| 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 | 38 | Very low | 39.5 | Very low | 220 Ų | 220 | 163.1 Ų | 163.1 | 100% | 1.084 | 80% | 0.799 | S | S | * | * | 0 | 85.4 | 0 | -56.5 | 175.2 | -174.1 | 0 | 0 | 107.4 | |||||
| 2 | E | 37.3 | Very low | 39.9 | Very low | 166 Ų | 166 | 162.8 Ų | 162.8 | 78% | 0.776 | 79% | 0.79 | S | S | * | * | 79.6 | 131.6 | 62.9 | -66.1 | 154.8 | 98.3 | 0 | 0 | 111.3 | |||||
| 3 | S | 40.5 | Very low | 39.6 | Very low | 107 Ų | 107 | 166.7 Ų | 166.7 | 75% | 0.748 | 79% | 0.791 | S | S | * | * | cis | -154.4 | 156.6 | -0.6 | -107.2 | 0 | 0 | 0 | 0 | 114 | ||||
| 4 | Q | 47.3 | Very low | 39.3 | Very low | 162 Ų | 162 | 168.6 Ų | 168.6 | 76% | 0.757 | 80% | 0.795 | S | S | * | * | trans | -54.2 | 147.3 | 162.4 | -64.4 | 169.7 | -23 | 0 | 0 | 112.2 | ||||
| 5 | R | 43.4 | Very low | 38.9 | Very low | 237 Ų | 237 | 162 Ų | 162 | 89% | 0.894 | 79% | 0.79 | S | S | * | * | -170.3 | 126.1 | 115.1 | -92.5 | 147.8 | -163.7 | -151.9 | 4.9 | 107.7 | |||||
| 6 | V | 44.7 | Very low | 38.9 | Very low | 114 Ų | 114 | 160.1 Ų | 160.1 | 69% | 0.691 | 79% | 0.794 | S | S | * | * | 68.8 | 112.8 | 54.5 | 178.8 | 0 | 0 | 0 | 0 | 112.3 | |||||
| 7 | L | 38 | Very low | 38.9 | Very low | 153 Ų | 153 | 162.6 Ų | 162.6 | 80% | 0.801 | 80% | 0.803 | S | S | * | * | -173.6 | 131.9 | 125.5 | -86.1 | 167.7 | 0 | 0 | 0 | 104.8 | |||||
| 8 | S | 36.7 | Very low | 38.6 | Very low | 95 Ų | 95 | 157.8 Ų | 157.8 | 66% | 0.664 | 80% | 0.802 | S | S | * | * | 70.3 | 141.7 | 53.4 | -154.8 | 0 | 0 | 0 | 0 | 111.5 | |||||
| 9 | S | 39.1 | Very low | 38.4 | Very low | 94 Ų | 94 | 155.3 Ų | 155.3 | 66% | 0.657 | 81% | 0.808 | S | S | * | * | cis | -156 | 160.3 | 25.5 | -39.3 | 0 | 0 | 0 | 0 | 114.1 | ||||
| 10 | Y | 34.9 | Very low | 38.1 | Very low | 196 Ų | 196 | 151.8 Ų | 151.8 | 77% | 0.769 | 81% | 0.811 | S | S | * | * | trans | 16.7 | 126.8 | 136.7 | -96.3 | -108.5 | 0 | 0 | 0 | 119.9 | K12 | Y10-K12 HydrophobicContact CD1-CG 4.49Å; Y10-K12 HydrophobicContact CE1-CD 4.41Å; Y10-K12 HydrophobicContact CE1-CG 4.38Å | ||
| 11 | R | 34.3 | Very low | 37.8 | Very low | 250 Ų | 250 | 150 Ų | 150 | 94% | 0.943 | 81% | 0.81 | S | S | * | * | trans | -139.3 | 85.7 | 142.1 | -161.6 | 177.1 | -168.8 | -173.9 | 3.5 | 112.8 | ||||
| 12 | K | 44.8 | Very low | 37.8 | Very low | 160 Ų | 160 | 146.7 Ų | 146.7 | 70% | 0.696 | 80% | 0.802 | S | S | * | * | trans | -66.2 | 142.8 | 154.2 | -81.4 | -173.5 | 173.8 | -178.9 | 0 | 108.9 | Y10 | Y10-K12 HydrophobicContact CD1-CG 4.49Å; Y10-K12 HydrophobicContact CE1-CD 4.41Å; Y10-K12 HydrophobicContact CE1-CG 4.38Å | ||
| 13 | R | 36.3 | Very low | 37.5 | Very low | 213 Ų | 213 | 142.2 Ų | 142.2 | 80% | 0.804 | 80% | 0.801 | S | S | * | * | 165.4 | 142.1 | 119.2 | -88.9 | 176.6 | -156.9 | -111.3 | 7.7 | 112.4 | |||||
| 14 | F | 35.4 | Very low | 37.2 | Very low | 193 Ų | 193 | 141 Ų | 141 | 85% | 0.846 | 81% | 0.806 | S | S | * | * | trans | 70.1 | 128.6 | 160.3 | -54.9 | -55.7 | 0 | 0 | 0 | 121 | ||||
| 15 | G | 32.1 | Very low | 36.5 | Very low | 70 Ų | 70 | 136.8 Ų | 136.8 | 72% | 0.722 | 81% | 0.805 | S | S | * | * | trans | 111.9 | 101.9 | 137.3 | 0 | 0 | 0 | 0 | 0 | 117.4 | ||||
| 16 | P | 39.3 | Very low | 36.2 | Very low | 132 Ų | 132 | 132.4 Ų | 132.4 | 86% | 0.857 | 81% | 0.805 | S | S | * | * | trans | -83 | 130.4 | 159.2 | 32.9 | -30.1 | 0 | 0 | 0 | 111.1 | ||||
| 17 | Q | 38.7 | Very low | 35.6 | Very low | 202 Ų | 202 | 138 Ų | 138 | 94% | 0.944 | 81% | 0.813 | S | S | * | * | trans | -133.2 | 144.1 | 156 | -67.4 | -167.8 | 92 | 0 | 0 | 106.8 | ||||
| 18 | G | 33.4 | Very low | 35.5 | Very low | 76 Ų | 76 | 139 Ų | 139 | 78% | 0.784 | 82% | 0.818 | S | S | * | * | cis | -179.7 | 105.3 | -6.4 | 0 | 0 | 0 | 0 | 0 | 108.5 | G20 | G18-G20 PolarHBondContact O-N 3.46Š| ||
| 19 | A | 36 | Very low | 35.3 | Very low | 110 Ų | 110 | 140.1 Ų | 140.1 | 91% | 0.909 | 83% | 0.826 | S | S | * | * | trans | -83.6 | 104.3 | -170.7 | 0 | 0 | 0 | 0 | 0 | 111.7 | S21 | A19-S21 PolarHBondContact O-N 3.19Š| ||
| 20 | G | 31.5 | Very low | 35 | Very low | 85 Ų | 85 | 140.8 Ų | 140.8 | 88% | 0.876 | 83% | 0.831 | S | S | * | * | trans | -81.6 | 98.8 | 170.8 | 0 | 0 | 0 | 0 | 0 | 111.4 | G18 | G18-G20 PolarHBondContact O-N 3.46Š| ||
| 21 | S | 32.9 | Very low | 34.9 | Very low | 114 Ų | 114 | 139.2 Ų | 139.2 | 80% | 0.797 | 84% | 0.835 | S | S | * | * | trans | -117.6 | 130.9 | 167.2 | -173.8 | 0 | 0 | 0 | 0 | 109.9 | A19 G23 | A19-S21 PolarHBondContact O-N 3.19Å; S21-G23 PolarHBondContact O-N 2.93Å | ||
| 22 | V | 36.8 | Very low | 34.7 | Very low | 151 Ų | 151 | 132.9 Ų | 132.9 | 92% | 0.915 | 83% | 0.83 | S | S | * | * | trans | -92.4 | 85.7 | -175 | -177.4 | 0 | 0 | 0 | 0 | 109.7 | ||||
| 23 | G | 32.5 | Very low | 34.3 | Very low | 72 Ų | 72 | 131.1 Ų | 131.1 | 74% | 0.742 | 84% | 0.837 | S | S | * | * | trans | -101.8 | 103.9 | 173.5 | 0 | 0 | 0 | 0 | 0 | 112.1 | S21 G25 | S21-G23 PolarHBondContact O-N 2.93Å; G23-G25 PolarHBondContact O-N 3.12Å | ||
| 24 | G | 32.9 | Very low | 34 | Very low | 83 Ų | 83 | 126.7 Ų | 126.7 | 86% | 0.856 | 84% | 0.839 | S | S | * | * | trans | -83.4 | 83.3 | 178.5 | 0 | 0 | 0 | 0 | 0 | 113.3 | ||||
| 25 | G | 32.2 | Very low | 34.1 | Very low | 72 Ų | 72 | 128.5 Ų | 128.5 | 74% | 0.742 | 84% | 0.84 | S | S | * | * | trans | -97.7 | 112.9 | 175.3 | 0 | 0 | 0 | 0 | 0 | 113.1 | G23 | G23-G25 PolarHBondContact O-N 3.12Š| ||
| 26 | V | 37.8 | Very low | 34.1 | Very low | 146 Ų | 146 | 134.7 Ų | 134.7 | 89% | 0.885 | 85% | 0.848 | S | S | * | * | P | Polyproline II helix | trans | -85 | 122.4 | 170.3 | 178.6 | 0 | 0 | 0 | 0 | 109.2 | ||
| 27 | R | 32.4 | Very low | 33.6 | Very low | 230 Ų | 230 | 132.8 Ų | 132.8 | 87% | 0.868 | 84% | 0.837 | S | S | * | * | P | Polyproline II helix | trans | -91.2 | 143.9 | 174.7 | -71.3 | -175.8 | 171 | -165.8 | -5.3 | 111.1 | ||
| 28 | L | 35.1 | Very low | 33.5 | Very low | 174 Ų | 174 | 130.9 Ų | 130.9 | 91% | 0.911 | 83% | 0.833 | S | S | * | * | P | Polyproline II helix | trans | -72 | 149.7 | 165.1 | -67.2 | 84 | 0 | 0 | 0 | 110.1 | ||
| 29 | S | 32.2 | Very low | 33.5 | Very low | 119 Ų | 119 | 136.3 Ų | 136.3 | 83% | 0.832 | 84% | 0.837 | S | S | * | * | trans | -143.9 | 103.8 | 162.1 | 60.6 | 0 | 0 | 0 | 0 | 109.4 | ||||
| 30 | S | 32.8 | Very low | 33.1 | Very low | 109 Ų | 109 | 134.8 Ų | 134.8 | 76% | 0.762 | 83% | 0.832 | S | S | * | * | trans | -80.6 | 154.5 | 160.7 | 55.5 | 0 | 0 | 0 | 0 | 109.6 | ||||
| 31 | L | 33.5 | Very low | 33.2 | Very low | 163 Ų | 163 | 136.2 Ų | 136.2 | 85% | 0.853 | 83% | 0.829 | S | S | * | * | trans | 175.8 | 168.4 | 132.9 | -98.5 | 173 | 0 | 0 | 0 | 111.8 | ||||
| 32 | S | 29.8 | Very low | 33.9 | Very low | 117 Ų | 117 | 136.2 Ų | 136.2 | 82% | 0.818 | 83% | 0.826 | S | S | * | * | trans | 76.8 | 105.2 | 164.1 | -58.2 | 0 | 0 | 0 | 0 | 117.5 | ||||
| 33 | S | 36.6 | Very low | 34 | Very low | 122 Ų | 122 | 138.6 Ų | 138.6 | 85% | 0.853 | 82% | 0.819 | S | S | * | * | trans | -94 | 155.2 | 167.1 | 54.6 | 0 | 0 | 0 | 0 | 111.6 | ||||
| 34 | S | 30.8 | Very low | 34 | Very low | 121 Ų | 121 | 141.6 Ų | 141.6 | 85% | 0.846 | 81% | 0.813 | S | S | * | * | trans | -158.3 | 139.1 | 156.3 | 54.4 | 0 | 0 | 0 | 0 | 110.9 | ||||
| 35 | R | 37.3 | Very low | 34.3 | Very low | 230 Ų | 230 | 144.1 Ų | 144.1 | 87% | 0.868 | 80% | 0.804 | S | S | * | * | trans | -97.6 | 152.9 | 167.2 | -57.2 | 175.1 | -179.3 | 174.6 | -0.5 | 108.3 | ||||
| 36 | F | 31.2 | Very low | 34.4 | Very low | 201 Ų | 201 | 144.7 Ų | 144.7 | 88% | 0.882 | 79% | 0.793 | S | S | * | * | 179.9 | 120 | 126.1 | -97.2 | -61.2 | 0 | 0 | 0 | 114.4 | |||||
| 37 | S | 29.8 | Very low | 34.2 | Very low | 92 Ų | 92 | 145.6 Ų | 145.6 | 64% | 0.643 | 79% | 0.788 | S | S | * | * | trans | 33.2 | 122.7 | 137.2 | 64.3 | 0 | 0 | 0 | 0 | 123.9 | ||||
| 38 | L | 36.6 | Very low | 34.1 | Very low | 161 Ų | 161 | 139.1 Ų | 139.1 | 84% | 0.843 | 78% | 0.777 | S | S | * | * | 73.5 | 147 | 127.9 | -104.4 | 73.6 | 0 | 0 | 0 | 123.9 | |||||
| 39 | H | 32.6 | Very low | 34.1 | Very low | 191 Ų | 191 | 135.5 Ų | 135.5 | 88% | 0.884 | 77% | 0.767 | S | S | * | * | trans | 79 | 133 | 155 | -118.2 | 72 | 0 | 0 | 0 | 118.5 | ||||
| 40 | G | 28.5 | Very low | 34.1 | Very low | 77 Ų | 77 | 136 Ų | 136 | 79% | 0.794 | 77% | 0.765 | S | S | * | * | trans | 163.7 | 20 | -179.3 | 0 | 0 | 0 | 0 | 0 | 120.3 | ||||
| 41 | S | 32.8 | Very low | 34.3 | Very low | 116 Ų | 116 | 138.9 Ų | 138.9 | 81% | 0.811 | 77% | 0.77 | S | S | * | * | trans | -70.8 | 166.7 | 162.8 | -57.5 | 0 | 0 | 0 | 0 | 110.1 | ||||
