-R176 PolarHBondContact O-N 3.18Å |
| 173 | E | 64.7 | Low | 71 | Confident | 91 Ų | 91 | 121.6 Ų | 121.6 | 43% | 0.425 | 57% | 0.569 | S | S | . | * | H | α-helix | trans | -76.2 | -40.4 | 173.8 | -155.2 | 174.4 | -165.1 | 0 | 0 | 111.5 | G169 E175 R176 Y177 | G169-E173 WeakPolarHBondContact O-CB 3.37Å; G169-E173 PolarHBondContact O-N 3.33Å; E173-E175 PolarHBondContact O-N 3Å; E173-R176 WeakPolarHBondContact O-CB 3.41Å; E173-R176 PolarHBondContact O-N 3.35Å; E173-R176 VanDerWaalsContact O-N 3.17Å; E173-Y177 HydrophobicContact CB-CE2 4.41Å; E173-Y177 HydrophobicContact CG-CD2 4.15Å; E173-Y177 HydrophobicContact CG-CE2 3.53Å; E173-Y177 WeakPolarHBondContact O-CD2 3.44Å; E173-Y177 PolarHBondContact O-N 3.07Å; E173-Y177 PolarHBondContact OE1-OH 3Å |
| 174 | N | 72.9 | Confident | 72.6 | Confident | 100 Ų | 100 | 116.5 Ų | 116.5 | 54% | 0.535 | 56% | 0.556 | S | S | . | * | H | α-helix | trans | -61.9 | -41.4 | 173.8 | -77.5 | 38.1 | 0 | 0 | 0 | 112.5 | E170 V171 R176 Y177 A178 | E170-N174 VanDerWaalsContact O-CB 3.29Å; E170-N174 WeakPolarHBondContact O-CB 3.34Å; E170-N174 PolarHBondContact O-N 2.73Å; E170-N174 PolarHBondContact O-OD1 3.41Å; V171-N174 PolarHBondContact O-N 3.16Å; N174-R176 VanDerWaalsContact C-N 3.33Å; N174-Y177 PolarHBondContact O-N 3.31Å; N174-A178 WeakPolarHBondContact O-CB 3.37Å; N174-A178 PolarHBondContact O-N 3.3Å |
| 175 | E | 80.3 | Confident | 74.6 | Confident | 133 Ų | 133 | 110.9 Ų | 110.9 | 62% | 0.621 | 54% | 0.537 | S | S | * | . | H | α-helix | trans | -65.4 | -36.8 | 174.2 | -74.6 | -179.4 | -179.9 | 0 | 0 | 112 | V171 E173 A178 Y179 | V171-E175 WeakPolarHBondContact O-CG 3.11Å; V171-E175 PolarHBondContact O-N 3.26Å; E173-E175 PolarHBondContact O-N 3Å; E175-A178 PolarHBondContact O-N 2.94Å; E175-Y179 WeakPolarHBondContact O-CB 3.46Å; E175-Y179 PolarHBondContact O-N 2.88Å |
| 176 | R | 81.4 | Confident | 76.4 | Confident | 158 Ų | 158 | 106.6 Ų | 106.6 | 60% | 0.596 | 53% | 0.529 | S | S | * | . | H | α-helix | trans | -65.6 | -45.5 | 173.6 | -83.2 | -161.2 | -96.4 | -160.3 | -5.9 | 112.6 | E172 E173 N174 A178 Y179 E180 | E172-R176 WeakPolarHBondContact O-CB 3.46Å; E172-R176 WeakPolarHBondContact O-CG 3.37Å; E172-R176 PolarHBondContact O-N 3.18Å; E173-R176 WeakPolarHBondContact O-CB 3.41Å; E173-R176 PolarHBondContact O-N 3.35Å; E173-R176 VanDerWaalsContact O-N 3.17Å; N174-R176 VanDerWaalsContact C-N 3.33Å; R176-A178 PolarHBondContact O-N 2.93Å; R176-Y179 PolarHBondContact O-N 2.92Å; R176-E180 WeakPolarHBondContact O-CG 3.33Å; R176-E180 PolarHBondContact O-N 3.26Å |
| 177 | Y | 85.6 | Confident | 78.3 | Confident | 112 Ų | 112 | 103.3 Ų | 103.3 | 44% | 0.439 | 52% | 0.517 | S | S | . | . | H | α-helix | trans | -59.3 | -48.3 | 174.2 | -70.3 | -51.9 | 0 | 0 | 0 | 110.6 | E173 N174 Y179 E180 W181 | E173-Y177 HydrophobicContact CB-CE2 4.41Å; E173-Y177 HydrophobicContact CG-CD2 4.15Å; E173-Y177 HydrophobicContact CG-CE2 3.53Å; E173-Y177 WeakPolarHBondContact O-CD2 3.44Å; E173-Y177 PolarHBondContact O-N 3.07Å; E173-Y177 PolarHBondContact OE1-OH 3Å; N174-Y177 PolarHBondContact O-N 3.31Å; Y177-Y179 VanDerWaalsContact C-N 3.29Å; Y177-Y179 PolarHBondContact O-N 3.36Å; Y177-E180 PolarHBondContact O-N 3.43Å; Y177-W181 VanDerWaalsContact O-CB 3.28Å; Y177-W181 WeakPolarHBondContact O-CB 3.36Å; Y177-W181 PolarHBondContact O-N 2.68Å |
| 178 | A | 85.7 | Confident | 80.3 | Confident | 57 Ų | 57 | 98.9 Ų | 98.9 | 47% | 0.471 | 50% | 0.496 | S | S | . | . | H | α-helix | trans | -56 | -44 | 178.6 | 0 | 0 | 0 | 0 | 0 | 112.2 | N174 E175 R176 Q182 | N174-A178 WeakPolarHBondContact O-CB 3.37Å; N174-A178 PolarHBondContact O-N 3.3Å; E175-A178 PolarHBondContact O-N 2.94Å; R176-A178 PolarHBondContact O-N 2.93Å; A178-Q182 VanDerWaalsContact O-CB 3.31Å; A178-Q182 WeakPolarHBondContact O-CB 3.36Å; A178-Q182 PolarHBondContact O-N 3.07Å |
| 179 | Y | 88.8 | Confident | 82.2 | Confident | 162 Ų | 162 | 98 Ų | 98 | 64% | 0.635 | 49% | 0.488 | S | S | * | . | H | α-helix | trans | -63.2 | -47.5 | 175.9 | 175.2 | -99.2 | 0 | 0 | 0 | 112.7 | E175 R176 Y177 Q182 R183 | E175-Y179 WeakPolarHBondContact O-CB 3.46Å; E175-Y179 PolarHBondContact O-N 2.88Å; R176-Y179 PolarHBondContact O-N 2.92Å; Y177-Y179 VanDerWaalsContact C-N 3.29Å; Y177-Y179 PolarHBondContact O-N 3.36Å; Y179-Q182 PolarHBondContact O-N 3.34Å; Y179-R183 WeakPolarHBondContact O-CB 3.44Å; Y179-R183 PolarHBondContact O-N 2.95Å |
| 180 | E | 92.1 | Very high | 84.1 | Confident | 100 Ų | 100 | 101.3 Ų | 101.3 | 47% | 0.467 | 50% | 0.498 | S | S | . | . | H | α-helix | trans | -66.2 | -38.9 | 179.7 | -71.4 | -167.8 | 163.4 | 0 | 0 | 112.6 | R176 Y177 R183 C184 | R176-E180 WeakPolarHBondContact O-CG 3.33Å; R176-E180 PolarHBondContact O-N 3.26Å; Y177-E180 PolarHBondContact O-N 3.43Å; E180-R183 PolarHBondContact O-N 3.15Å; E180-C184 VanDerWaalsContact O-CB 3.31Å; E180-C184 WeakPolarHBondContact O-CB 3.45Å; E180-C184 PolarHBondContact O-N 2.77Å |