| 42 | P | 48.3 | Very low | 34.2 | Very low | 113 Ų | 113 | 136.3 Ų | 136.3 | 73% | 0.734 | 77% | 0.765 | S | S | * | * | cis | -137.3 | -157.9 | 17.8 | 26.6 | 3.2 | 0 | 0 | 0 | 112.2 | ||||
| 43 | R | 39 | Very low | 34.4 | Very low | 202 Ų | 202 | 142.2 Ų | 142.2 | 76% | 0.762 | 77% | 0.77 | S | S | * | * | cis | -161.4 | 143.7 | 30.5 | -87.3 | -162.2 | 159.8 | 172.2 | -3.1 | 115 | ||||
| 44 | H | 32.8 | Very low | 34.2 | Very low | 135 Ų | 135 | 145.1 Ų | 145.1 | 63% | 0.625 | 78% | 0.775 | S | S | * | * | trans | 69.2 | 163.6 | 133.5 | -70.6 | -136.1 | 0 | 0 | 0 | 118.8 | ||||
| 45 | M | 38.1 | Very low | 34.1 | Very low | 135 Ų | 135 | 144.8 Ų | 144.8 | 67% | 0.665 | 77% | 0.772 | S | S | * | * | cis | -161.9 | 159.8 | 1.7 | -117 | -28.1 | 54.5 | 0 | 0 | 106.6 | ||||
| 46 | T | 34.5 | Very low | 33.9 | Very low | 84 Ų | 84 | 142.4 Ų | 142.4 | 52% | 0.515 | 78% | 0.776 | S | S | . | * | cis | -161.7 | -172 | -9.2 | -17.4 | 0 | 0 | 0 | 0 | 109 | ||||
| 47 | H | 33.2 | Very low | 33.8 | Very low | 166 Ų | 166 | 136.3 Ų | 136.3 | 77% | 0.769 | 77% | 0.77 | S | S | * | * | trans | 92.2 | 136.1 | 151.6 | -53.4 | -60 | 0 | 0 | 0 | 119 | ||||
| 48 | S | 31.2 | Very low | 33.7 | Very low | 93 Ų | 93 | 138 Ų | 138 | 65% | 0.65 | 78% | 0.782 | S | S | * | * | cis | -161.1 | 144.7 | -22.1 | -165.1 | 0 | 0 | 0 | 0 | 113 | ||||
| 49 | S | 34.4 | Very low | 33.5 | Very low | 99 Ų | 99 | 135.2 Ų | 135.2 | 69% | 0.692 | 78% | 0.781 | S | S | * | * | trans | 43.8 | 118.1 | 146.4 | 57.1 | 0 | 0 | 0 | 0 | 121.6 | ||||
| 50 | T | 32.9 | Very low | 33.4 | Very low | 130 Ų | 130 | 130 Ų | 130 | 80% | 0.798 | 78% | 0.779 | S | S | * | * | trans | -51.2 | 164.4 | 148.5 | 45.6 | 0 | 0 | 0 | 0 | 114.1 | ||||
| 51 | I | 36.6 | Very low | 33.6 | Very low | 169 Ų | 169 | 130.2 Ų | 130.2 | 87% | 0.867 | 78% | 0.782 | S | S | * | * | trans | -113.1 | 143.1 | 161.7 | -65.9 | 177.2 | 0 | 0 | 0 | 108.7 | ||||
| 52 | S | 30.9 | Very low | 33.5 | Very low | 108 Ų | 108 | 129.2 Ų | 129.2 | 76% | 0.755 | 78% | 0.781 | S | S | * | * | trans | -120.1 | 165.2 | 175.5 | -75.3 | 0 | 0 | 0 | 0 | 112.7 | ||||
| 53 | R | 33.3 | Very low | 32.7 | Very low | 242 Ų | 242 | 131.2 Ų | 131.2 | 91% | 0.913 | 78% | 0.784 | S | S | * | * | trans | -65.8 | 154.5 | -176.2 | -55.6 | 166.8 | -179.4 | 155.6 | -3.1 | 112.1 | ||||
| 54 | L | 33.2 | Very low | 32.4 | Very low | 182 Ų | 182 | 128.8 Ų | 128.8 | 95% | 0.953 | 79% | 0.786 | S | S | * | * | trans | -131.4 | 150 | 152.2 | -77.9 | 177.3 | 0 | 0 | 0 | 110.2 | ||||
| 55 | S | 29.8 | Very low | 32.4 | Very low | 114 Ų | 114 | 130.3 Ų | 130.3 | 80% | 0.797 | 80% | 0.798 | S | S | * | * | trans | -151.7 | 129.9 | 179.2 | 177.4 | 0 | 0 | 0 | 0 | 109.5 | ||||
| 56 | L | 31.4 | Very low | 32.1 | Very low | 181 Ų | 181 | 127.1 Ų | 127.1 | 95% | 0.948 | 80% | 0.8 | S | S | * | * | trans | -171.4 | 156.8 | 171.5 | -130.7 | 72.1 | 0 | 0 | 0 | 106.2 | ||||
| 57 | G | 29.2 | Very low | 32.2 | Very low | 72 Ų | 72 | 129.8 Ų | 129.8 | 74% | 0.742 | 82% | 0.816 | S | S | * | * | cis | -179.7 | 142.9 | -3.7 | 0 | 0 | 0 | 0 | 0 | 109.1 | ||||
| 58 | S | 29.2 | Very low | 32.8 | Very low | 129 Ų | 129 | 127.9 Ų | 127.9 | 90% | 0.902 | 82% | 0.818 | S | S | * | * | trans | -73.2 | 138 | -165.5 | -177.3 | 0 | 0 | 0 | 0 | 116.5 | ||||
| 59 | A | 32.1 | Very low | 33 | Very low | 101 Ų | 101 | 126.9 Ų | 126.9 | 84% | 0.835 | 82% | 0.823 | S | S | * | * | trans | -177.5 | 150.6 | 138.1 | 0 | 0 | 0 | 0 | 0 | 109.3 | ||||
| 60 | G | 31.1 | Very low | 33.2 | Very low | 81 Ų | 81 | 130 Ų | 130 | 84% | 0.835 | 83% | 0.832 | S | S | * | * | cis | 164.7 | 127.1 | -8 | 0 | 0 | 0 | 0 | 0 | 110.5 | ||||
| 61 | G | 31.4 | Very low | 33.3 | Very low | 83 Ų | 83 | 135.9 Ų | 135.9 | 86% | 0.856 | 84% | 0.839 | S | S | * | * | trans | 172.9 | 149.9 | -178.4 | 0 | 0 | 0 | 0 | 0 | 112.5 | ||||
| 62 | A | 31.9 | Very low | 33.8 | Very low | 95 Ų | 95 | 135.7 Ų | 135.7 | 79% | 0.785 | 84% | 0.839 | S | S | * | * | trans | -148 | -170.3 | -166.9 | 0 | 0 | 0 | 0 | 0 | 113.8 | ||||
| 63 | L | 30.5 | Very low | 34.2 | Very low | 154 Ų | 154 | 137.3 Ų | 137.3 | 81% | 0.806 | 84% | 0.839 | S | S | * | * | trans | 85.5 | 126.7 | -175.5 | -48.6 | 176.3 | 0 | 0 | 0 | 113.2 | ||||
| 64 | L | 31.9 | Very low | 34.6 | Very low | 152 Ų | 152 | 135.4 Ų | 135.4 | 80% | 0.796 | 84% | 0.838 | S | S | * | * | cis | 69.3 | 136.6 | 40.7 | -55.9 | 172.4 | 0 | 0 | 0 | 112.9 | ||||
| 65 | L | 34 | Very low | 35.7 | Very low | 166 Ų | 166 | 131.1 Ų | 131.1 | 87% | 0.869 | 82% | 0.823 | S | S | * | * | cis | -168.6 | 146.1 | -13.6 | 170.7 | 66.6 | 0 | 0 | 0 | 107.8 | ||||
| 66 | G | 30.6 | Very low | 36.8 | Very low | 69 Ų | 69 | 128.6 Ų | 128.6 | 71% | 0.711 | 81% | 0.81 | S | S | * | * | trans | 112.3 | 130.9 | 152.2 | 0 | 0 | 0 | 0 | 0 | 119.2 | ||||
| 67 | T | 38.3 | Very low | 38 | Very low | 140 Ų | 140 | 124.4 Ų | 124.4 | 86% | 0.859 | 79% | 0.788 | S | S | * | * | trans | -80.2 | 174.8 | 150.1 | 44.3 | 0 | 0 | 0 | 0 | 109.3 | ||||
| 68 | P | 45.9 | Very low | 39.3 | Very low | 126 Ų | 126 | 125.4 Ų | 125.4 | 82% | 0.818 | 78% | 0.784 | S | S | * | * | cis | -145.3 | -175.8 | 20.5 | 44.8 | -25.4 | 0 | 0 | 0 | 117.8 | ||||
| 69 | G | 35.1 | Very low | 40.8 | Very low | 72 Ų | 72 | 125 Ų | 125 | 74% | 0.742 | 77% | 0.771 | S | S | * | * | trans | 105.4 | 107 | 134.3 | 0 | 0 | 0 | 0 | 0 | 120 | ||||
| 70 | N | 37.4 | Very low | 42.3 | Very low | 164 Ų | 164 | 124.9 Ų | 124.9 | 88% | 0.877 | 76% | 0.756 | S | S | * | * | trans | 9 | 115.9 | 155.6 | -72.1 | 5.4 | 0 | 0 | 0 | 120.6 | ||||
| 71 | R | 34.9 | Very low | 43.8 | Very low | 253 Ų | 253 | 126.8 Ų | 126.8 | 96% | 0.955 | 74% | 0.741 | S | S | * | * | -163.5 | 161.8 | 110.1 | -112.4 | 170 | 165.4 | 147.1 | -5 | 112.3 | |||||
| 72 | L | 47.4 | Very low | 45.3 | Very low | 166 Ų | 166 | 125.3 Ų | 125.3 | 87% | 0.869 | 72% | 0.72 | S | S | * | * | trans | -81.2 | 135.5 | -175.7 | -62.5 | 160.2 | 0 | 0 | 0 | 111.4 | ||||
| 73 | D | 39.7 | Very low | 46.8 | Very low | 142 Ų | 142 | 126 Ų | 126 | 76% | 0.759 | 71% | 0.707 | S | S | * | * | -164.8 | 164 | 123.1 | -132.2 | -41.3 | 0 | 0 | 0 | 113.4 | S75 | D73-S75 PolarHBondContact O-N 2.85Š| |||
| 74 | F | 42.4 | Very low | 48.7 | Very low | 201 Ų | 201 | 127.2 Ų | 127.2 | 88% | 0.882 | 70% | 0.702 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -79.5 | 56 | -161 | -73.3 | -91.9 | 0 | 0 | 0 | 116.4 | ||
| 75 | S | 56.3 | Low | 50.6 | Low | 92 Ų | 92 | 129.1 Ų | 129.1 | 64% | 0.643 | 70% | 0.699 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -117.4 | -34.7 | 174.7 | -165.1 | 0 | 0 | 0 | 0 | 114.9 | D73 D77 S78 | D73-S75 PolarHBondContact O-N 2.85Å; S75-D77 VanDerWaalsContact C-N 3.33Å; S75-D77 PolarHBondContact O-N 3.33Å; S75-S78 PolarHBondContact O-N 2.62Å |
| 76 | A | 53.1 | Low | 52.3 | Low | 62 Ų | 62 | 126.6 Ų | 126.6 | 51% | 0.512 | 68% | 0.683 | S | S | . | * | H | α-helix | trans | -64.3 | -32.5 | -175.3 | 0 | 0 | 0 | 0 | 0 | 114.1 | S78 L79 L80 | A76-S78 PolarHBondContact O-N 2.99Å; A76-L79 PolarHBondContact O-N 3.14Å; A76-L79 VanDerWaalsContact O-N 3.16Å; A76-L80 WeakPolarHBondContact O-CG 3.26Å; A76-L80 PolarHBondContact O-N 2.85Å |
| 77 | D | 55.2 | Low | 54.4 | Low | 92 Ų | 92 | 126.5 Ų | 126.5 | 49% | 0.492 | 67% | 0.669 | S | S | . | * | H | α-helix | trans | -65.2 | -26.6 | -173.6 | -146.1 | 60.1 | 0 | 0 | 0 | 113.3 | S75 K81 | S75-D77 VanDerWaalsContact C-N 3.33Å; S75-D77 PolarHBondContact O-N 3.33Å; D77-K81 WeakPolarHBondContact O-CB 3.4Å; D77-K81 WeakPolarHBondContact O-CG 3.38Å; D77-K81 PolarHBondContact O-N 3Å; D77-K81 IonicContact OD2-NZ 2.72Å; D77-K81 PolarHBondContact OD2-NZ 2.92Å |
| 78 | S | 57 | Low | 56.3 | Low | 94 Ų | 94 | 128.2 Ų | 128.2 | 66% | 0.657 | 66% | 0.659 | S | S | * | * | H | α-helix | trans | -73.8 | -43.8 | 174.9 | -167.8 | 0 | 0 | 0 | 0 | 111.6 | S75 A76 K81 A82 | S75-S78 PolarHBondContact O-N 2.62Å; A76-S78 PolarHBondContact O-N 2.99Å; S78-K81 PolarHBondContact O-N 2.79Å; S78-A82 PolarHBondContact O-N 3.32Å |
| 79 | L | 60.3 | Low | 57.8 | Low | 119 Ų | 119 | 125.9 Ų | 125.9 | 62% | 0.623 | 64% | 0.643 | S | S | * | * | H | α-helix | trans | -66.4 | -40.9 | 175.8 | -106.3 | 164.9 | 0 | 0 | 0 | 111.8 | A76 A82 Q83 | A76-L79 PolarHBondContact O-N 3.14Å; A76-L79 VanDerWaalsContact O-N 3.16Å; L79-A82 WeakPolarHBondContact O-CB 3.35Å; L79-A82 PolarHBondContact O-N 3.46Å; L79-Q83 PolarHBondContact O-N 3.23Å |