| 181 | W | 90.8 | Very high | 86.2 | Confident | 173 Ų | 173 | 98.7 Ų | 98.7 | 66% | 0.655 | 49% | 0.49 | S | S | * | . | H | α-helix | trans | -59.8 | -49.7 | 172.3 | -83.8 | 113.1 | 0 | 0 | 0 | 111.2 | Y177 R183 C184 L185 | Y177-W181 VanDerWaalsContact O-CB 3.28Å; Y177-W181 WeakPolarHBondContact O-CB 3.36Å; Y177-W181 PolarHBondContact O-N 2.68Å; W181-R183 VanDerWaalsContact C-N 3.32Å; W181-R183 PolarHBondContact O-N 3.03Å; W181-C184 WeakPolarHBondContact O-CB 3.48Å; W181-C184 PolarHBondContact O-N 2.73Å; W181-L185 WeakPolarHBondContact O-CB 3.35Å; W181-L185 PolarHBondContact O-N 3.45Å |
| 182 | Q | 91.4 | Very high | 88.2 | Confident | 151 Ų | 151 | 96 Ų | 96 | 71% | 0.706 | 47% | 0.472 | S | S | * | . | H | α-helix | trans | -63.8 | -38.2 | 179.2 | -169.5 | 166.8 | -44 | 0 | 0 | 112 | A178 Y179 L185 G186 | A178-Q182 VanDerWaalsContact O-CB 3.31Å; A178-Q182 WeakPolarHBondContact O-CB 3.36Å; A178-Q182 PolarHBondContact O-N 3.07Å; Y179-Q182 PolarHBondContact O-N 3.34Å; Q182-L185 PolarHBondContact O-N 3.45Å; Q182-G186 PolarHBondContact O-N 3.05Å |
| 183 | R | 93.8 | Very high | 89.9 | Confident | 136 Ų | 136 | 96.5 Ų | 96.5 | 51% | 0.513 | 47% | 0.472 | S | S | . | . | H | α-helix | trans | -65 | -41 | 173.6 | -177.1 | -179.7 | 64.2 | 87.2 | -0.6 | 112.2 | Y179 E180 W181 G186 S187 | Y179-R183 WeakPolarHBondContact O-CB 3.44Å; Y179-R183 PolarHBondContact O-N 2.95Å; E180-R183 PolarHBondContact O-N 3.15Å; W181-R183 VanDerWaalsContact C-N 3.32Å; W181-R183 PolarHBondContact O-N 3.03Å; R183-G186 PolarHBondContact O-N 3.16Å; R183-S187 PolarHBondContact O-N 2.93Å; R183-S187 PolarHBondContact O-OG 3.46Å |
| 184 | C | 94.8 | Very high | 91.5 | Very high | 75 Ų | 75 | 98.8 Ų | 98.8 | 51% | 0.507 | 48% | 0.481 | S | S | . | . | H | α-helix | trans | -63.5 | -47 | 176.2 | -173.6 | 0 | 0 | 0 | 0 | 110.7 | E180 W181 G186 S187 A188 | E180-C184 VanDerWaalsContact O-CB 3.31Å; E180-C184 WeakPolarHBondContact O-CB 3.45Å; E180-C184 PolarHBondContact O-N 2.77Å; W181-C184 WeakPolarHBondContact O-CB 3.48Å; W181-C184 PolarHBondContact O-N 2.73Å; C184-G186 PolarHBondContact O-N 3.39Å; C184-S187 WeakPolarHBondContact O-CB 3.47Å; C184-S187 PolarHBondContact O-N 2.89Å; C184-S187 VanDerWaalsContact O-N 3.12Å; C184-A188 PolarHBondContact O-N 3.38Å |
| 185 | L | 93.8 | Very high | 92.6 | Very high | 47 Ų | 47 | 94.2 Ų | 94.2 | 25% | 0.246 | 46% | 0.457 | C | S | . | . | H | α-helix | trans | -59.6 | -45.4 | 176 | -168.9 | 71.5 | 0 | 0 | 0 | 111.5 | W181 Q182 S187 A188 L189 T231 | W181-L185 WeakPolarHBondContact O-CB 3.35Å; W181-L185 PolarHBondContact O-N 3.45Å; Q182-L185 PolarHBondContact O-N 3.45Å; L185-S187 VanDerWaalsContact C-N 3.3Å; L185-S187 PolarHBondContact O-N 3.12Å; L185-A188 WeakPolarHBondContact O-CB 3.47Å; L185-A188 PolarHBondContact O-N 2.87Å; L185-L189 WeakPolarHBondContact O-CG 3.33Å; L185-L189 PolarHBondContact O-N 3.09Å; L185-T231 HydrophobicContact CD1-CG2 3.45Å; L185-T231 VanDerWaalsContact CD1-CG2 3.45Å; L185-T231 HydrophobicContact CG-CG2 4.39Å |
| 186 | G | 94.3 | Very high | 93.4 | Very high | 40 Ų | 40 | 92 Ų | 92 | 41% | 0.412 | 45% | 0.449 | S | S | . | . | H | α-helix | trans | -59.2 | -39.8 | 174.5 | 0 | 0 | 0 | 0 | 0 | 113 | Q182 R183 C184 N190 | Q182-G186 PolarHBondContact O-N 3.05Å; R183-G186 PolarHBondContact O-N 3.16Å; C184-G186 PolarHBondContact O-N 3.39Å; G186-N190 WeakPolarHBondContact O-CB 3.38Å; G186-N190 PolarHBondContact O-N 3.28Å; G186-N190 VanDerWaalsContact O-N 3.09Å |
| 187 | S | 96.6 | Very high | 94.2 | Very high | 65 Ų | 65 | 88.8 Ų | 88.8 | 46% | 0.455 | 44% | 0.444 | S | S | . | . | H | α-helix | trans | -67.4 | -41.7 | 174.6 | -68.4 | 0 | 0 | 0 | 0 | 112.4 | R183 C184 L185 N190 V191 | R183-S187 PolarHBondContact O-N 2.93Å; R183-S187 PolarHBondContact O-OG 3.46Å; C184-S187 WeakPolarHBondContact O-CB 3.47Å; C184-S187 PolarHBondContact O-N 2.89Å; C184-S187 VanDerWaalsContact O-N 3.12Å; L185-S187 VanDerWaalsContact C-N 3.3Å; L185-S187 PolarHBondContact O-N 3.12Å; S187-N190 WeakPolarHBondContact O-CB 3.28Å; S187-N190 PolarHBondContact O-N 3.37Å; S187-V191 WeakPolarHBondContact O-CG2 3.46Å; S187-V191 PolarHBondContact O-N 2.95Å |
| 188 | A | 96.7 | Very high | 94.7 | Very high | 17 Ų | 17 | 87.3 Ų | 87.3 | 14% | 0.14 | 45% | 0.446 | C | S | . | . | H | α-helix | trans | -60.5 | -46.7 | 177.3 | 0 | 0 | 0 | 0 | 0 | 111.5 | C184 L185 N190 V191 I192 V227 | C184-A188 PolarHBondContact O-N 3.38Å; L185-A188 WeakPolarHBondContact O-CB 3.47Å; L185-A188 PolarHBondContact O-N 2.87Å; A188-N190 VanDerWaalsContact C-N 3.28Å; A188-N190 PolarHBondContact O-N 3.19Å; A188-V191 WeakPolarHBondContact O-CB 3.43Å; A188-V191 PolarHBondContact O-N 3.39Å; A188-V191 VanDerWaalsContact O-N 3.16Å; A188-I192 WeakPolarHBondContact O-CD1 3.49Å; A188-I192 WeakPolarHBondContact O-CG1 3.45Å; A188-I192 PolarHBondContact O-N 2.89Å; A188-V227 HydrophobicContact CB-CG1 3.69Å |