| 80 | L | 63.2 | Low | 59.9 | Low | 99 Ų | 99 | 126.5 Ų | 126.5 | 52% | 0.518 | 63% | 0.629 | S | S | . | * | H | α-helix | trans | -64.1 | -40.3 | 173.6 | -71.2 | 172.4 | 0 | 0 | 0 | 111.6 | A76 A82 Q83 Y84 | A76-L80 WeakPolarHBondContact O-CG 3.26Å; A76-L80 PolarHBondContact O-N 2.85Å; L80-A82 VanDerWaalsContact C-N 3.33Å; L80-A82 PolarHBondContact O-N 2.88Å; L80-Q83 PolarHBondContact O-N 2.95Å; L80-Y84 WeakPolarHBondContact O-CB 3.04Å; L80-Y84 PolarHBondContact O-N 2.99Å |
| 81 | K | 62.6 | Low | 62 | Low | 122 Ų | 122 | 124.2 Ų | 124.2 | 53% | 0.53 | 61% | 0.613 | S | S | . | * | H | α-helix | trans | -68.3 | -27.6 | 172.4 | -82.5 | 169.1 | 179.4 | 134.4 | 0 | 113.7 | D77 S78 R85 | D77-K81 WeakPolarHBondContact O-CB 3.4Å; D77-K81 WeakPolarHBondContact O-CG 3.38Å; D77-K81 PolarHBondContact O-N 3Å; D77-K81 IonicContact OD2-NZ 2.72Å; D77-K81 PolarHBondContact OD2-NZ 2.92Å; S78-K81 PolarHBondContact O-N 2.79Å; K81-R85 VanDerWaalsContact O-CG 3.3Å; K81-R85 WeakPolarHBondContact O-CG 3.44Å; K81-R85 PolarHBondContact O-N 3.06Å |
| 82 | A | 63.8 | Low | 64.2 | Low | 51 Ų | 51 | 118.5 Ų | 118.5 | 42% | 0.421 | 60% | 0.595 | S | S | . | * | H | α-helix | trans | -67.9 | -52.6 | 170.6 | 0 | 0 | 0 | 0 | 0 | 110.3 | S78 L79 L80 Y84 R85 E86 | S78-A82 PolarHBondContact O-N 3.32Å; L79-A82 WeakPolarHBondContact O-CB 3.35Å; L79-A82 PolarHBondContact O-N 3.46Å; L80-A82 VanDerWaalsContact C-N 3.33Å; L80-A82 PolarHBondContact O-N 2.88Å; A82-Y84 PolarHBondContact O-N 3.39Å; A82-R85 WeakPolarHBondContact O-CB 3.37Å; A82-R85 PolarHBondContact O-N 2.82Å; A82-R85 VanDerWaalsContact O-N 3.08Å; A82-E86 PolarHBondContact O-N 2.83Å |
| 83 | Q | 63.9 | Low | 65.9 | Low | 110 Ų | 110 | 115.3 Ų | 115.3 | 51% | 0.514 | 58% | 0.582 | S | S | . | * | H | α-helix | trans | -59.7 | -40.5 | 175.5 | -76.2 | -167.4 | -41.2 | 0 | 0 | 112.7 | L79 L80 R85 E86 T87 | L79-Q83 PolarHBondContact O-N 3.23Å; L80-Q83 PolarHBondContact O-N 2.95Å; Q83-R85 PolarHBondContact O-N 3.13Å; Q83-E86 CarbonylContact O-C 3.55Å; Q83-E86 WeakPolarHBondContact O-CB 3.34Å; Q83-E86 PolarHBondContact O-N 3.27Å; Q83-E86 VanDerWaalsContact O-N 3.12Å; Q83-T87 WeakPolarHBondContact O-CG2 3.43Å; Q83-T87 PolarHBondContact O-N 2.73Å; Q83-T87 PolarHBondContact O-OG1 2.92Å |
| 84 | Y | 69.8 | Low | 67.8 | Low | 179 Ų | 179 | 115 Ų | 115 | 70% | 0.702 | 58% | 0.577 | S | S | * | * | H | α-helix | trans | -69.6 | -21.4 | 177.8 | -136.8 | -76.2 | 0 | 0 | 0 | 113.2 | L80 A82 R88 | L80-Y84 WeakPolarHBondContact O-CB 3.04Å; L80-Y84 PolarHBondContact O-N 2.99Å; A82-Y84 PolarHBondContact O-N 3.39Å; Y84-R88 WeakPolarHBondContact O-CB 3.14Å; Y84-R88 PolarHBondContact O-N 2.87Å |
| 85 | R | 70.8 | Confident | 69.7 | Low | 192 Ų | 192 | 111.6 Ų | 111.6 | 73% | 0.725 | 57% | 0.565 | S | S | * | * | H | α-helix | trans | -78 | -42.4 | 167.7 | -76.9 | 172.5 | 175.6 | -177.9 | -0.7 | 110.6 | K81 A82 Q83 R88 T89 | K81-R85 VanDerWaalsContact O-CG 3.3Å; K81-R85 WeakPolarHBondContact O-CG 3.44Å; K81-R85 PolarHBondContact O-N 3.06Å; A82-R85 WeakPolarHBondContact O-CB 3.37Å; A82-R85 PolarHBondContact O-N 2.82Å; A82-R85 VanDerWaalsContact O-N 3.08Å; Q83-R85 PolarHBondContact O-N 3.13Å; R85-R88 CarbonylContact O-C 3.6Å; R85-R88 PolarHBondContact O-N 2.74Å; R85-T89 WeakPolarHBondContact O-CG2 3.34Å; R85-T89 PolarHBondContact O-N 2.85Å; R85-T89 PolarHBondContact O-OG1 3.46Å |
| 86 | E | 70.6 | Confident | 70.9 | Confident | 113 Ų | 113 | 112 Ų | 112 | 53% | 0.528 | 56% | 0.558 | S | S | . | * | H | α-helix | trans | -64 | -48.8 | 179.9 | -170.5 | 172 | -162 | 0 | 0 | 112.2 | A82 Q83 R88 T89 N90 | A82-E86 PolarHBondContact O-N 2.83Å; Q83-E86 CarbonylContact O-C 3.55Å; Q83-E86 WeakPolarHBondContact O-CB 3.34Å; Q83-E86 PolarHBondContact O-N 3.27Å; Q83-E86 VanDerWaalsContact O-N 3.12Å; E86-R88 PolarHBondContact O-N 2.74Å; E86-T89 VanDerWaalsContact CA-OG1 3.31Å; E86-T89 WeakPolarHBondContact CA-OG1 3.4Å; E86-T89 PolarHBondContact O-N 3Å; E86-T89 PolarHBondContact O-OG1 3.44Å; E86-N90 WeakPolarHBondContact O-CB 3.19Å; E86-N90 PolarHBondContact O-N 3.34Å; E86-N90 PolarHBondContact O-ND2 3.08Å; E86-N90 PolarHBondContact O-OD1 3.1Å |
| 87 | T | 75.2 | Confident | 72.4 | Confident | 67 Ų | 67 | 110.3 Ų | 110.3 | 41% | 0.411 | 55% | 0.546 | S | S | . | . | H | α-helix | trans | -60 | -46.1 | 172.5 | 57.1 | 0 | 0 | 0 | 0 | 110.7 | Q83 T89 N90 E91 | Q83-T87 WeakPolarHBondContact O-CG2 3.43Å; Q83-T87 PolarHBondContact O-N 2.73Å; Q83-T87 PolarHBondContact O-OG1 2.92Å; T87-T89 VanDerWaalsContact C-N 3.3Å; T87-T89 PolarHBondContact O-N 3.36Å; T87-N90 CarbonylContact O-C 3.59Å; T87-N90 PolarHBondContact O-N 3.23Å; T87-N90 VanDerWaalsContact O-N 3.07Å; T87-E91 WeakPolarHBondContact O-CB 3.48Å; T87-E91 WeakPolarHBondContact O-CG 3.4Å; T87-E91 PolarHBondContact O-N 3.4Å |
| 88 | R | 78.6 | Confident | 73.8 | Confident | 177 Ų | 177 | 109.6 Ų | 109.6 | 67% | 0.668 | 54% | 0.542 | S | S | * | . | H | α-helix | trans | -66.2 | -27.8 | 177.8 | -172.3 | 171.7 | 179.4 | 162.4 | 2.2 | 113.4 | Y84 R85 E86 K92 | Y84-R88 WeakPolarHBondContact O-CB 3.14Å; Y84-R88 PolarHBondContact O-N 2.87Å; R85-R88 CarbonylContact O-C 3.6Å; R85-R88 PolarHBondContact O-N 2.74Å; E86-R88 PolarHBondContact O-N 2.74Å; R88-K92 VanDerWaalsContact O-CB 3.22Å; R88-K92 WeakPolarHBondContact O-CB 3.25Å; R88-K92 PolarHBondContact O-N 2.85Å; R88-K92 VanDerWaalsContact O-N 3.11Å |
| 89 | T | 77.6 | Confident | 75.3 | Confident | 76 Ų | 76 | 110.2 Ų | 110.2 | 47% | 0.466 | 54% | 0.538 | S | S | . | . | H | α-helix | trans | -75.3 | -36.1 | 169.5 | 44.8 | 0 | 0 | 0 | 0 | 112 | R85 E86 T87 K92 V93 | R85-T89 WeakPolarHBondContact O-CG2 3.34Å; R85-T89 PolarHBondContact O-N 2.85Å; R85-T89 PolarHBondContact O-OG1 3.46Å; E86-T89 VanDerWaalsContact CA-OG1 3.31Å; E86-T89 WeakPolarHBondContact CA-OG1 3.4Å; E86-T89 PolarHBondContact O-N 3Å; E86-T89 PolarHBondContact O-OG1 3.44Å; T87-T89 VanDerWaalsContact C-N 3.3Å; T87-T89 PolarHBondContact O-N 3.36Å; T89-K92 PolarHBondContact O-N 2.82Å; T89-V93 WeakPolarHBondContact O-CB 3.42Å; T89-V93 VanDerWaalsContact O-CG2 3.31Å; T89-V93 WeakPolarHBondContact O-CG2 3.4Å; T89-V93 PolarHBondContact O-N 2.85Å |
| 90 | N | 78.9 | Confident | 76.6 | Confident | 86 Ų | 86 | 109.5 Ų | 109.5 | 46% | 0.46 | 54% | 0.535 | S | S | . | . | H | α-helix | trans | -69.3 | -48.2 | 176.8 | -66.5 | -11.2 | 0 | 0 | 0 | 110.8 | E86 T87 K92 V93 E94 | E86-N90 WeakPolarHBondContact O-CB 3.19Å; E86-N90 PolarHBondContact O-N 3.34Å; E86-N90 PolarHBondContact O-ND2 3.08Å; E86-N90 PolarHBondContact O-OD1 3.1Å; T87-N90 CarbonylContact O-C 3.59Å; T87-N90 PolarHBondContact O-N 3.23Å; T87-N90 VanDerWaalsContact O-N 3.07Å; N90-K92 VanDerWaalsContact C-N 3.25Å; N90-K92 PolarHBondContact O-N 2.92Å; N90-V93 CarbonylContact O-C 3.58Å; N90-V93 PolarHBondContact O-N 3.05Å; N90-E94 WeakPolarHBondContact O-CG 3.2Å; N90-E94 PolarHBondContact O-N 3.05Å |
| 91 | E | 80.3 | Confident | 77.7 | Confident | 115 Ų | 115 | 113.3 Ų | 113.3 | 54% | 0.537 | 54% | 0.542 | S | S | . | . | H | α-helix | trans | -52.9 | -42 | 168.5 | -72.8 | 173 | 172.4 | 0 | 0 | 111.6 | T87 E94 M95 | T87-E91 WeakPolarHBondContact O-CB 3.48Å; T87-E91 WeakPolarHBondContact O-CG 3.4Å; T87-E91 PolarHBondContact O-N 3.4Å; E91-E94 PolarHBondContact O-N 3.41Å; E91-M95 VanDerWaalsContact O-CB 3.25Å; E91-M95 WeakPolarHBondContact O-CB 3.22Å; E91-M95 WeakPolarHBondContact O-CG 3.47Å; E91-M95 PolarHBondContact O-N 2.57Å |
| 92 | K | 82.7 | Confident | 79 | Confident | 133 Ų | 133 | 113.5 Ų | 113.5 | 58% | 0.578 | 54% | 0.544 | S | S | * | . | H | α-helix | trans | -66.3 | -40.2 | 175.9 | -175.1 | -177.1 | 175.6 | -170.1 | 0 | 111.9 | R88 T89 N90 M96 | R88-K92 VanDerWaalsContact O-CB 3.22Å; R88-K92 WeakPolarHBondContact O-CB 3.25Å; R88-K92 PolarHBondContact O-N 2.85Å; R88-K92 VanDerWaalsContact O-N 3.11Å; T89-K92 PolarHBondContact O-N 2.82Å; N90-K92 VanDerWaalsContact C-N 3.25Å; N90-K92 PolarHBondContact O-N 2.92Å; K92-M96 HydrophobicContact CG-SD 4.23Å; K92-M96 WeakPolarHBondContact O-CB 3.38Å; K92-M96 VanDerWaalsContact O-CG 3.23Å; K92-M96 WeakPolarHBondContact O-CG 3.38Å; K92-M96 PolarHBondContact O-N 3.49Å |
| 93 | V | 81.2 | Confident | 80.2 | Confident | 99 Ų | 99 | 113.1 Ų | 113.1 | 60% | 0.6 | 54% | 0.54 | S | S | * | . | H | α-helix | trans | -69 | -39 | 176.9 | 166.9 | 0 | 0 | 0 | 0 | 111.2 | T89 N90 M96 G97 | T89-V93 WeakPolarHBondContact O-CB 3.42Å; T89-V93 VanDerWaalsContact O-CG2 3.31Å; T89-V93 WeakPolarHBondContact O-CG2 3.4Å; T89-V93 PolarHBondContact O-N 2.85Å; N90-V93 CarbonylContact O-C 3.58Å; N90-V93 PolarHBondContact O-N 3.05Å; V93-M96 PolarHBondContact O-N 2.91Å; V93-G97 PolarHBondContact O-N 2.8Å |