| 189 | L | 95 | Very high | 95.1 | Very high | 76 Ų | 76 | 86.7 Ų | 86.7 | 40% | 0.398 | 44% | 0.435 | S | S | . | . | H | α-helix | trans | -59 | -40.4 | 174.4 | -70.7 | 173.6 | 0 | 0 | 0 | 112 | L185 I192 K193 T231 | L185-L189 WeakPolarHBondContact O-CG 3.33Å; L185-L189 PolarHBondContact O-N 3.09Å; L189-I192 PolarHBondContact O-N 3.4Å; L189-K193 WeakPolarHBondContact O-CB 3.45Å; L189-K193 PolarHBondContact O-N 3.03Å; L189-T231 HydrophobicContact CD2-CG2 3.69Å; L189-T231 HydrophobicContact CG-CG2 4.09Å |
| 190 | N | 97 | Very high | 95.4 | Very high | 103 Ų | 103 | 84.7 Ų | 84.7 | 55% | 0.551 | 44% | 0.435 | S | S | * | . | H | α-helix | trans | -65.5 | -39.1 | 176.6 | -170.3 | 46.8 | 0 | 0 | 0 | 112.5 | G186 S187 A188 K193 K194 | G186-N190 WeakPolarHBondContact O-CB 3.38Å; G186-N190 PolarHBondContact O-N 3.28Å; G186-N190 VanDerWaalsContact O-N 3.09Å; S187-N190 WeakPolarHBondContact O-CB 3.28Å; S187-N190 PolarHBondContact O-N 3.37Å; A188-N190 VanDerWaalsContact C-N 3.28Å; A188-N190 PolarHBondContact O-N 3.19Å; N190-K193 PolarHBondContact O-N 3.38Å; N190-K194 VanDerWaalsContact O-CB 3.24Å; N190-K194 WeakPolarHBondContact O-CB 3.4Å; N190-K194 PolarHBondContact O-N 3.41Å |
| 191 | V | 97.5 | Very high | 95.6 | Very high | 67 Ų | 67 | 82.4 Ų | 82.4 | 41% | 0.406 | 44% | 0.439 | S | S | . | . | H | α-helix | trans | -60.7 | -47.4 | 174.5 | 169.5 | 0 | 0 | 0 | 0 | 110.7 | S187 A188 K194 A195 | S187-V191 WeakPolarHBondContact O-CG2 3.46Å; S187-V191 PolarHBondContact O-N 2.95Å; A188-V191 WeakPolarHBondContact O-CB 3.43Å; A188-V191 PolarHBondContact O-N 3.39Å; A188-V191 VanDerWaalsContact O-N 3.16Å; V191-K194 PolarHBondContact O-N 3.44Å; V191-A195 WeakPolarHBondContact O-CB 3.24Å; V191-A195 PolarHBondContact O-N 3.18Å |
| 192 | I | 96.8 | Very high | 95.8 | Very high | 33 Ų | 33 | 76.4 Ų | 76.4 | 17% | 0.169 | 42% | 0.419 | C | S | . | . | H | α-helix | trans | -61.8 | -47 | 179.4 | -63.2 | 157.4 | 0 | 0 | 0 | 110.5 | A188 L189 A195 N196 V224 V227 Y228 | A188-I192 WeakPolarHBondContact O-CD1 3.49Å; A188-I192 WeakPolarHBondContact O-CG1 3.45Å; A188-I192 PolarHBondContact O-N 2.89Å; L189-I192 PolarHBondContact O-N 3.4Å; I192-A195 PolarHBondContact O-N 2.93Å; I192-N196 PolarHBondContact O-N 2.98Å; I192-V224 HydrophobicContact CG1-CG1 4.42Å; I192-V227 HydrophobicContact CD1-CG1 4.11Å; I192-V227 HydrophobicContact CG1-CG1 4.13Å; I192-Y228 HydrophobicContact CD1-CD2 4.2Å; I192-Y228 HydrophobicContact CG2-CD2 4.47Å |
| 193 | K | 97.4 | Very high | 96.1 | Very high | 130 Ų | 130 | 75.3 Ų | 75.3 | 57% | 0.565 | 43% | 0.428 | S | S | * | . | H | α-helix | trans | -60.5 | -48.6 | 178.2 | -175.3 | 179 | 178.1 | -177.3 | 0 | 111.4 | L189 N190 A195 N196 D197 | L189-K193 WeakPolarHBondContact O-CB 3.45Å; L189-K193 PolarHBondContact O-N 3.03Å; N190-K193 PolarHBondContact O-N 3.38Å; K193-A195 VanDerWaalsContact C-N 3.31Å; K193-A195 PolarHBondContact O-N 3.2Å; K193-N196 WeakPolarHBondContact O-CB 3.45Å; K193-N196 PolarHBondContact O-N 3.35Å; K193-N196 VanDerWaalsContact O-N 3.16Å; K193-D197 PolarHBondContact O-N 3.41Å |
| 194 | K | 98 | Very high | 96.2 | Very high | 140 Ų | 140 | 71.2 Ų | 71.2 | 61% | 0.609 | 42% | 0.421 | S | S | * | . | H | α-helix | trans | -61 | -39.9 | 179.3 | -175 | 175.5 | -179.8 | -179.9 | 0 | 112.1 | N190 V191 T198 | N190-K194 VanDerWaalsContact O-CB 3.24Å; N190-K194 WeakPolarHBondContact O-CB 3.4Å; N190-K194 PolarHBondContact O-N 3.41Å; V191-K194 PolarHBondContact O-N 3.44Å; K194-T198 WeakPolarHBondContact O-CB 3.39Å; K194-T198 PolarHBondContact O-N 2.84Å; K194-T198 PolarHBondContact O-OG1 3.39Å |
| 195 | A | 97.3 | Very high | 96.3 | Very high | 3 Ų | 3 | 72.1 Ų | 72.1 | 3% | 0.025 | 43% | 0.428 | C | S | . | . | H | α-helix | trans | -60.9 | -46.2 | 175.2 | 0 | 0 | 0 | 0 | 0 | 111.4 | V191 I192 K193 T198 L199 Y220 V224 | V191-A195 WeakPolarHBondContact O-CB 3.24Å; V191-A195 PolarHBondContact O-N 3.18Å; I192-A195 PolarHBondContact O-N 2.93Å; K193-A195 VanDerWaalsContact C-N 3.31Å; K193-A195 PolarHBondContact O-N 3.2Å; A195-T198 PolarHBondContact O-N 3.3Å; A195-L199 WeakPolarHBondContact O-CG 3.49Å; A195-L199 PolarHBondContact O-N 2.8Å; A195-Y220 HydrophobicContact CB-CE1 4.07Å; A195-Y220 VanDerWaalsContact CB-OH 3.28Å; A195-Y220 WeakPolarHBondContact CB-OH 3.5Å; A195-V224 HydrophobicContact CB-CB 4.46Å; A195-V224 HydrophobicContact CB-CG1 3.86Å; A195-V224 HydrophobicContact CB-CG2 3.79Å |
| 196 | N | 96.3 | Very high | 96.4 | Very high | 87 Ų | 87 | 73.8 Ų | 73.8 | 47% | 0.465 | 44% | 0.443 | S | S | . | . | H | α-helix | trans | -62.8 | -47.5 | 178.4 | -167.2 | 2.7 | 0 | 0 | 0 | 111.9 | I192 K193 T198 L199 N200 | I192-N196 PolarHBondContact O-N 2.98Å; K193-N196 WeakPolarHBondContact O-CB 3.45Å; K193-N196 PolarHBondContact O-N 3.35Å; K193-N196 VanDerWaalsContact O-N 3.16Å; N196-T198 VanDerWaalsContact C-N 3.27Å; N196-T198 PolarHBondContact O-N 2.94Å; N196-L199 PolarHBondContact O-N 2.86Å; N196-N200 WeakPolarHBondContact O-CB 3.13Å; N196-N200 VanDerWaalsContact O-CG 3.32Å; N196-N200 PolarHBondContact O-N 2.91Å; N196-N200 PolarHBondContact O-ND2 3.21Å; N196-N200 PolarHBondContact OD1-ND2 3.18Å |
| 197 | D | 97.6 | Very high | 96.5 | Very high | 90 Ų | 90 | 75 Ų | 75 | 48% | 0.481 | 44% | 0.443 | S | S | . | . | H | α-helix | trans | -60.9 | -38.3 | 176.9 | -68 | -18.7 | 0 | 0 | 0 | 111.4 | K193 G201 | K193-D197 PolarHBondContact O-N 3.41Å; D197-G201 PolarHBondContact O-N 2.97Å |
| 198 | T | 96.1 | Very high | 96.5 | Very high | 81 Ų | 81 | 73.2 Ų | 73.2 | 50% | 0.497 | 43% | 0.43 | S | S | . | . | H | α-helix | trans | -65.8 | -46.9 | 177.9 | -57.5 | 0 | 0 | 0 | 0 | 111.4 | K194 A195 N196 G201 | K194-T198 WeakPolarHBondContact O-CB 3.39Å; K194-T198 PolarHBondContact O-N 2.84Å; K194-T198 PolarHBondContact O-OG1 3.39Å; A195-T198 PolarHBondContact O-N 3.3Å; N196-T198 VanDerWaalsContact C-N 3.27Å; N196-T198 PolarHBondContact O-N 2.94Å; T198-G201 PolarHBondContact O-N 2.9Å |
| 199 | L | 94.4 | Very high | 96.5 | Very high | 44 Ų | 44 | 75.2 Ų | 75.2 | 23% | 0.23 | 44% | 0.44 | C | S | . | . | H | α-helix | trans | -66.6 | -42.4 | 179.6 | -68.3 | 166.8 | 0 | 0 | 0 | 111.8 | A195 N196 G201 I202 L221 | A195-L199 WeakPolarHBondContact O-CG 3.49Å; A195-L199 PolarHBondContact O-N 2.8Å; N196-L199 PolarHBondContact O-N 2.86Å; L199-G201 PolarHBondContact O-N 3.16Å; L199-I202 HydrophobicContact CD2-CD1 4.45Å; L199-I202 PolarHBondContact O-N 3.47Å; L199-L221 HydrophobicContact CD1-CD2 3.56Å; L199-L221 HydrophobicContact CD2-CD2 4.42Å |
| 200 | N | 94.8 | Very high | 96.7 | Very high | 120 Ų | 120 | 78.3 Ų | 78.3 | 64% | 0.642 | 45% | 0.453 | S | S | * | . | H | α-helix | trans | -69.3 | -23.7 | 175.6 | -69.3 | -32.1 | 0 | 0 | 0 | 112.7 | N196 I202 | N196-N200 WeakPolarHBondContact O-CB 3.13Å; N196-N200 VanDerWaalsContact O-CG 3.32Å; N196-N200 PolarHBondContact O-N 2.91Å; N196-N200 PolarHBondContact O-ND2 3.21Å; N196-N200 PolarHBondContact OD1-ND2 3.18Å; N200-I202 PolarHBondContact O-N 3.47Å |
| 201 | G | 97.1 | Very high | 96.6 | Very high | 53 Ų | 53 | 76.1 Ų | 76.1 | 55% | 0.546 | 44% | 0.443 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -73.8 | -9.8 | 175.1 | 0 | 0 | 0 | 0 | 0 | 114.1 | D197 T198 L199 S203 | D197-G201 PolarHBondContact O-N 2.97Å; T198-G201 PolarHBondContact O-N 2.9Å; L199-G201 PolarHBondContact O-N 3.16Å; G201-S203 PolarHBondContact O-N 3.48Å; G201-S203 VanDerWaalsContact O-N 3.15Å |
| 202 | I | 96 | Very high | 96.5 | Very high | 47 Ų | 47 | 76.2 Ų | 76.2 | 24% | 0.241 | 44% | 0.44 | C | S | . | . | trans | -77.3 | 102.7 | 177.5 | -54.7 | 175.3 | 0 | 0 | 0 | 109.2 | L199 N200 S204 V207 C208 | L199-I202 HydrophobicContact CD2-CD1 4.45Å; L199-I202 PolarHBondContact O-N 3.47Å; N200-I202 PolarHBondContact O-N 3.47Å; I202-S204 VanDerWaalsContact C-N 3.28Å; I202-S204 WeakPolarHBondContact CG2-O 3.28Å; I202-S204 PolarHBondContact O-N 2.96Å; I202-V207 HydrophobicContact CG2-CB 4.17Å; I202-V207 HydrophobicContact CG2-CG1 4.14Å; I202-C208 HydrophobicContact CB-CB 4.19Å; I202-C208 HydrophobicContact CD1-CB 4.31Å; I202-C208 HydrophobicContact CG2-CB 3.84Å | ||
| 203 | S | 96.1 | Very high | 96.5 | Very high | 128 Ų | 128 | 82 Ų | 82 | 90% | 0.895 | 47% | 0.467 | S | S | * | . | trans | -68.3 | -24.7 | -179.1 | -49.6 | 0 | 0 | 0 | 0 | 114.1 | G201 | G201-S203 PolarHBondContact O-N 3.48Å; G201-S203 VanDerWaalsContact O-N 3.15Å | ||
| 204 | S | 97.4 | Very high | 96.5 | Very high | 50 Ų | 50 | 77.9 Ų | 77.9 | 35% | 0.35 | 45% | 0.454 | S | S | . | . | trans | -98.3 | 117.5 | -178.8 | -179.2 | 0 | 0 | 0 | 0 | 111.5 | I202 S206 V207 C208 | I202-S204 VanDerWaalsContact C-N 3.28Å; I202-S204 WeakPolarHBondContact CG2-O 3.28Å; I202-S204 PolarHBondContact O-N 2.96Å; S204-S206 VanDerWaalsContact C-N 3.33Å; S204-S206 PolarHBondContact O-N 2.91Å; S204-S206 PolarHBondContact OG-OG 3.05Å; S204-S206 VanDerWaalsContact OG-OG 3.13Å; S204-V207 PolarHBondContact O-N 3.26Å; S204-C208 PolarHBondContact O-N 3.27Å | ||
| 205 | S | 95.1 | Very high | 96.5 | Very high | 94 Ų | 94 | 75.1 Ų | 75.1 | 66% | 0.657 | 46% | 0.458 | S | S | * | . | H | α-helix | trans | -63.7 | -35.5 | -179.6 | 176.1 | 0 | 0 | 0 | 0 | 113.1 | C208 T209 | S205-C208 PolarHBondContact O-N 3.43Å; S205-T209 WeakPolarHBondContact O-CB 3.44Å; S205-T209 PolarHBondContact O-N 3.37Å; S205-T209 PolarHBondContact O-OG1 2.9Å |