| 94 | E | 80.4 | Confident | 81.5 | Confident | 137 Ų | 137 | 111 Ų | 111 | 64% | 0.64 | 54% | 0.538 | S | S | * | . | H | α-helix | trans | -65.1 | -45.1 | 172.6 | -72.4 | -177.8 | 172.8 | 0 | 0 | 111.4 | N90 E91 M96 G97 L98 | N90-E94 WeakPolarHBondContact O-CG 3.2Å; N90-E94 PolarHBondContact O-N 3.05Å; E91-E94 PolarHBondContact O-N 3.41Å; E94-M96 VanDerWaalsContact C-N 3.31Å; E94-M96 PolarHBondContact O-N 2.91Å; E94-G97 CarbonylContact O-C 3.6Å; E94-G97 PolarHBondContact O-N 2.66Å; E94-L98 WeakPolarHBondContact O-CB 3.48Å; E94-L98 VanDerWaalsContact O-CG 3.31Å; E94-L98 WeakPolarHBondContact O-CG 3.5Å; E94-L98 PolarHBondContact O-N 3.41Å |
| 95 | M | 82.4 | Confident | 82.6 | Confident | 128 Ų | 128 | 108.9 Ų | 108.9 | 63% | 0.631 | 53% | 0.533 | S | S | * | . | H | α-helix | trans | -63.9 | -34.1 | 174 | -75.2 | -65.3 | -66 | 0 | 0 | 112.5 | E91 L98 N99 | E91-M95 VanDerWaalsContact O-CB 3.25Å; E91-M95 WeakPolarHBondContact O-CB 3.22Å; E91-M95 WeakPolarHBondContact O-CG 3.47Å; E91-M95 PolarHBondContact O-N 2.57Å; M95-L98 HydrophobicContact SD-CD1 4.25Å; M95-N99 VanDerWaalsContact O-CB 3.26Å; M95-N99 WeakPolarHBondContact O-CB 3.16Å; M95-N99 PolarHBondContact O-N 3.27Å |
| 96 | M | 82.2 | Confident | 83.6 | Confident | 100 Ų | 100 | 103.9 Ų | 103.9 | 49% | 0.493 | 52% | 0.519 | S | S | . | . | H | α-helix | trans | -68.7 | -46.2 | 171.4 | -74.6 | 177.1 | 68.9 | 0 | 0 | 111 | K92 V93 E94 L98 N99 D100 | K92-M96 HydrophobicContact CG-SD 4.23Å; K92-M96 WeakPolarHBondContact O-CB 3.38Å; K92-M96 VanDerWaalsContact O-CG 3.23Å; K92-M96 WeakPolarHBondContact O-CG 3.38Å; K92-M96 PolarHBondContact O-N 3.49Å; V93-M96 PolarHBondContact O-N 2.91Å; E94-M96 VanDerWaalsContact C-N 3.31Å; E94-M96 PolarHBondContact O-N 2.91Å; M96-L98 VanDerWaalsContact C-N 3.29Å; M96-L98 PolarHBondContact O-N 2.94Å; M96-N99 CarbonylContact O-C 3.57Å; M96-N99 WeakPolarHBondContact O-CA 3.37Å; M96-N99 WeakPolarHBondContact O-CB 3.3Å; M96-N99 PolarHBondContact O-N 3.14Å; M96-D100 VanDerWaalsContact O-CG 3.26Å; M96-D100 PolarHBondContact O-N 2.73Å |
| 97 | G | 84.1 | Confident | 84.6 | Confident | 27 Ų | 27 | 105 Ų | 105 | 28% | 0.278 | 52% | 0.524 | S | S | . | . | H | α-helix | trans | -64.5 | -28.9 | 175.7 | 0 | 0 | 0 | 0 | 0 | 114.1 | V93 E94 R101 | V93-G97 PolarHBondContact O-N 2.8Å; E94-G97 CarbonylContact O-C 3.6Å; E94-G97 PolarHBondContact O-N 2.66Å; G97-R101 WeakPolarHBondContact O-CD 3.29Å; G97-R101 WeakPolarHBondContact O-CG 3.2Å; G97-R101 PolarHBondContact O-N 3.04Å |
| 98 | L | 85.4 | Confident | 85.5 | Confident | 78 Ų | 78 | 106.9 Ų | 106.9 | 41% | 0.408 | 53% | 0.527 | S | S | . | . | H | α-helix | trans | -71.7 | -42.8 | 168.4 | -73.8 | 172 | 0 | 0 | 0 | 111.2 | E94 M95 M96 R101 F102 | E94-L98 WeakPolarHBondContact O-CB 3.48Å; E94-L98 VanDerWaalsContact O-CG 3.31Å; E94-L98 WeakPolarHBondContact O-CG 3.5Å; E94-L98 PolarHBondContact O-N 3.41Å; M95-L98 HydrophobicContact SD-CD1 4.25Å; M96-L98 VanDerWaalsContact C-N 3.29Å; M96-L98 PolarHBondContact O-N 2.94Å; L98-R101 WeakPolarHBondContact O-CB 3.29Å; L98-R101 PolarHBondContact O-N 3.05Å; L98-F102 HydrophobicContact CB-CE2 4.45Å; L98-F102 WeakPolarHBondContact O-CD2 3.29Å; L98-F102 PolarHBondContact O-N 2.83Å |
| 99 | N | 87 | Confident | 86.2 | Confident | 106 Ų | 106 | 100.9 Ų | 100.9 | 57% | 0.567 | 51% | 0.51 | S | S | * | . | H | α-helix | trans | -65.1 | -39.5 | 177.6 | -164.9 | 33.5 | 0 | 0 | 0 | 112.1 | M95 M96 R101 F102 A103 | M95-N99 VanDerWaalsContact O-CB 3.26Å; M95-N99 WeakPolarHBondContact O-CB 3.16Å; M95-N99 PolarHBondContact O-N 3.27Å; M96-N99 CarbonylContact O-C 3.57Å; M96-N99 WeakPolarHBondContact O-CA 3.37Å; M96-N99 WeakPolarHBondContact O-CB 3.3Å; M96-N99 PolarHBondContact O-N 3.14Å; N99-R101 VanDerWaalsContact C-N 3.34Å; N99-R101 PolarHBondContact O-N 3.47Å; N99-F102 CarbonylContact O-C 3.56Å; N99-F102 PolarHBondContact O-N 3.42Å; N99-A103 WeakPolarHBondContact O-CB 3.49Å; N99-A103 PolarHBondContact O-N 2.93Å |
| 100 | D | 87.2 | Confident | 86.9 | Confident | 104 Ų | 104 | 105.2 Ų | 105.2 | 56% | 0.556 | 52% | 0.518 | S | S | * | . | H | α-helix | trans | -64.4 | -39 | 174.2 | -65.8 | -21.6 | 0 | 0 | 0 | 111.2 | M96 A103 S104 | M96-D100 VanDerWaalsContact O-CG 3.26Å; M96-D100 PolarHBondContact O-N 2.73Å; D100-A103 PolarHBondContact O-N 2.85Å; D100-S104 PolarHBondContact O-N 3.42Å |
| 101 | R | 87.8 | Confident | 87.7 | Confident | 179 Ų | 179 | 105.6 Ų | 105.6 | 68% | 0.675 | 52% | 0.515 | S | S | * | . | H | α-helix | trans | -64.4 | -43.3 | 171.5 | -72.8 | 167.7 | -171.5 | -172 | 4.3 | 111.4 | G97 L98 N99 S104 F105 | G97-R101 WeakPolarHBondContact O-CD 3.29Å; G97-R101 WeakPolarHBondContact O-CG 3.2Å; G97-R101 PolarHBondContact O-N 3.04Å; L98-R101 WeakPolarHBondContact O-CB 3.29Å; L98-R101 PolarHBondContact O-N 3.05Å; N99-R101 VanDerWaalsContact C-N 3.34Å; N99-R101 PolarHBondContact O-N 3.47Å; R101-S104 PolarHBondContact O-N 2.92Å; R101-S104 PolarHBondContact O-OG 3.31Å; R101-F105 WeakPolarHBondContact O-CB 3.15Å; R101-F105 PolarHBondContact O-N 3.3Å |
| 102 | F | 89.2 | Confident | 88.3 | Confident | 127 Ų | 127 | 104.3 Ų | 104.3 | 56% | 0.557 | 51% | 0.512 | S | S | * | . | H | α-helix | trans | -64 | -38.9 | 174.7 | -75.9 | -57.4 | 0 | 0 | 0 | 112.1 | L98 N99 F105 I106 | L98-F102 HydrophobicContact CB-CE2 4.45Å; L98-F102 WeakPolarHBondContact O-CD2 3.29Å; L98-F102 PolarHBondContact O-N 2.83Å; N99-F102 CarbonylContact O-C 3.56Å; N99-F102 PolarHBondContact O-N 3.42Å; F102-F105 PolarHBondContact O-N 3.29Å; F102-I106 WeakPolarHBondContact O-CB 3.41Å; F102-I106 VanDerWaalsContact O-CG1 3.26Å; F102-I106 WeakPolarHBondContact O-CG1 3.36Å; F102-I106 PolarHBondContact O-N 3.36Å |
| 103 | A | 88.8 | Confident | 88.8 | Confident | 43 Ų | 43 | 103.3 Ų | 103.3 | 36% | 0.355 | 51% | 0.509 | S | S | . | . | H | α-helix | trans | -60.4 | -49.9 | 172.8 | 0 | 0 | 0 | 0 | 0 | 110.9 | N99 D100 F105 I106 E107 | N99-A103 WeakPolarHBondContact O-CB 3.49Å; N99-A103 PolarHBondContact O-N 2.93Å; D100-A103 PolarHBondContact O-N 2.85Å; A103-F105 PolarHBondContact O-N 2.78Å; A103-I106 PolarHBondContact O-N 2.79Å; A103-I106 VanDerWaalsContact O-N 3.16Å; A103-E107 WeakPolarHBondContact O-CG 3.39Å; A103-E107 PolarHBondContact O-N 2.79Å |
| 104 | S | 90.6 | Very high | 89.4 | Confident | 66 Ų | 66 | 104.9 Ų | 104.9 | 46% | 0.462 | 51% | 0.51 | S | S | . | . | H | α-helix | trans | -61.8 | -30.9 | 175.8 | 75.7 | 0 | 0 | 0 | 0 | 113.3 | D100 R101 K108 | D100-S104 PolarHBondContact O-N 3.42Å; R101-S104 PolarHBondContact O-N 2.92Å; R101-S104 PolarHBondContact O-OG 3.31Å; S104-K108 VanDerWaalsContact O-CB 3.28Å; S104-K108 WeakPolarHBondContact O-CB 3.19Å; S104-K108 PolarHBondContact O-N 3.06Å |
| 105 | F | 93.8 | Very high | 90.1 | Very high | 134 Ų | 134 | 102.8 Ų | 102.8 | 59% | 0.588 | 50% | 0.5 | S | S | * | . | H | α-helix | trans | -73.3 | -41.9 | 175.6 | -175.6 | -97.8 | 0 | 0 | 0 | 111.2 | R101 F102 A103 K108 V109 | R101-F105 WeakPolarHBondContact O-CB 3.15Å; R101-F105 PolarHBondContact O-N 3.3Å; F102-F105 PolarHBondContact O-N 3.29Å; A103-F105 PolarHBondContact O-N 2.78Å; F105-K108 PolarHBondContact O-N 2.89Å; F105-V109 HydrophobicContact CD1-CG2 4.05Å; F105-V109 HydrophobicContact CE1-CG2 3.66Å; F105-V109 HydrophobicContact CZ-CG2 3.92Å; F105-V109 WeakPolarHBondContact O-CB 3.19Å; F105-V109 WeakPolarHBondContact O-CG2 3.25Å; F105-V109 PolarHBondContact O-N 2.88Å |
| 106 | I | 91.2 | Very high | 90.6 | Very high | 87 Ų | 87 | 101.4 Ų | 101.4 | 45% | 0.446 | 50% | 0.495 | S | S | . | . | H | α-helix | trans | -64.4 | -40.9 | 174.7 | -70.1 | 163.2 | 0 | 0 | 0 | 110.7 | F102 A103 V109 R110 | F102-I106 WeakPolarHBondContact O-CB 3.41Å; F102-I106 VanDerWaalsContact O-CG1 3.26Å; F102-I106 WeakPolarHBondContact O-CG1 3.36Å; F102-I106 PolarHBondContact O-N 3.36Å; A103-I106 PolarHBondContact O-N 2.79Å; A103-I106 VanDerWaalsContact O-N 3.16Å; I106-V109 PolarHBondContact O-N 3.36Å; I106-R110 WeakPolarHBondContact O-CB 3.33Å; I106-R110 WeakPolarHBondContact O-CG 3.39Å; I106-R110 PolarHBondContact O-N 3.35Å |
| 107 | E | 92.3 | Very high | 91.2 | Very high | 136 Ų | 136 | 100.8 Ų | 100.8 | 64% | 0.636 | 50% | 0.497 | S | S | * | . | H | α-helix | trans | -62.8 | -42 | 171.6 | -72.9 | -178.5 | 168.1 | 0 | 0 | 111.7 | A103 R110 F111 | A103-E107 WeakPolarHBondContact O-CG 3.39Å; A103-E107 PolarHBondContact O-N 2.79Å; E107-R110 PolarHBondContact O-N 3.47Å; E107-F111 WeakPolarHBondContact O-CB 3.27Å; E107-F111 PolarHBondContact O-N 2.89Å |