| 206 | S | 96.9 | Very high | 96.6 | Very high | 81 Ų | 81 | 81.9 Ų | 81.9 | 57% | 0.566 | 49% | 0.488 | S | S | * | . | H | α-helix | trans | -66 | -42.5 | 177 | 55.4 | 0 | 0 | 0 | 0 | 111.6 | S204 T209 E210 | S204-S206 VanDerWaalsContact C-N 3.33Å; S204-S206 PolarHBondContact O-N 2.91Å; S204-S206 PolarHBondContact OG-OG 3.05Å; S204-S206 VanDerWaalsContact OG-OG 3.13Å; S206-T209 PolarHBondContact O-N 3.41Å; S206-E210 WeakPolarHBondContact O-CB 3.31Å; S206-E210 PolarHBondContact O-N 2.96Å |
| 207 | V | 97.3 | Very high | 96.6 | Very high | 67 Ų | 67 | 78.1 Ų | 78.1 | 41% | 0.406 | 47% | 0.471 | S | S | . | . | H | α-helix | trans | -65.1 | -42.7 | 176.6 | 177.9 | 0 | 0 | 0 | 0 | 110.6 | I202 S204 T209 E210 V211 | I202-V207 HydrophobicContact CG2-CB 4.17Å; I202-V207 HydrophobicContact CG2-CG1 4.14Å; S204-V207 PolarHBondContact O-N 3.26Å; V207-T209 VanDerWaalsContact C-N 3.31Å; V207-T209 PolarHBondContact O-N 3.18Å; V207-E210 PolarHBondContact O-N 3.47Å; V207-V211 HydrophobicContact CG1-CG2 4.42Å; V207-V211 VanDerWaalsContact O-CG2 3.3Å; V207-V211 WeakPolarHBondContact O-CG2 3.45Å; V207-V211 PolarHBondContact O-N 2.84Å |
| 208 | C | 96.4 | Very high | 96.6 | Very high | 27 Ų | 27 | 78.5 Ų | 78.5 | 18% | 0.182 | 47% | 0.471 | C | S | . | . | H | α-helix | trans | -59.5 | -44.3 | 176.2 | -172.8 | 0 | 0 | 0 | 0 | 111.3 | I202 S204 S205 V211 I212 | I202-C208 HydrophobicContact CB-CB 4.19Å; I202-C208 HydrophobicContact CD1-CB 4.31Å; I202-C208 HydrophobicContact CG2-CB 3.84Å; S204-C208 PolarHBondContact O-N 3.27Å; S205-C208 PolarHBondContact O-N 3.43Å; C208-V211 PolarHBondContact O-N 3.17Å; C208-I212 WeakPolarHBondContact O-CD1 3.43Å; C208-I212 VanDerWaalsContact O-CG1 3.23Å; C208-I212 WeakPolarHBondContact O-CG1 3.25Å; C208-I212 PolarHBondContact O-N 3.49Å; C208-I212 VanDerWaalsContact SG-CD1 3.58Å |
| 209 | T | 96.5 | Very high | 96.7 | Very high | 58 Ų | 58 | 80.9 Ų | 80.9 | 36% | 0.356 | 48% | 0.476 | S | S | . | . | H | α-helix | trans | -62.9 | -44.2 | 177.3 | -54.2 | 0 | 0 | 0 | 0 | 111.6 | S205 S206 V207 I212 Q213 | S205-T209 WeakPolarHBondContact O-CB 3.44Å; S205-T209 PolarHBondContact O-N 3.37Å; S205-T209 PolarHBondContact O-OG1 2.9Å; S206-T209 PolarHBondContact O-N 3.41Å; V207-T209 VanDerWaalsContact C-N 3.31Å; V207-T209 PolarHBondContact O-N 3.18Å; T209-I212 PolarHBondContact O-N 3.15Å; T209-Q213 HydrophobicContact CG2-CG 4.34Å; T209-Q213 VanDerWaalsContact CG2-NE2 3.31Å; T209-Q213 WeakPolarHBondContact O-CB 3.31Å; T209-Q213 VanDerWaalsContact O-CG 3.28Å; T209-Q213 WeakPolarHBondContact O-CG 3.29Å; T209-Q213 PolarHBondContact O-N 3.46Å |
| 210 | E | 97.8 | Very high | 96.8 | Very high | 142 Ų | 142 | 84 Ų | 84 | 66% | 0.664 | 49% | 0.486 | S | S | * | . | H | α-helix | trans | -61.4 | -44.8 | 177.3 | -172 | -177.9 | 151.4 | 0 | 0 | 111.7 | S206 V207 Q213 S214 | S206-E210 WeakPolarHBondContact O-CB 3.31Å; S206-E210 PolarHBondContact O-N 2.96Å; V207-E210 PolarHBondContact O-N 3.47Å; E210-Q213 PolarHBondContact O-N 2.94Å; E210-S214 WeakPolarHBondContact O-CB 3.48Å; E210-S214 PolarHBondContact O-N 2.94Å |
| 211 | V | 96.9 | Very high | 96.9 | Very high | 57 Ų | 57 | 80 Ų | 80 | 35% | 0.345 | 46% | 0.464 | S | S | . | . | H | α-helix | trans | -60.9 | -49.2 | 177 | 171.1 | 0 | 0 | 0 | 0 | 110.7 | V207 C208 Q213 S214 G217 | V207-V211 HydrophobicContact CG1-CG2 4.42Å; V207-V211 VanDerWaalsContact O-CG2 3.3Å; V207-V211 WeakPolarHBondContact O-CG2 3.45Å; V207-V211 PolarHBondContact O-N 2.84Å; C208-V211 PolarHBondContact O-N 3.17Å; V211-Q213 VanDerWaalsContact C-N 3.3Å; V211-Q213 PolarHBondContact O-N 3.43Å; V211-S214 PolarHBondContact O-N 3.31Å; V211-S214 PolarHBondContact O-OG 3.46Å; V211-G217 WeakPolarHBondContact O-CA 3.45Å |
| 212 | I | 95 | Very high | 96.9 | Very high | 69 Ų | 69 | 82.7 Ų | 82.7 | 35% | 0.354 | 47% | 0.465 | S | S | . | . | H | α-helix | trans | -66.5 | -32 | -177.8 | -64.2 | 164.8 | 0 | 0 | 0 | 111.8 | C208 T209 L221 | C208-I212 WeakPolarHBondContact O-CD1 3.43Å; C208-I212 VanDerWaalsContact O-CG1 3.23Å; C208-I212 WeakPolarHBondContact O-CG1 3.25Å; C208-I212 PolarHBondContact O-N 3.49Å; C208-I212 VanDerWaalsContact SG-CD1 3.58Å; T209-I212 PolarHBondContact O-N 3.15Å; I212-L221 HydrophobicContact CB-CD1 4.31Å; I212-L221 HydrophobicContact CG1-CD1 4.13Å; I212-L221 HydrophobicContact CG2-CD1 3.92Å |
| 213 | Q | 96.1 | Very high | 97 | Very high | 154 Ų | 154 | 82.3 Ų | 82.3 | 72% | 0.72 | 47% | 0.473 | S | S | * | . | H | α-helix | trans | -87.4 | -14.8 | 178.7 | -68.3 | 179.7 | 5.2 | 0 | 0 | 113.7 | T209 E210 V211 | T209-Q213 HydrophobicContact CG2-CG 4.34Å; T209-Q213 VanDerWaalsContact CG2-NE2 3.31Å; T209-Q213 WeakPolarHBondContact O-CB 3.31Å; T209-Q213 VanDerWaalsContact O-CG 3.28Å; T209-Q213 WeakPolarHBondContact O-CG 3.29Å; T209-Q213 PolarHBondContact O-N 3.46Å; E210-Q213 PolarHBondContact O-N 2.94Å; V211-Q213 VanDerWaalsContact C-N 3.3Å; V211-Q213 PolarHBondContact O-N 3.43Å |
| 214 | S | 98.3 | Very high | 97.1 | Very high | 44 Ų | 44 | 77.1 Ų | 77.1 | 31% | 0.308 | 44% | 0.436 | S | S | . | . | S | Bend | trans | -66.8 | 147.5 | 174.8 | 75.9 | 0 | 0 | 0 | 0 | 111.2 | E210 V211 Q216 G217 M218 | E210-S214 WeakPolarHBondContact O-CB 3.48Å; E210-S214 PolarHBondContact O-N 2.94Å; V211-S214 PolarHBondContact O-N 3.31Å; V211-S214 PolarHBondContact O-OG 3.46Å; S214-Q216 VanDerWaalsContact C-N 3.32Å; S214-Q216 PolarHBondContact O-N 3.19Å; S214-G217 PolarHBondContact O-N 3Å; S214-G217 PolarHBondContact OG-N 3.41Å; S214-M218 VanDerWaalsContact O-CB 3.32Å; S214-M218 WeakPolarHBondContact O-CB 3.34Å; S214-M218 PolarHBondContact O-N 3.02Å |
| 215 | A | 98.2 | Very high | 97.1 | Very high | 82 Ų | 82 | 79.1 Ų | 79.1 | 68% | 0.678 | 45% | 0.446 | S | S | * | . | H | α-helix | trans | -56.5 | -47 | 176.4 | 0 | 0 | 0 | 0 | 0 | 111.7 | G217 M218 E219 | A215-G217 PolarHBondContact O-N 2.85Å; A215-M218 PolarHBondContact O-N 3.47Å; A215-E219 WeakPolarHBondContact O-CG 3.47Å; A215-E219 PolarHBondContact O-N 2.92Å |
| 216 | Q | 97.9 | Very high | 97.2 | Very high | 144 Ų | 144 | 78.6 Ų | 78.6 | 67% | 0.673 | 43% | 0.433 | S | S | * | . | H | α-helix | trans | -64 | -42.7 | -179.2 | -169.3 | 67.8 | 35.1 | 0 | 0 | 112.6 | S214 Y220 | S214-Q216 VanDerWaalsContact C-N 3.32Å; S214-Q216 PolarHBondContact O-N 3.19Å; Q216-Y220 PolarHBondContact O-N 3.49Å; Q216-Y220 VanDerWaalsContact O-N 3.07Å |
| 217 | G | 97.3 | Very high | 97.1 | Very high | 9 Ų | 9 | 77 Ų | 77 | 9% | 0.093 | 42% | 0.42 | C | S | . | . | H | α-helix | trans | -68.7 | -39.9 | 178.5 | 0 | 0 | 0 | 0 | 0 | 111.9 | V211 S214 A215 Y220 L221 | V211-G217 WeakPolarHBondContact O-CA 3.45Å; S214-G217 PolarHBondContact O-N 3Å; S214-G217 PolarHBondContact OG-N 3.41Å; A215-G217 PolarHBondContact O-N 2.85Å; G217-Y220 WeakPolarHBondContact O-CB 3.49Å; G217-Y220 PolarHBondContact O-N 3.09Å; G217-L221 VanDerWaalsContact O-CG 3.26Å; G217-L221 WeakPolarHBondContact O-CG 3.35Å; G217-L221 PolarHBondContact O-N 3.25Å |
| 218 | M | 96.9 | Very high | 97.1 | Very high | 98 Ų | 98 | 79.6 Ų | 79.6 | 48% | 0.483 | 42% | 0.423 | S | S | . | . | H | α-helix | trans | -63.6 | -43.3 | 175.5 | -171.8 | 62.6 | 140.1 | 0 | 0 | 112.1 | S214 A215 Y220 L221 L222 | S214-M218 VanDerWaalsContact O-CB 3.32Å; S214-M218 WeakPolarHBondContact O-CB 3.34Å; S214-M218 PolarHBondContact O-N 3.02Å; A215-M218 PolarHBondContact O-N 3.47Å; M218-Y220 VanDerWaalsContact C-N 3.33Å; M218-Y220 PolarHBondContact O-N 3.34Å; M218-L221 PolarHBondContact O-N 3.19Å; M218-L222 HydrophobicContact CG-CD1 4.3Å; M218-L222 WeakPolarHBondContact O-CB 3.31Å; M218-L222 WeakPolarHBondContact O-CG 3.49Å; M218-L222 PolarHBondContact O-N 3.47Å |
| 219 | E | 97.8 | Very high | 97 | Very high | 130 Ų | 130 | 83.6 Ų | 83.6 | 61% | 0.607 | 43% | 0.434 | S | S | * | . | H | α-helix | trans | -60.6 | -42.4 | 174.3 | -75.8 | -169.6 | 146.4 | 0 | 0 | 112 | A215 L222 G223 | A215-E219 WeakPolarHBondContact O-CG 3.47Å; A215-E219 PolarHBondContact O-N 2.92Å; E219-L222 PolarHBondContact O-N 3.27Å; E219-G223 PolarHBondContact O-N 3.42Å |
| 220 | Y | 97.7 | Very high | 96.9 | Very high | 110 Ų | 110 | 83.7 Ų | 83.7 | 43% | 0.431 | 44% | 0.435 | S | S | . | . | H | α-helix | trans | -59.9 | -47.3 | 174.3 | 174.2 | -98.9 | 0 | 0 | 0 | 111.8 | A195 Q216 G217 M218 L222 G223 V224 | A195-Y220 HydrophobicContact CB-CE1 4.07Å; A195-Y220 VanDerWaalsContact CB-OH 3.28Å; A195-Y220 WeakPolarHBondContact CB-OH 3.5Å; Q216-Y220 PolarHBondContact O-N 3.49Å; Q216-Y220 VanDerWaalsContact O-N 3.07Å; G217-Y220 WeakPolarHBondContact O-CB 3.49Å; G217-Y220 PolarHBondContact O-N 3.09Å; M218-Y220 VanDerWaalsContact C-N 3.33Å; M218-Y220 PolarHBondContact O-N 3.34Å; Y220-L222 PolarHBondContact O-N 3.15Å; Y220-G223 PolarHBondContact O-N 3.18Å; Y220-V224 HydrophobicContact CD1-CG2 4.31Å; Y220-V224 HydrophobicContact CE1-CG2 3.83Å; Y220-V224 HydrophobicContact CE2-CG2 4.15Å; Y220-V224 WeakPolarHBondContact O-CG2 3.38Å; Y220-V224 PolarHBondContact O-N 3.18Å |
| 221 | L | 97.3 | Very high | 96.6 | Very high | 36 Ų | 36 | 77.2 Ų | 77.2 | 19% | 0.188 | 41% | 0.405 | C | S | . | . | H | α-helix | trans | -63.1 | -42.2 | 179.7 | -70.1 | 172.1 | 0 | 0 | 0 | 112.1 | L199 I212 G217 M218 G223 V224 V225 | L199-L221 HydrophobicContact CD1-CD2 3.56Å; L199-L221 HydrophobicContact CD2-CD2 4.42Å; I212-L221 HydrophobicContact CB-CD1 4.31Å; I212-L221 HydrophobicContact CG1-CD1 4.13Å; I212-L221 HydrophobicContact CG2-CD1 3.92Å; G217-L221 VanDerWaalsContact O-CG 3.26Å; G217-L221 WeakPolarHBondContact O-CG 3.35Å; G217-L221 PolarHBondContact O-N 3.25Å; M218-L221 PolarHBondContact O-N 3.19Å; L221-G223 VanDerWaalsContact C-N 3.29Å; L221-G223 PolarHBondContact O-N 3.46Å; L221-V224 PolarHBondContact O-N 3.37Å; L221-V225 WeakPolarHBondContact O-CG2 3.48Å; L221-V225 PolarHBondContact O-N 3.18Å |