| 108 | K | 93.6 | Very high | 91.7 | Very high | 107 Ų | 107 | 103.3 Ų | 103.3 | 47% | 0.465 | 51% | 0.507 | S | S | . | . | H | α-helix | trans | -67.3 | -37.7 | 177 | -173.2 | 55.5 | 176.3 | 175.3 | 0 | 112.6 | S104 F105 L112 | S104-K108 VanDerWaalsContact O-CB 3.28Å; S104-K108 WeakPolarHBondContact O-CB 3.19Å; S104-K108 PolarHBondContact O-N 3.06Å; F105-K108 PolarHBondContact O-N 2.89Å; K108-L112 HydrophobicContact CD-CD1 4.47Å; K108-L112 HydrophobicContact CD-CG 4.46Å; K108-L112 HydrophobicContact CG-CD1 4.23Å; K108-L112 WeakPolarHBondContact O-CB 3.42Å; K108-L112 VanDerWaalsContact O-CG 3.25Å; K108-L112 WeakPolarHBondContact O-CG 3.18Å; K108-L112 PolarHBondContact O-N 3.42Å |
| 109 | V | 94.1 | Very high | 91.9 | Very high | 51 Ų | 51 | 104.4 Ų | 104.4 | 31% | 0.309 | 51% | 0.513 | S | S | . | . | H | α-helix | trans | -63.6 | -51 | 172.6 | 168.7 | 0 | 0 | 0 | 0 | 109.8 | F105 I106 F111 L112 E113 | F105-V109 HydrophobicContact CD1-CG2 4.05Å; F105-V109 HydrophobicContact CE1-CG2 3.66Å; F105-V109 HydrophobicContact CZ-CG2 3.92Å; F105-V109 WeakPolarHBondContact O-CB 3.19Å; F105-V109 WeakPolarHBondContact O-CG2 3.25Å; F105-V109 PolarHBondContact O-N 2.88Å; I106-V109 PolarHBondContact O-N 3.36Å; V109-F111 VanDerWaalsContact C-N 3.3Å; V109-F111 PolarHBondContact O-N 3.45Å; V109-L112 CarbonylContact O-C 3.55Å; V109-L112 PolarHBondContact O-N 3.49Å; V109-E113 HydrophobicContact CG1-CG 4.19Å; V109-E113 WeakPolarHBondContact O-CB 3.38Å; V109-E113 WeakPolarHBondContact O-CG 3.28Å; V109-E113 PolarHBondContact O-N 2.84Å |
| 110 | R | 92.6 | Very high | 92.2 | Very high | 166 Ų | 166 | 103 Ų | 103 | 63% | 0.626 | 51% | 0.508 | S | S | * | . | H | α-helix | trans | -57.5 | -39.9 | 176.1 | -76.1 | 175.1 | 173.5 | -179.9 | -1.3 | 113.2 | I106 E107 E113 Q114 | I106-R110 WeakPolarHBondContact O-CB 3.33Å; I106-R110 WeakPolarHBondContact O-CG 3.39Å; I106-R110 PolarHBondContact O-N 3.35Å; E107-R110 PolarHBondContact O-N 3.47Å; R110-E113 PolarHBondContact O-N 2.84Å; R110-Q114 VanDerWaalsContact O-CB 3.28Å; R110-Q114 WeakPolarHBondContact O-CB 3.37Å; R110-Q114 PolarHBondContact O-N 3.21Å |
| 111 | F | 95.4 | Very high | 92.2 | Very high | 95 Ų | 95 | 101.4 Ų | 101.4 | 42% | 0.417 | 50% | 0.502 | S | S | . | . | H | α-helix | trans | -64.8 | -41.6 | 174.9 | 178.1 | -90.1 | 0 | 0 | 0 | 111.9 | E107 V109 Q114 Q115 | E107-F111 WeakPolarHBondContact O-CB 3.27Å; E107-F111 PolarHBondContact O-N 2.89Å; V109-F111 VanDerWaalsContact C-N 3.3Å; V109-F111 PolarHBondContact O-N 3.45Å; F111-Q114 PolarHBondContact O-N 3.43Å; F111-Q115 HydrophobicContact CD1-CG 4.32Å; F111-Q115 HydrophobicContact CE1-CG 3.89Å; F111-Q115 HydrophobicContact CZ-CG 4.09Å; F111-Q115 WeakPolarHBondContact O-CG 3.43Å; F111-Q115 PolarHBondContact O-N 2.9Å |
| 112 | L | 93.2 | Very high | 92.2 | Very high | 87 Ų | 87 | 98 Ų | 98 | 46% | 0.455 | 49% | 0.494 | S | S | . | . | H | α-helix | trans | -69.7 | -38.4 | 176 | -72.2 | 169.3 | 0 | 0 | 0 | 112 | K108 V109 Q115 N116 | K108-L112 HydrophobicContact CD-CD1 4.47Å; K108-L112 HydrophobicContact CD-CG 4.46Å; K108-L112 HydrophobicContact CG-CD1 4.23Å; K108-L112 WeakPolarHBondContact O-CB 3.42Å; K108-L112 VanDerWaalsContact O-CG 3.25Å; K108-L112 WeakPolarHBondContact O-CG 3.18Å; K108-L112 PolarHBondContact O-N 3.42Å; V109-L112 CarbonylContact O-C 3.55Å; V109-L112 PolarHBondContact O-N 3.49Å; L112-Q115 PolarHBondContact O-N 3.45Å; L112-N116 VanDerWaalsContact O-CB 3.23Å; L112-N116 WeakPolarHBondContact O-CB 3.34Å; L112-N116 PolarHBondContact O-N 2.87Å |
| 113 | E | 92.6 | Very high | 91.9 | Very high | 113 Ų | 113 | 97.3 Ų | 97.3 | 53% | 0.528 | 50% | 0.495 | S | S | . | . | H | α-helix | trans | -60.5 | -45.2 | 171.1 | -72 | 171.9 | 156.2 | 0 | 0 | 110.8 | V109 R110 N116 T117 | V109-E113 HydrophobicContact CG1-CG 4.19Å; V109-E113 WeakPolarHBondContact O-CB 3.38Å; V109-E113 WeakPolarHBondContact O-CG 3.28Å; V109-E113 PolarHBondContact O-N 2.84Å; R110-E113 PolarHBondContact O-N 2.84Å; E113-N116 PolarHBondContact O-N 3.43Å; E113-T117 WeakPolarHBondContact O-CG2 3.4Å; E113-T117 PolarHBondContact O-N 3.43Å; E113-T117 PolarHBondContact O-OG1 2.83Å |
| 114 | Q | 94.9 | Very high | 91.6 | Very high | 131 Ų | 131 | 99.5 Ų | 99.5 | 61% | 0.612 | 51% | 0.505 | S | S | * | . | H | α-helix | trans | -66.3 | -39.9 | 176.8 | -171 | 176.6 | 10.7 | 0 | 0 | 112.4 | R110 F111 N116 T117 V118 | R110-Q114 VanDerWaalsContact O-CB 3.28Å; R110-Q114 WeakPolarHBondContact O-CB 3.37Å; R110-Q114 PolarHBondContact O-N 3.21Å; F111-Q114 PolarHBondContact O-N 3.43Å; Q114-N116 VanDerWaalsContact C-N 3.32Å; Q114-T117 PolarHBondContact O-OG1 2.84Å; Q114-T117 VanDerWaalsContact O-OG1 3.05Å; Q114-V118 VanDerWaalsContact O-CG2 3.3Å; Q114-V118 WeakPolarHBondContact O-CG2 3.07Å; Q114-V118 PolarHBondContact O-N 2.88Å; Q114-V118 VanDerWaalsContact O-N 3.07Å |
| 115 | Q | 94.8 | Very high | 91.2 | Very high | 93 Ų | 93 | 101.7 Ų | 101.7 | 44% | 0.435 | 51% | 0.507 | S | S | . | . | H | α-helix | trans | -63.4 | -39.8 | 170.7 | -77 | -165.8 | -51.6 | 0 | 0 | 111.5 | F111 L112 V118 L119 | F111-Q115 HydrophobicContact CD1-CG 4.32Å; F111-Q115 HydrophobicContact CE1-CG 3.89Å; F111-Q115 HydrophobicContact CZ-CG 4.09Å; F111-Q115 WeakPolarHBondContact O-CG 3.43Å; F111-Q115 PolarHBondContact O-N 2.9Å; L112-Q115 PolarHBondContact O-N 3.45Å; Q115-V118 PolarHBondContact O-N 2.63Å; Q115-L119 WeakPolarHBondContact O-CB 3.31Å; Q115-L119 VanDerWaalsContact O-CG 3.25Å; Q115-L119 WeakPolarHBondContact O-CG 3.43Å; Q115-L119 PolarHBondContact O-N 3.33Å |
| 116 | N | 91.4 | Very high | 90.3 | Very high | 100 Ų | 100 | 100.1 Ų | 100.1 | 54% | 0.535 | 51% | 0.505 | S | S | . | . | H | α-helix | trans | -70.4 | -38.1 | -179.2 | -159.2 | 4.7 | 0 | 0 | 0 | 111.8 | L112 E113 Q114 L119 V120 | L112-N116 VanDerWaalsContact O-CB 3.23Å; L112-N116 WeakPolarHBondContact O-CB 3.34Å; L112-N116 PolarHBondContact O-N 2.87Å; E113-N116 PolarHBondContact O-N 3.43Å; Q114-N116 VanDerWaalsContact C-N 3.32Å; N116-L119 PolarHBondContact O-N 3.4Å; N116-V120 WeakPolarHBondContact O-CB 3.1Å; N116-V120 VanDerWaalsContact O-CG2 3.25Å; N116-V120 WeakPolarHBondContact O-CG2 3.48Å; N116-V120 PolarHBondContact O-N 3.25Å |
| 117 | T | 95.1 | Very high | 89.3 | Confident | 86 Ų | 86 | 104.8 Ų | 104.8 | 53% | 0.528 | 52% | 0.517 | S | S | . | . | H | α-helix | trans | -65.3 | -42.3 | 172.1 | 56.2 | 0 | 0 | 0 | 0 | 111.8 | E113 Q114 V120 T121 | E113-T117 WeakPolarHBondContact O-CG2 3.4Å; E113-T117 PolarHBondContact O-N 3.43Å; E113-T117 PolarHBondContact O-OG1 2.83Å; Q114-T117 PolarHBondContact O-OG1 2.84Å; Q114-T117 VanDerWaalsContact O-OG1 3.05Å; T117-V120 PolarHBondContact O-N 2.94Å; T117-T121 WeakPolarHBondContact O-CG2 3.28Å; T117-T121 PolarHBondContact O-N 3.11Å; T117-T121 PolarHBondContact O-OG1 3.19Å |
| 118 | V | 94.6 | Very high | 88 | Confident | 81 Ų | 81 | 101.8 Ų | 101.8 | 49% | 0.491 | 52% | 0.522 | S | S | . | . | H | α-helix | trans | -58.5 | -52 | 173 | 170.4 | 0 | 0 | 0 | 0 | 110.8 | Q114 Q115 V120 T121 E122 | Q114-V118 VanDerWaalsContact O-CG2 3.3Å; Q114-V118 WeakPolarHBondContact O-CG2 3.07Å; Q114-V118 PolarHBondContact O-N 2.88Å; Q114-V118 VanDerWaalsContact O-N 3.07Å; Q115-V118 PolarHBondContact O-N 2.63Å; V118-V120 VanDerWaalsContact C-N 3.32Å; V118-V120 PolarHBondContact O-N 3.45Å; V118-T121 CarbonylContact O-C 3.54Å; V118-T121 PolarHBondContact O-N 2.88Å; V118-T121 VanDerWaalsContact O-N 3.07Å; V118-T121 PolarHBondContact O-OG1 3.48Å; V118-E122 PolarHBondContact O-N 3.48Å |
| 119 | L | 90.9 | Very high | 86.5 | Confident | 100 Ų | 100 | 103.5 Ų | 103.5 | 52% | 0.524 | 53% | 0.529 | S | S | . | . | H | α-helix | trans | -59 | -40.1 | 178.3 | -73.5 | 168.5 | 0 | 0 | 0 | 112.3 | Q115 N116 E122 L123 | Q115-L119 WeakPolarHBondContact O-CB 3.31Å; Q115-L119 VanDerWaalsContact O-CG 3.25Å; Q115-L119 WeakPolarHBondContact O-CG 3.43Å; Q115-L119 PolarHBondContact O-N 3.33Å; N116-L119 PolarHBondContact O-N 3.4Å; L119-E122 PolarHBondContact O-N 3.46Å; L119-L123 WeakPolarHBondContact O-CB 3.37Å; L119-L123 PolarHBondContact O-N 2.71Å |
| 120 | V | 91.4 | Very high | 84.8 | Confident | 77 Ų | 77 | 107 Ų | 107 | 47% | 0.467 | 54% | 0.542 | S | S | . | . | H | α-helix | trans | -65.8 | -39.1 | 174.7 | 167.1 | 0 | 0 | 0 | 0 | 111.8 | N116 T117 V118 T124 | N116-V120 WeakPolarHBondContact O-CB 3.1Å; N116-V120 VanDerWaalsContact O-CG2 3.25Å; N116-V120 WeakPolarHBondContact O-CG2 3.48Å; N116-V120 PolarHBondContact O-N 3.25Å; T117-V120 PolarHBondContact O-N 2.94Å; V118-V120 VanDerWaalsContact C-N 3.32Å; V118-V120 PolarHBondContact O-N 3.45Å; V120-T124 WeakPolarHBondContact O-CB 3.37Å; V120-T124 WeakPolarHBondContact O-CG2 3.41Å; V120-T124 PolarHBondContact O-N 2.99Å; V120-T124 PolarHBondContact O-OG1 3.28Å |
| 121 | T | 88.6 | Confident | 83.3 | Confident | 71 Ų | 71 | 103.5 Ų | 103.5 | 44% | 0.436 | 54% | 0.541 | S | S | . | . | H | α-helix | trans | -68.3 | -33.1 | 173.6 | 60.5 | 0 | 0 | 0 | 0 | 112.8 | T117 V118 T124 Q125 | T117-T121 WeakPolarHBondContact O-CG2 3.28Å; T117-T121 PolarHBondContact O-N 3.11Å; T117-T121 PolarHBondContact O-OG1 3.19Å; V118-T121 CarbonylContact O-C 3.54Å; V118-T121 PolarHBondContact O-N 2.88Å; V118-T121 VanDerWaalsContact O-N 3.07Å; V118-T121 PolarHBondContact O-OG1 3.48Å; T121-T124 WeakPolarHBondContact CA-OG1 3.38Å; T121-T124 PolarHBondContact O-OG1 3.17Å; T121-Q125 WeakPolarHBondContact O-CB 3.39Å; T121-Q125 VanDerWaalsContact O-CG 3.25Å; T121-Q125 WeakPolarHBondContact O-CG 3.44Å; T121-Q125 PolarHBondContact O-N 3.44Å |
| 122 | E | 87.7 | Confident | 81.7 | Confident | 107 Ų | 107 | 102.8 Ų | 102.8 | 50% | 0.5 | 55% | 0.548 | S | S | . | . | H | α-helix | trans | -70.9 | -45.4 | 174.7 | -173.9 | 169.1 | -156.9 | 0 | 0 | 111.2 | V118 L119 T124 Q125 L126 | V118-E122 PolarHBondContact O-N 3.48Å; L119-E122 PolarHBondContact O-N 3.46Å; E122-T124 PolarHBondContact O-N 3.04Å; E122-Q125 PolarHBondContact O-N 2.89Å; E122-L126 HydrophobicContact CG-CD1 4.09Å; E122-L126 WeakPolarHBondContact O-CB 3.43Å; E122-L126 WeakPolarHBondContact O-CG 3.43Å; E122-L126 PolarHBondContact O-N 2.89Å |
| 123 | L | 81.6 | Confident | 80.6 | Confident | 113 Ų | 113 | 108.3 Ų | 108.3 | 59% | 0.592 | 56% | 0.563 | S | S | * | * | H | α-helix | trans | -62.6 | -42.2 | 177.5 | -139.4 | 174 | 0 | 0 | 0 | 111.3 | L119 L126 R127 | L119-L123 WeakPolarHBondContact O-CB 3.37Å; L119-L123 PolarHBondContact O-N 2.71Å; L123-L126 PolarHBondContact O-N 2.67Å; L123-R127 WeakPolarHBondContact O-CB 3.44Å; L123-R127 PolarHBondContact O-N 2.75Å |
| 124 | T | 83.2 | Confident | 79.9 | Confident | 89 Ų | 89 | 107.3 Ų | 107.3 | 55% | 0.546 | 56% | 0.561 | S | S | . | * | H | α-helix | trans | -67.8 | -37.5 | 174.8 | 47.6 | 0 | 0 | 0 | 0 | 112.6 | V120 T121 E122 G128 | V120-T124 WeakPolarHBondContact O-CB 3.37Å; V120-T124 WeakPolarHBondContact O-CG2 3.41Å; V120-T124 PolarHBondContact O-N 2.99Å; V120-T124 PolarHBondContact O-OG1 3.28Å; T121-T124 WeakPolarHBondContact CA-OG1 3.38Å; T121-T124 PolarHBondContact O-OG1 3.17Å; E122-T124 PolarHBondContact O-N 3.04Å; T124-G128 PolarHBondContact O-N 2.82Å |
| 125 | Q | 81.8 | Confident | 79.4 | Confident | 112 Ų | 112 | 102.5 Ų | 102.5 | 52% | 0.523 | 55% | 0.546 | S | S | . | . | H | α-helix | trans | -66.2 | -34.9 | 172.1 | -80.5 | -176.3 | 52.2 | 0 | 0 | 113.6 | T121 E122 K129 | T121-Q125 WeakPolarHBondContact O-CB 3.39Å; T121-Q125 VanDerWaalsContact O-CG 3.25Å; T121-Q125 WeakPolarHBondContact O-CG 3.44Å; T121-Q125 PolarHBondContact O-N 3.44Å; E122-Q125 PolarHBondContact O-N 2.89Å; Q125-K129 WeakPolarHBondContact O-CD 3.5Å; Q125-K129 VanDerWaalsContact O-CE 3.3Å; Q125-K129 WeakPolarHBondContact O-CE 3.17Å; Q125-K129 VanDerWaalsContact O-CG 3.23Å; Q125-K129 WeakPolarHBondContact O-CG 3.33Å |
| 126 | L | 75.5 | Confident | 78.9 | Confident | 101 Ų | 101 | 101.1 Ų | 101.1 | 53% | 0.529 | 54% | 0.542 | S | S | . | . | H | α-helix | trans | -73.2 | -41.5 | 176 | -72.9 | 170.6 | 0 | 0 | 0 | 111.1 | E122 L123 G128 K129 E130 | E122-L126 HydrophobicContact CG-CD1 4.09Å; E122-L126 WeakPolarHBondContact O-CB 3.43Å; E122-L126 WeakPolarHBondContact O-CG 3.43Å; E122-L126 PolarHBondContact O-N 2.89Å; L123-L126 PolarHBondContact O-N 2.67Å; L126-G128 VanDerWaalsContact C-N 3.29Å; L126-G128 PolarHBondContact O-N 3.39Å; L126-K129 CarbonylContact O-C 3.57Å; L126-K129 WeakPolarHBondContact O-CA 3.19Å; L126-K129 WeakPolarHBondContact O-CB 3.37Å; L126-K129 PolarHBondContact O-N 3.16Å; L126-E130 PolarHBondContact O-N 2.83Å |
| 127 | R | 70.9 | Confident | 78.7 | Confident | 185 Ų | 185 | 99.7 Ų | 99.7 | 70% | 0.698 | 53% | 0.533 | S | S | * | . | H | α-helix | trans | -64.6 | -33.2 | 175.1 | -148.9 | 179.2 | -165.4 | -174.6 | 3.8 | 112.6 | L123 K129 E130 | L123-R127 WeakPolarHBondContact O-CB 3.44Å; L123-R127 PolarHBondContact O-N 2.75Å; R127-K129 PolarHBondContact O-N 3.1Å; R127-E130 VanDerWaalsContact CG-OE2 3.26Å; R127-E130 WeakPolarHBondContact CG-OE2 3.31Å; R127-E130 PolarHBondContact O-N 3.26Å |
| 128 | G | 63.8 | Low | 78.4 | Confident | 72 Ų | 72 | 102 Ų | 102 | 74% | 0.742 | 54% | 0.536 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -70.8 | -3.5 | 168.8 | 0 | 0 | 0 | 0 | 0 | 115.1 | T124 L126 | T124-G128 PolarHBondContact O-N 2.82Å; L126-G128 VanDerWaalsContact C-N 3.29Å; L126-G128 PolarHBondContact O-N 3.39Å |
| 129 | K | 62.7 | Low | 78.3 | Confident | 143 Ų | 143 | 103 Ų | 103 | 62% | 0.622 | 54% | 0.536 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -114.4 | 2.7 | 175.6 | -65.2 | 163 | -167.1 | 165.3 | 0 | 112.5 | Q125 L126 R127 | Q125-K129 WeakPolarHBondContact O-CD 3.5Å; Q125-K129 VanDerWaalsContact O-CE 3.3Å; Q125-K129 WeakPolarHBondContact O-CE 3.17Å; Q125-K129 VanDerWaalsContact O-CG 3.23Å; Q125-K129 WeakPolarHBondContact O-CG 3.33Å; L126-K129 CarbonylContact O-C 3.57Å; L126-K129 WeakPolarHBondContact O-CA 3.19Å; L126-K129 WeakPolarHBondContact O-CB 3.37Å; L126-K129 PolarHBondContact O-N 3.16Å; R127-K129 PolarHBondContact O-N 3.1Å |
| 130 | E | 58.9 | Low | 78.4 | Confident | 124 Ų | 124 | 103.7 Ų | 103.7 | 58% | 0.579 | 54% | 0.536 | S | S | * | . | S | Bend | trans | -63.4 | 157.3 | 169.3 | -74.7 | -171.7 | 136.4 | 0 | 0 | 110.7 | L126 R127 S132 | L126-E130 PolarHBondContact O-N 2.83Å; R127-E130 VanDerWaalsContact CG-OE2 3.26Å; R127-E130 WeakPolarHBondContact CG-OE2 3.31Å; R127-E130 PolarHBondContact O-N 3.26Å; E130-S132 VanDerWaalsContact C-N 3.27Å; E130-S132 PolarHBondContact O-N 2.93Å |
| 131 | P | 59.5 | Low | 78.6 | Confident | 94 Ų | 94 | 105.3 Ų | 105.3 | 61% | 0.61 | 54% | 0.539 | S | S | * | . | S | Bend | trans | -84.4 | 39.1 | -137.9 | 33.4 | -38.9 | 0 | 0 | 0 | 116.1 | R133 L134 G135 | P131-R133 VanDerWaalsContact C-N 3.31Å; P131-R133 PolarHBondContact O-N 3.42Å; P131-L134 HydrophobicContact CB-CB 4.3Å; P131-L134 PolarHBondContact O-N 3.46Å; P131-G135 PolarHBondContact O-N 3.17Å; P131-G135 VanDerWaalsContact O-N 3.16Å |
| 132 | S | 62.6 | Low | 78.9 | Confident | 79 Ų | 79 | 106.1 Ų | 106.1 | 55% | 0.552 | 54% | 0.54 | S | S | * | . | H | α-helix | trans | -48.3 | -54 | 175.6 | -170.2 | 0 | 0 | 0 | 0 | 110.8 | E130 L134 G135 D136 | E130-S132 VanDerWaalsContact C-N 3.27Å; E130-S132 PolarHBondContact O-N 2.93Å; S132-L134 PolarHBondContact O-N 2.95Å; S132-G135 CarbonylContact O-C 3.54Å; S132-G135 WeakPolarHBondContact O-CA 3.43Å; S132-G135 PolarHBondContact O-N 3.33Å; S132-D136 PolarHBondContact O-N 3.47Å; S132-D136 PolarHBondContact OG-OD2 3Å |
| 133 | R | 70.4 | Confident | 79.3 | Confident | 203 Ų | 203 | 107.2 Ų | 107.2 | 77% | 0.766 | 54% | 0.539 | S | S | * | . | H | α-helix | trans | -53.5 | -32.2 | -178.8 | -174.6 | 178.2 | 179.3 | -166.7 | -0.4 | 114 | P131 D136 I137 | P131-R133 VanDerWaalsContact C-N 3.31Å; P131-R133 PolarHBondContact O-N 3.42Å; R133-D136 WeakPolarHBondContact CA-OD2 3.34Å; R133-D136 PolarHBondContact N-OD2 2.78Å; R133-I137 HydrophobicContact CG-CD1 4.29Å; R133-I137 WeakPolarHBondContact O-CD1 3.4Å; R133-I137 VanDerWaalsContact O-CG1 3.22Å; R133-I137 WeakPolarHBondContact O-CG1 3.4Å; R133-I137 PolarHBondContact O-N 3.49Å; R133-I137 VanDerWaalsContact O-N 3.15Å |
| 134 | L | 77.6 | Confident | 80.1 | Confident | 93 Ų | 93 | 104.8 Ų | 104.8 | 49% | 0.487 | 53% | 0.525 | S | S | . | . | H | α-helix | trans | -77.4 | -39.5 | 176.9 | -177.6 | 61.4 | 0 | 0 | 0 | 111.2 | P131 S132 D136 F138 | P131-L134 HydrophobicContact CB-CB 4.3Å; P131-L134 PolarHBondContact O-N 3.46Å; S132-L134 PolarHBondContact O-N 2.95Å; L134-D136 VanDerWaalsContact C-N 3.34Å; L134-F138 HydrophobicContact CD1-CD2 4.12Å; L134-F138 HydrophobicContact CD1-CE2 3.58Å; L134-F138 HydrophobicContact CD1-CZ 3.95Å; L134-F138 HydrophobicContact CD2-CE2 4.11Å; L134-F138 HydrophobicContact CG-CD2 3.96Å; L134-F138 HydrophobicContact CG-CE2 3.58Å; L134-F138 HydrophobicContact CG-CZ 4.42Å; L134-F138 WeakPolarHBondContact O-CD2 3.4Å; L134-F138 PolarHBondContact O-N 3.36Å |
| 135 | G | 83.4 | Confident | 80.7 | Confident | 30 Ų | 30 | 104.9 Ų | 104.9 | 31% | 0.309 | 52% | 0.522 | S | S | . | . | H | α-helix | trans | -62.7 | -38.9 | 169.7 | 0 | 0 | 0 | 0 | 0 | 112.8 | P131 S132 F138 Q139 | P131-G135 PolarHBondContact O-N 3.17Å; P131-G135 VanDerWaalsContact O-N 3.16Å; S132-G135 CarbonylContact O-C 3.54Å; S132-G135 WeakPolarHBondContact O-CA 3.43Å; S132-G135 PolarHBondContact O-N 3.33Å; G135-F138 PolarHBondContact O-N 2.84Å; G135-Q139 WeakPolarHBondContact O-CB 3.49Å; G135-Q139 VanDerWaalsContact O-CG 3.29Å; G135-Q139 WeakPolarHBondContact O-CG 3.31Å; G135-Q139 PolarHBondContact O-N 3.22Å |