| 222 | L | 96.9 | Very high | 96.3 | Very high | 110 Ų | 110 | 78.7 Ų | 78.7 | 58% | 0.576 | 41% | 0.407 | S | S | * | . | H | α-helix | trans | -59 | -42.8 | 174 | -74.1 | 167.9 | 0 | 0 | 0 | 111.3 | M218 E219 Y220 V225 E226 | M218-L222 HydrophobicContact CG-CD1 4.3Å; M218-L222 WeakPolarHBondContact O-CB 3.31Å; M218-L222 WeakPolarHBondContact O-CG 3.49Å; M218-L222 PolarHBondContact O-N 3.47Å; E219-L222 PolarHBondContact O-N 3.27Å; Y220-L222 PolarHBondContact O-N 3.15Å; L222-V225 PolarHBondContact O-N 3.08Å; L222-E226 WeakPolarHBondContact O-CB 3.39Å; L222-E226 PolarHBondContact O-N 3.49Å |
| 223 | G | 97.9 | Very high | 96 | Very high | 39 Ų | 39 | 82.1 Ų | 82.1 | 40% | 0.402 | 42% | 0.415 | S | S | . | . | H | α-helix | trans | -60 | -45.7 | 174 | 0 | 0 | 0 | 0 | 0 | 112.8 | E219 Y220 L221 E226 V227 | E219-G223 PolarHBondContact O-N 3.42Å; Y220-G223 PolarHBondContact O-N 3.18Å; L221-G223 VanDerWaalsContact C-N 3.29Å; L221-G223 PolarHBondContact O-N 3.46Å; G223-E226 PolarHBondContact O-N 3.24Å; G223-V227 WeakPolarHBondContact O-CG2 3.32Å; G223-V227 PolarHBondContact O-N 2.67Å |
| 224 | V | 97.8 | Very high | 95.3 | Very high | 19 Ų | 19 | 78.7 Ų | 78.7 | 12% | 0.115 | 41% | 0.405 | C | S | . | . | H | α-helix | trans | -64 | -41.9 | 177.8 | 174.5 | 0 | 0 | 0 | 0 | 111.7 | I192 A195 Y220 L221 E226 V227 Y228 | I192-V224 HydrophobicContact CG1-CG1 4.42Å; A195-V224 HydrophobicContact CB-CB 4.46Å; A195-V224 HydrophobicContact CB-CG1 3.86Å; A195-V224 HydrophobicContact CB-CG2 3.79Å; Y220-V224 HydrophobicContact CD1-CG2 4.31Å; Y220-V224 HydrophobicContact CE1-CG2 3.83Å; Y220-V224 HydrophobicContact CE2-CG2 4.15Å; Y220-V224 WeakPolarHBondContact O-CG2 3.38Å; Y220-V224 PolarHBondContact O-N 3.18Å; L221-V224 PolarHBondContact O-N 3.37Å; V224-E226 VanDerWaalsContact C-N 3.3Å; V224-E226 PolarHBondContact O-N 3.37Å; V224-V227 PolarHBondContact O-N 3.19Å; V224-Y228 PolarHBondContact O-N 3.4Å |
| 225 | V | 96.6 | Very high | 93.9 | Very high | 92 Ų | 92 | 81 Ų | 81 | 56% | 0.558 | 41% | 0.411 | S | S | * | . | H | α-helix | trans | -61.9 | -40.1 | 175.8 | 168.9 | 0 | 0 | 0 | 0 | 111 | L221 L222 Y228 R229 | L221-V225 WeakPolarHBondContact O-CG2 3.48Å; L221-V225 PolarHBondContact O-N 3.18Å; L222-V225 PolarHBondContact O-N 3.08Å; V225-Y228 WeakPolarHBondContact O-CB 3.2Å; V225-Y228 PolarHBondContact O-N 3.4Å; V225-R229 WeakPolarHBondContact O-CB 3.19Å; V225-R229 PolarHBondContact O-N 3.21Å |
| 226 | E | 97.3 | Very high | 91.7 | Very high | 82 Ų | 82 | 87.2 Ų | 87.2 | 38% | 0.383 | 43% | 0.431 | S | S | . | . | H | α-helix | trans | -66.1 | -42.8 | 177.3 | -178.3 | 57.3 | -163.4 | 0 | 0 | 111.8 | L222 G223 V224 Y228 R229 V230 | L222-E226 WeakPolarHBondContact O-CB 3.39Å; L222-E226 PolarHBondContact O-N 3.49Å; G223-E226 PolarHBondContact O-N 3.24Å; V224-E226 VanDerWaalsContact C-N 3.3Å; V224-E226 PolarHBondContact O-N 3.37Å; E226-Y228 VanDerWaalsContact C-N 3.31Å; E226-Y228 PolarHBondContact O-N 3.01Å; E226-R229 PolarHBondContact O-N 3.21Å; E226-R229 IonicContact OE1-CZ 3.47Å; E226-R229 IonicContact OE1-NE 3.49Å; E226-R229 PolarHBondContact OE1-NE 3.36Å; E226-R229 IonicContact OE1-NH2 2.65Å; E226-R229 PolarHBondContact OE1-NH2 3.07Å; E226-R229 IonicContact OE2-CZ 3.49Å; E226-R229 IonicContact OE2-NE 2.77Å; E226-R229 PolarHBondContact OE2-NE 3.47Å; E226-R229 IonicContact OE2-NH2 3.39Å; E226-R229 PolarHBondContact OE2-NH2 3.37Å; E226-V230 WeakPolarHBondContact O-CG2 3.45Å; E226-V230 PolarHBondContact O-N 2.87Å |
| 227 | V | 96.6 | Very high | 91.3 | Very high | 49 Ų | 49 | 84.4 Ų | 84.4 | 30% | 0.297 | 42% | 0.419 | S | S | . | . | H | α-helix | trans | -58.9 | -43.8 | 173.2 | 174.7 | 0 | 0 | 0 | 0 | 110.9 | A188 I192 G223 V224 V230 T231 | A188-V227 HydrophobicContact CB-CG1 3.69Å; I192-V227 HydrophobicContact CD1-CG1 4.11Å; I192-V227 HydrophobicContact CG1-CG1 4.13Å; G223-V227 WeakPolarHBondContact O-CG2 3.32Å; G223-V227 PolarHBondContact O-N 2.67Å; V224-V227 PolarHBondContact O-N 3.19Å; V227-V230 PolarHBondContact O-N 3.07Å; V227-T231 WeakPolarHBondContact O-CB 3.48Å; V227-T231 PolarHBondContact O-N 3.5Å; V227-T231 PolarHBondContact O-OG1 3.2Å |
| 228 | Y | 96 | Very high | 91 | Very high | 120 Ų | 120 | 88.3 Ų | 88.3 | 47% | 0.471 | 44% | 0.436 | S | S | . | . | H | α-helix | trans | -60.5 | -46.1 | 174.7 | 174.4 | -96.6 | 0 | 0 | 0 | 112.1 | I192 V224 V225 E226 V230 T231 K232 | I192-Y228 HydrophobicContact CD1-CD2 4.2Å; I192-Y228 HydrophobicContact CG2-CD2 4.47Å; V224-Y228 PolarHBondContact O-N 3.4Å; V225-Y228 WeakPolarHBondContact O-CB 3.2Å; V225-Y228 PolarHBondContact O-N 3.4Å; E226-Y228 VanDerWaalsContact C-N 3.31Å; E226-Y228 PolarHBondContact O-N 3.01Å; Y228-V230 VanDerWaalsContact C-N 3.35Å; Y228-V230 PolarHBondContact O-N 3.34Å; Y228-T231 PolarHBondContact O-N 3.11Å; Y228-K232 HydrophobicContact CD1-CG 4.4Å; Y228-K232 HydrophobicContact CD2-CG 4.4Å; Y228-K232 HydrophobicContact CE1-CG 3.88Å; Y228-K232 HydrophobicContact CE2-CG 3.89Å; Y228-K232 WeakPolarHBondContact O-CB 3.5Å; Y228-K232 PolarHBondContact O-N 2.71Å; Y228-K232 WeakPolarHBondContact OH-CE 3.31Å |