| 136 | D | 85.6 | Confident | 81.5 | Confident | 64 Ų | 64 | 106.8 Ų | 106.8 | 34% | 0.342 | 52% | 0.524 | S | S | . | . | H | α-helix | trans | -63.5 | -46 | 178.1 | -61.1 | -42.4 | 0 | 0 | 0 | 110.7 | S132 R133 L134 Q139 E140 | S132-D136 PolarHBondContact O-N 3.47Å; S132-D136 PolarHBondContact OG-OD2 3Å; R133-D136 WeakPolarHBondContact CA-OD2 3.34Å; R133-D136 PolarHBondContact N-OD2 2.78Å; L134-D136 VanDerWaalsContact C-N 3.34Å; D136-Q139 PolarHBondContact O-N 2.97Å; D136-E140 WeakPolarHBondContact O-CG 3.47Å; D136-E140 PolarHBondContact O-N 3.47Å |
| 137 | I | 86.9 | Confident | 82.5 | Confident | 70 Ų | 70 | 109.1 Ų | 109.1 | 36% | 0.359 | 53% | 0.526 | S | S | . | . | H | α-helix | trans | -60.7 | -48.5 | 172.9 | -69.3 | 163.2 | 0 | 0 | 0 | 111.1 | R133 Q139 E140 E141 | R133-I137 HydrophobicContact CG-CD1 4.29Å; R133-I137 WeakPolarHBondContact O-CD1 3.4Å; R133-I137 VanDerWaalsContact O-CG1 3.22Å; R133-I137 WeakPolarHBondContact O-CG1 3.4Å; R133-I137 PolarHBondContact O-N 3.49Å; R133-I137 VanDerWaalsContact O-N 3.15Å; I137-Q139 PolarHBondContact O-N 2.9Å; I137-E140 WeakPolarHBondContact O-CB 3.23Å; I137-E140 PolarHBondContact O-N 3.19Å; I137-E141 WeakPolarHBondContact O-CG 3.18Å; I137-E141 PolarHBondContact O-N 3.41Å |
| 138 | F | 88.9 | Confident | 83.8 | Confident | 135 Ų | 135 | 104.8 Ų | 104.8 | 59% | 0.592 | 51% | 0.514 | S | S | * | . | H | α-helix | trans | -64.6 | -28.5 | 178.1 | -72.8 | -47.7 | 0 | 0 | 0 | 113.1 | L134 G135 L142 | L134-F138 HydrophobicContact CD1-CD2 4.12Å; L134-F138 HydrophobicContact CD1-CE2 3.58Å; L134-F138 HydrophobicContact CD1-CZ 3.95Å; L134-F138 HydrophobicContact CD2-CE2 4.11Å; L134-F138 HydrophobicContact CG-CD2 3.96Å; L134-F138 HydrophobicContact CG-CE2 3.58Å; L134-F138 HydrophobicContact CG-CZ 4.42Å; L134-F138 WeakPolarHBondContact O-CD2 3.4Å; L134-F138 PolarHBondContact O-N 3.36Å; G135-F138 PolarHBondContact O-N 2.84Å; F138-L142 WeakPolarHBondContact O-CB 3.42Å; F138-L142 PolarHBondContact O-N 3.34Å |
| 139 | Q | 92.5 | Very high | 85.4 | Confident | 102 Ų | 102 | 105.5 Ų | 105.5 | 48% | 0.477 | 50% | 0.503 | S | S | . | . | H | α-helix | trans | -74.3 | -32.4 | 170.7 | -72.2 | 177.6 | 41.2 | 0 | 0 | 112.9 | G135 D136 I137 R143 | G135-Q139 WeakPolarHBondContact O-CB 3.49Å; G135-Q139 VanDerWaalsContact O-CG 3.29Å; G135-Q139 WeakPolarHBondContact O-CG 3.31Å; G135-Q139 PolarHBondContact O-N 3.22Å; D136-Q139 PolarHBondContact O-N 2.97Å; I137-Q139 PolarHBondContact O-N 2.9Å; Q139-R143 VanDerWaalsContact CB-NH2 3.28Å; Q139-R143 WeakPolarHBondContact O-CB 3.42Å; Q139-R143 VanDerWaalsContact O-CG 3.25Å; Q139-R143 WeakPolarHBondContact O-CG 3.14Å; Q139-R143 PolarHBondContact O-N 2.91Å; Q139-R143 PolarHBondContact O-NE 2.93Å |
| 140 | E | 93.3 | Very high | 87.1 | Confident | 114 Ų | 114 | 103.7 Ų | 103.7 | 53% | 0.533 | 50% | 0.5 | S | S | . | . | H | α-helix | trans | -65.6 | -50.3 | 173.1 | -78.8 | 171.8 | 177.5 | 0 | 0 | 111 | D136 I137 L142 R143 E144 | D136-E140 WeakPolarHBondContact O-CG 3.47Å; D136-E140 PolarHBondContact O-N 3.47Å; I137-E140 WeakPolarHBondContact O-CB 3.23Å; I137-E140 PolarHBondContact O-N 3.19Å; E140-L142 VanDerWaalsContact C-N 3.34Å; E140-L142 PolarHBondContact O-N 3.3Å; E140-R143 PolarHBondContact O-N 3Å; E140-R143 VanDerWaalsContact O-N 3.13Å; E140-E144 PolarHBondContact O-N 2.69Å |
| 141 | E | 94.8 | Very high | 89 | Confident | 111 Ų | 111 | 100 Ų | 100 | 52% | 0.519 | 50% | 0.496 | S | S | . | . | H | α-helix | trans | -56.7 | -46.2 | 172.4 | -66.2 | -63.8 | 160.7 | 0 | 0 | 111.3 | I137 R143 E144 L145 | I137-E141 WeakPolarHBondContact O-CG 3.18Å; I137-E141 PolarHBondContact O-N 3.41Å; E141-R143 VanDerWaalsContact C-N 3.31Å; E141-R143 PolarHBondContact O-N 3.15Å; E141-E144 PolarHBondContact O-N 2.9Å; E141-L145 WeakPolarHBondContact O-CB 3.37Å; E141-L145 VanDerWaalsContact O-CD1 3.3Å; E141-L145 WeakPolarHBondContact O-CD1 3.49Å; E141-L145 PolarHBondContact O-N 2.83Å |
| 142 | L | 95.4 | Very high | 90.8 | Very high | 88 Ų | 88 | 101.7 Ų | 101.7 | 46% | 0.461 | 50% | 0.499 | S | S | . | . | H | α-helix | trans | -65 | -31.7 | 177.9 | -176.9 | 62.2 | 0 | 0 | 0 | 113 | F138 E140 R146 | F138-L142 WeakPolarHBondContact O-CB 3.42Å; F138-L142 PolarHBondContact O-N 3.34Å; E140-L142 VanDerWaalsContact C-N 3.34Å; E140-L142 PolarHBondContact O-N 3.3Å; L142-R146 WeakPolarHBondContact O-CB 3.27Å; L142-R146 WeakPolarHBondContact O-CD 3.44Å; L142-R146 WeakPolarHBondContact O-CG 3.35Å; L142-R146 PolarHBondContact O-N 2.89Å |
| 143 | R | 96.8 | Very high | 92.5 | Very high | 129 Ų | 129 | 101.1 Ų | 101.1 | 49% | 0.487 | 50% | 0.495 | S | S | . | . | H | α-helix | trans | -71.6 | -40.6 | 173.7 | -80.9 | 178.7 | -109.1 | 117.6 | -4 | 111.4 | Q139 E140 E141 R146 R147 | Q139-R143 VanDerWaalsContact CB-NH2 3.28Å; Q139-R143 WeakPolarHBondContact O-CB 3.42Å; Q139-R143 VanDerWaalsContact O-CG 3.25Å; Q139-R143 WeakPolarHBondContact O-CG 3.14Å; Q139-R143 PolarHBondContact O-N 2.91Å; Q139-R143 PolarHBondContact O-NE 2.93Å; E140-R143 PolarHBondContact O-N 3Å; E140-R143 VanDerWaalsContact O-N 3.13Å; E141-R143 VanDerWaalsContact C-N 3.31Å; E141-R143 PolarHBondContact O-N 3.15Å; R143-R146 PolarHBondContact O-N 2.83Å; R143-R147 WeakPolarHBondContact O-CB 3.34Å; R143-R147 PolarHBondContact O-N 2.85Å |
| 144 | E | 97.1 | Very high | 93.8 | Very high | 62 Ų | 62 | 94.5 Ų | 94.5 | 29% | 0.29 | 48% | 0.484 | S | S | . | . | H | α-helix | trans | -69.7 | -43.2 | 177.4 | 177.6 | 53.3 | -156 | 0 | 0 | 112.1 | E140 E141 R146 R147 Q148 | E140-E144 PolarHBondContact O-N 2.69Å; E141-E144 PolarHBondContact O-N 2.9Å; E144-R146 VanDerWaalsContact C-N 3.3Å; E144-R146 PolarHBondContact O-N 3.36Å; E144-R147 WeakPolarHBondContact O-CB 3.48Å; E144-R147 PolarHBondContact O-N 3.46Å; E144-R147 VanDerWaalsContact O-N 3.17Å; E144-R147 IonicContact OE1-CZ 3.79Å; E144-R147 IonicContact OE1-NE 2.76Å; E144-R147 IonicContact OE1-NH2 2.63Å; E144-R147 PolarHBondContact OE1-NH2 3.02Å; E144-R147 IonicContact OE2-CZ 3.86Å; E144-R147 IonicContact OE2-NE 2.92Å; E144-R147 PolarHBondContact OE2-NE 2.88Å; E144-R147 IonicContact OE2-NH2 3.69Å; E144-R147 PolarHBondContact OE2-NH2 3.29Å; E144-Q148 WeakPolarHBondContact O-CG 3.42Å; E144-Q148 PolarHBondContact O-N 3.06Å; E144-Q148 WeakPolarHBondContact OE1-CG 3.47Å; E144-Q148 PolarHBondContact OE1-NE2 3.08Å |
| 145 | L | 96.7 | Very high | 94.8 | Very high | 92 Ų | 92 | 91.7 Ų | 91.7 | 48% | 0.482 | 48% | 0.477 | S | S | . | . | H | α-helix | trans | -58.9 | -40.6 | 172.6 | -95.3 | 69.7 | 0 | 0 | 0 | 111.8 | E141 Q148 V149 | E141-L145 WeakPolarHBondContact O-CB 3.37Å; E141-L145 VanDerWaalsContact O-CD1 3.3Å; E141-L145 WeakPolarHBondContact O-CD1 3.49Å; E141-L145 PolarHBondContact O-N 2.83Å; L145-Q148 PolarHBondContact O-N 2.74Å; L145-V149 WeakPolarHBondContact O-CG2 3.35Å; L145-V149 PolarHBondContact O-N 2.91Å |
| 146 | R | 97.6 | Very high | 95.5 | Very high | 151 Ų | 151 | 96.1 Ų | 96.1 | 57% | 0.57 | 49% | 0.488 | S | S | * | . | H | α-helix | trans | -61.9 | -49.1 | 173.3 | -75.6 | 167.6 | -175.3 | -81.3 | -1.2 | 111.3 | L142 R143 E144 Q148 V149 D150 | L142-R146 WeakPolarHBondContact O-CB 3.27Å; L142-R146 WeakPolarHBondContact O-CD 3.44Å; L142-R146 WeakPolarHBondContact O-CG 3.35Å; L142-R146 PolarHBondContact O-N 2.89Å; R143-R146 PolarHBondContact O-N 2.83Å; E144-R146 VanDerWaalsContact C-N 3.3Å; E144-R146 PolarHBondContact O-N 3.36Å; R146-Q148 PolarHBondContact O-N 3.13Å; R146-V149 PolarHBondContact O-N 3.37Å; R146-D150 PolarHBondContact O-N 3.18Å |
| 147 | R | 97.8 | Very high | 96 | Very high | 151 Ų | 151 | 95.2 Ų | 95.2 | 57% | 0.57 | 49% | 0.489 | S | S | * | . | H | α-helix | trans | -57.5 | -35.5 | 176.8 | -165.1 | -168.8 | 68.9 | 76.2 | 4.2 | 112.5 | R143 E144 G151 | R143-R147 WeakPolarHBondContact O-CB 3.34Å; R143-R147 PolarHBondContact O-N 2.85Å; E144-R147 WeakPolarHBondContact O-CB 3.48Å; E144-R147 PolarHBondContact O-N 3.46Å; E144-R147 VanDerWaalsContact O-N 3.17Å; E144-R147 IonicContact OE1-CZ 3.79Å; E144-R147 IonicContact OE1-NE 2.76Å; E144-R147 IonicContact OE1-NH2 2.63Å; E144-R147 PolarHBondContact OE1-NH2 3.02Å; E144-R147 IonicContact OE2-CZ 3.86Å; E144-R147 IonicContact OE2-NE 2.92Å; E144-R147 PolarHBondContact OE2-NE 2.88Å; E144-R147 IonicContact OE2-NH2 3.69Å; E144-R147 PolarHBondContact OE2-NH2 3.29Å; R147-G151 PolarHBondContact O-N 3.46Å |