| 229 | R | 95.4 | Very high | 90.7 | Very high | 111 Ų | 111 | 87.8 Ų | 87.8 | 42% | 0.419 | 43% | 0.434 | S | S | . | . | H | α-helix | trans | -62.8 | -40 | 179.7 | -169.3 | -169.2 | 70.9 | 86.6 | -1.7 | 112.3 | V225 E226 R233 | V225-R229 WeakPolarHBondContact O-CB 3.19Å; V225-R229 PolarHBondContact O-N 3.21Å; E226-R229 PolarHBondContact O-N 3.21Å; E226-R229 IonicContact OE1-CZ 3.47Å; E226-R229 IonicContact OE1-NE 3.49Å; E226-R229 PolarHBondContact OE1-NE 3.36Å; E226-R229 IonicContact OE1-NH2 2.65Å; E226-R229 PolarHBondContact OE1-NH2 3.07Å; E226-R229 IonicContact OE2-CZ 3.49Å; E226-R229 IonicContact OE2-NE 2.77Å; E226-R229 PolarHBondContact OE2-NE 3.47Å; E226-R229 IonicContact OE2-NH2 3.39Å; E226-R229 PolarHBondContact OE2-NH2 3.37Å; R229-R233 VanDerWaalsContact NH2-NH2 3.15Å; R229-R233 WeakPolarHBondContact O-CG 3.22Å; R229-R233 PolarHBondContact O-N 2.62Å |
| 230 | V | 93.3 | Very high | 90.3 | Very high | 60 Ų | 60 | 85.3 Ų | 85.3 | 36% | 0.364 | 42% | 0.423 | S | S | . | . | H | α-helix | trans | -64.9 | -50.7 | 174.7 | 172.8 | 0 | 0 | 0 | 0 | 110.2 | E226 V227 Y228 K232 R233 | E226-V230 WeakPolarHBondContact O-CG2 3.45Å; E226-V230 PolarHBondContact O-N 2.87Å; V227-V230 PolarHBondContact O-N 3.07Å; Y228-V230 VanDerWaalsContact C-N 3.35Å; Y228-V230 PolarHBondContact O-N 3.34Å; V230-K232 VanDerWaalsContact C-N 3.32Å; V230-K232 PolarHBondContact O-N 3.42Å; V230-R233 PolarHBondContact O-N 3.45Å; V230-R233 VanDerWaalsContact O-N 3.14Å |
| 231 | T | 92.3 | Very high | 89.8 | Confident | 6 Ų | 6 | 83.8 Ų | 83.8 | 4% | 0.037 | 42% | 0.423 | C | S | . | . | H | α-helix | trans | -55.5 | -46.8 | 179.6 | -56.1 | 0 | 0 | 0 | 0 | 111.1 | L185 L189 V227 Y228 R233 V234 E235 | L185-T231 HydrophobicContact CD1-CG2 3.45Å; L185-T231 VanDerWaalsContact CD1-CG2 3.45Å; L185-T231 HydrophobicContact CG-CG2 4.39Å; L189-T231 HydrophobicContact CD2-CG2 3.69Å; L189-T231 HydrophobicContact CG-CG2 4.09Å; V227-T231 WeakPolarHBondContact O-CB 3.48Å; V227-T231 PolarHBondContact O-N 3.5Å; V227-T231 PolarHBondContact O-OG1 3.2Å; Y228-T231 PolarHBondContact O-N 3.11Å; T231-R233 VanDerWaalsContact C-N 3.29Å; T231-R233 PolarHBondContact O-N 2.71Å; T231-V234 PolarHBondContact O-N 2.7Å; T231-E235 PolarHBondContact O-N 3.47Å |
| 232 | K | 90.1 | Very high | 89.3 | Confident | 88 Ų | 88 | 86.9 Ų | 86.9 | 38% | 0.383 | 44% | 0.439 | S | S | . | . | H | α-helix | trans | -64.4 | -28.4 | -179.8 | -86.7 | -70.9 | 171.7 | -150.1 | 0 | 114.8 | Y228 V230 V234 E235 | Y228-K232 HydrophobicContact CD1-CG 4.4Å; Y228-K232 HydrophobicContact CD2-CG 4.4Å; Y228-K232 HydrophobicContact CE1-CG 3.88Å; Y228-K232 HydrophobicContact CE2-CG 3.89Å; Y228-K232 WeakPolarHBondContact O-CB 3.5Å; Y228-K232 PolarHBondContact O-N 2.71Å; Y228-K232 WeakPolarHBondContact OH-CE 3.31Å; V230-K232 VanDerWaalsContact C-N 3.32Å; V230-K232 PolarHBondContact O-N 3.42Å; K232-V234 PolarHBondContact O-N 2.86Å; K232-E235 IonicContact NZ-OE2 2.73Å; K232-E235 PolarHBondContact NZ-OE2 2.81Å |
| 233 | R | 88.8 | Confident | 88.8 | Confident | 141 Ų | 141 | 85.3 Ų | 85.3 | 53% | 0.532 | 43% | 0.429 | S | S | . | . | H | α-helix | trans | -71.6 | -20 | 175.3 | -76.1 | -174.3 | -71.2 | 142.8 | -5.7 | 113.1 | R229 V230 T231 | R229-R233 VanDerWaalsContact NH2-NH2 3.15Å; R229-R233 WeakPolarHBondContact O-CG 3.22Å; R229-R233 PolarHBondContact O-N 2.62Å; V230-R233 PolarHBondContact O-N 3.45Å; V230-R233 VanDerWaalsContact O-N 3.14Å; T231-R233 VanDerWaalsContact C-N 3.29Å; T231-R233 PolarHBondContact O-N 2.71Å |
| 234 | V | 81.1 | Confident | 88.1 | Confident | 83 Ų | 83 | 88.8 Ų | 88.8 | 50% | 0.503 | 43% | 0.431 | S | S | . | . | H | α-helix | trans | -93.6 | -21.1 | -178.5 | -178.6 | 0 | 0 | 0 | 0 | 111.5 | T231 K232 | T231-V234 PolarHBondContact O-N 2.7Å; K232-V234 PolarHBondContact O-N 2.86Å |
| 235 | E | 68.9 | Low | 87.3 | Confident | 93 Ų | 93 | 94.7 Ų | 94.7 | 44% | 0.435 | 46% | 0.457 | S | S | . | . | trans | -82.5 | -7.2 | 177.1 | -69.8 | -178.6 | 168.1 | 0 | 0 | 114.6 | T231 K232 | T231-E235 PolarHBondContact O-N 3.47Å; K232-E235 IonicContact NZ-OE2 2.73Å; K232-E235 PolarHBondContact NZ-OE2 2.81Å | ||
| 236 | L | 51.1 | Low | 86.4 | Confident | 211 Ų | 211 | 94.9 Ų | 94.9 | 100% | 1.105 | 45% | 0.448 | S | S | * | . | trans | -100 | 0 | 178.3 | -74 | 171.8 | 0 | 0 | 0 | 111.2 |
Retrieved 236 of 236 residues in 292.1 ms
(Link to these results)