| 148 | Q | 97.8 | Very high | 96.6 | Very high | 94 Ų | 94 | 99.6 Ų | 99.6 | 44% | 0.439 | 50% | 0.501 | S | S | . | . | H | α-helix | trans | -70.6 | -43.7 | 174 | -70.2 | 175.5 | 20.2 | 0 | 0 | 112.1 | E144 L145 R146 G151 L152 | E144-Q148 WeakPolarHBondContact O-CG 3.42Å; E144-Q148 PolarHBondContact O-N 3.06Å; E144-Q148 WeakPolarHBondContact OE1-CG 3.47Å; E144-Q148 PolarHBondContact OE1-NE2 3.08Å; L145-Q148 PolarHBondContact O-N 2.74Å; R146-Q148 PolarHBondContact O-N 3.13Å; Q148-G151 PolarHBondContact O-N 3.12Å; Q148-L152 WeakPolarHBondContact O-CB 3.31Å; Q148-L152 VanDerWaalsContact O-CG 3.26Å; Q148-L152 WeakPolarHBondContact O-CG 3.33Å; Q148-L152 PolarHBondContact O-N 3.3Å |
| 149 | V | 97.9 | Very high | 96.9 | Very high | 86 Ų | 86 | 98.6 Ų | 98.6 | 52% | 0.521 | 50% | 0.501 | S | S | . | . | H | α-helix | trans | -61.5 | -43.8 | 174.2 | 168.8 | 0 | 0 | 0 | 0 | 111.5 | L145 R146 L152 S153 | L145-V149 WeakPolarHBondContact O-CG2 3.35Å; L145-V149 PolarHBondContact O-N 2.91Å; R146-V149 PolarHBondContact O-N 3.37Å; V149-L152 PolarHBondContact O-N 2.78Å; V149-S153 VanDerWaalsContact O-CB 3.29Å; V149-S153 WeakPolarHBondContact O-CB 3.22Å; V149-S153 PolarHBondContact O-N 2.95Å; V149-S153 PolarHBondContact O-OG 3.46Å |
| 150 | D | 97.9 | Very high | 97.1 | Very high | 105 Ų | 105 | 98.1 Ų | 98.1 | 56% | 0.561 | 50% | 0.499 | S | S | * | . | H | α-helix | trans | -63.6 | -44.7 | 177.2 | -63 | -30.2 | 0 | 0 | 0 | 110.8 | R146 S153 A154 | R146-D150 PolarHBondContact O-N 3.18Å; D150-S153 PolarHBondContact O-N 3.4Å; D150-A154 WeakPolarHBondContact O-CB 3.47Å; D150-A154 PolarHBondContact O-N 3.4Å |
| 151 | G | 98.2 | Very high | 97.4 | Very high | 47 Ų | 47 | 97.7 Ų | 97.7 | 49% | 0.485 | 50% | 0.5 | S | S | . | . | H | α-helix | trans | -64.2 | -41.7 | 176.6 | 0 | 0 | 0 | 0 | 0 | 113.6 | R147 Q148 G155 | R147-G151 PolarHBondContact O-N 3.46Å; Q148-G151 PolarHBondContact O-N 3.12Å; G151-G155 PolarHBondContact O-N 3.15Å |
| 152 | L | 97.8 | Very high | 97.4 | Very high | 130 Ų | 130 | 96.1 Ų | 96.1 | 68% | 0.681 | 49% | 0.492 | S | S | * | . | H | α-helix | trans | -67.2 | -36.3 | 173.7 | -73.2 | 170.4 | 0 | 0 | 0 | 111.8 | Q148 V149 G155 K156 | Q148-L152 WeakPolarHBondContact O-CB 3.31Å; Q148-L152 VanDerWaalsContact O-CG 3.26Å; Q148-L152 WeakPolarHBondContact O-CG 3.33Å; Q148-L152 PolarHBondContact O-N 3.3Å; V149-L152 PolarHBondContact O-N 2.78Å; L152-G155 PolarHBondContact O-N 2.87Å; L152-K156 VanDerWaalsContact O-CB 3.27Å; L152-K156 WeakPolarHBondContact O-CB 3.3Å; L152-K156 PolarHBondContact O-N 2.92Å |
| 153 | S | 97.9 | Very high | 97.4 | Very high | 67 Ų | 67 | 99.9 Ų | 99.9 | 47% | 0.469 | 50% | 0.5 | S | S | . | . | H | α-helix | trans | -68.9 | -42.8 | 177.5 | -58.9 | 0 | 0 | 0 | 0 | 111.7 | V149 D150 K156 A157 | V149-S153 VanDerWaalsContact O-CB 3.29Å; V149-S153 WeakPolarHBondContact O-CB 3.22Å; V149-S153 PolarHBondContact O-N 2.95Å; V149-S153 PolarHBondContact O-OG 3.46Å; D150-S153 PolarHBondContact O-N 3.4Å; S153-K156 PolarHBondContact O-N 3.02Å; S153-A157 WeakPolarHBondContact O-CB 3.46Å; S153-A157 PolarHBondContact O-N 2.93Å |
| 154 | A | 98.1 | Very high | 97.4 | Very high | 64 Ų | 64 | 97.7 Ų | 97.7 | 53% | 0.529 | 50% | 0.498 | S | S | . | . | H | α-helix | trans | -65.3 | -40.4 | 173 | 0 | 0 | 0 | 0 | 0 | 112.1 | D150 R158 | D150-A154 WeakPolarHBondContact O-CB 3.47Å; D150-A154 PolarHBondContact O-N 3.4Å; A154-R158 WeakPolarHBondContact O-CB 3.42Å; A154-R158 PolarHBondContact O-N 3.48Å |
| 155 | G | 98.2 | Very high | 97.3 | Very high | 33 Ų | 33 | 99.2 Ų | 99.2 | 34% | 0.34 | 51% | 0.508 | S | S | . | . | H | α-helix | trans | -62.3 | -43.5 | 173.8 | 0 | 0 | 0 | 0 | 0 | 112.6 | G151 L152 R158 L159 | G151-G155 PolarHBondContact O-N 3.15Å; L152-G155 PolarHBondContact O-N 2.87Å; G155-R158 PolarHBondContact O-N 3.47Å; G155-L159 WeakPolarHBondContact O-CG 3.4Å; G155-L159 PolarHBondContact O-N 2.96Å |
| 156 | K | 97.8 | Very high | 97 | Very high | 124 Ų | 124 | 100.9 Ų | 100.9 | 54% | 0.539 | 52% | 0.515 | S | S | . | . | H | α-helix | trans | -60.3 | -53.7 | 174.3 | -179.5 | -171.9 | 160.6 | -176 | 0 | 111.2 | L152 S153 R158 L159 E160 | L152-K156 VanDerWaalsContact O-CB 3.27Å; L152-K156 WeakPolarHBondContact O-CB 3.3Å; L152-K156 PolarHBondContact O-N 2.92Å; S153-K156 PolarHBondContact O-N 3.02Å; K156-R158 PolarHBondContact O-N 3.11Å; K156-L159 CarbonylContact O-C 3.55Å; K156-L159 PolarHBondContact O-N 2.9Å; K156-E160 WeakPolarHBondContact CE-OE1 3.4Å; K156-E160 VanDerWaalsContact CE-OE2 3.29Å; K156-E160 WeakPolarHBondContact CE-OE2 3.43Å; K156-E160 HydrophobicContact CG-CG 4.43Å; K156-E160 IonicContact NZ-OE1 2.67Å; K156-E160 PolarHBondContact NZ-OE1 3.14Å; K156-E160 WeakPolarHBondContact O-CG 3.39Å; K156-E160 PolarHBondContact O-N 3.22Å |
| 157 | A | 97.1 | Very high | 96.8 | Very high | 45 Ų | 45 | 95.8 Ų | 95.8 | 37% | 0.372 | 51% | 0.505 | S | S | . | . | H | α-helix | trans | -59 | -37.2 | -179 | 0 | 0 | 0 | 0 | 0 | 112.2 | S153 E160 I161 | S153-A157 WeakPolarHBondContact O-CB 3.46Å; S153-A157 PolarHBondContact O-N 2.93Å; A157-E160 PolarHBondContact O-N 3.18Å; A157-I161 WeakPolarHBondContact O-CG1 3.23Å; A157-I161 PolarHBondContact O-N 2.96Å; A157-I161 VanDerWaalsContact O-N 3.1Å |
| 158 | R | 98.2 | Very high | 96.7 | Very high | 162 Ų | 162 | 91 Ų | 91 | 61% | 0.611 | 50% | 0.498 | S | S | * | . | H | α-helix | trans | -63.5 | -45.8 | 172.3 | 178.2 | 179.1 | 167.8 | 173.9 | -2.4 | 112.3 | A154 G155 K156 E160 I161 E162 | A154-R158 WeakPolarHBondContact O-CB 3.42Å; A154-R158 PolarHBondContact O-N 3.48Å; G155-R158 PolarHBondContact O-N 3.47Å; K156-R158 PolarHBondContact O-N 3.11Å; R158-E160 VanDerWaalsContact C-N 3.31Å; R158-E160 PolarHBondContact O-N 3.19Å; R158-I161 PolarHBondContact O-N 2.64Å; R158-E162 IonicContact CZ-OE1 2.88Å; R158-E162 IonicContact NE-OE1 2.64Å; R158-E162 PolarHBondContact NE-OE1 2.87Å; R158-E162 IonicContact NH2-OE1 3.64Å; R158-E162 PolarHBondContact NH2-OE1 3.21Å; R158-E162 WeakPolarHBondContact O-CG 3.46Å; R158-E162 PolarHBondContact O-N 3.04Å |
| 159 | L | 96.1 | Very high | 96.5 | Very high | 114 Ų | 114 | 90.9 Ų | 90.9 | 60% | 0.597 | 50% | 0.501 | S | S | * | . | H | α-helix | trans | -66.9 | -31.5 | 178.5 | -72.5 | 170.5 | 0 | 0 | 0 | 112.5 | G155 K156 R163 | G155-L159 WeakPolarHBondContact O-CG 3.4Å; G155-L159 PolarHBondContact O-N 2.96Å; K156-L159 CarbonylContact O-C 3.55Å; K156-L159 PolarHBondContact O-N 2.9Å; L159-R163 WeakPolarHBondContact O-CB 3.38Å; L159-R163 PolarHBondContact O-N 2.87Å |
| 160 | E | 97.4 | Very high | 96.2 | Very high | 91 Ų | 91 | 90.3 Ų | 90.3 | 43% | 0.425 | 50% | 0.497 | S | S | . | . | H | α-helix | trans | -65.1 | -46.3 | 172.3 | -72.5 | 171.5 | 142.3 | 0 | 0 | 110.7 | K156 A157 R158 R163 D164 | K156-E160 WeakPolarHBondContact CE-OE1 3.4Å; K156-E160 VanDerWaalsContact CE-OE2 3.29Å; K156-E160 WeakPolarHBondContact CE-OE2 3.43Å; K156-E160 HydrophobicContact CG-CG 4.43Å; K156-E160 IonicContact NZ-OE1 2.67Å; K156-E160 PolarHBondContact NZ-OE1 3.14Å; K156-E160 WeakPolarHBondContact O-CG 3.39Å; K156-E160 PolarHBondContact O-N 3.22Å; A157-E160 PolarHBondContact O-N 3.18Å; R158-E160 VanDerWaalsContact C-N 3.31Å; R158-E160 PolarHBondContact O-N 3.19Å; E160-R163 PolarHBondContact O-N 2.93Å; E160-D164 WeakPolarHBondContact O-CB 3.4Å; E160-D164 PolarHBondContact O-N 2.9Å |
| 161 | I | 97.8 | Very high | 95.9 | Very high | 106 Ų | 106 | 88 Ų | 88 | 54% | 0.544 | 49% | 0.493 | S | S | . | . | H | α-helix | trans | -61.8 | -45.1 | 173.7 | -66.1 | 163.2 | 0 | 0 | 0 | 111.8 | A157 R158 R163 D164 N165 | A157-I161 WeakPolarHBondContact O-CG1 3.23Å; A157-I161 PolarHBondContact O-N 2.96Å; A157-I161 VanDerWaalsContact O-N 3.1Å; R158-I161 PolarHBondContact O-N 2.64Å; I161-R163 VanDerWaalsContact C-N 3.32Å; I161-R163 PolarHBondContact O-N 2.86Å; I161-D164 PolarHBondContact O-N 2.67Å; I161-N165 WeakPolarHBondContact O-CB 3.44Å; I161-N165 VanDerWaalsContact O-CG 3.24Å; I161-N165 PolarHBondContact O-N 2.84Å; I161-N165 PolarHBondContact O-ND2 3.35Å; I161-N165 VanDerWaalsContact O-ND2 3.16Å |
| 162 | E | 95.6 | Very high | 95.7 | Very high | 77 Ų | 77 | 88.7 Ų | 88.7 | 36% | 0.36 | 49% | 0.487 | S | S | . | . | H | α-helix | trans | -63 | -38.1 | 176.8 | -74.1 | 177.5 | -177.7 | 0 | 0 | 111.7 | R158 M166 | R158-E162 IonicContact CZ-OE1 2.88Å; R158-E162 IonicContact NE-OE1 2.64Å; R158-E162 PolarHBondContact NE-OE1 2.87Å; R158-E162 IonicContact NH2-OE1 3.64Å; R158-E162 PolarHBondContact NH2-OE1 3.21Å; R158-E162 WeakPolarHBondContact O-CG 3.46Å; R158-E162 PolarHBondContact O-N 3.04Å; E162-M166 WeakPolarHBondContact O-CB 3.31Å; E162-M166 WeakPolarHBondContact O-CG 3.35Å; E162-M166 PolarHBondContact O-N 3.42Å; E162-M166 VanDerWaalsContact O-N 3.13Å |
| 163 | R | 94.9 | Very high | 95.2 | Very high | 168 Ų | 168 | 87.4 Ų | 87.4 | 63% | 0.634 | 48% | 0.481 | S | S | * | . | H | α-helix | trans | -65.1 | -43.9 | 174.1 | 177.5 | -86.5 | -179.7 | -177.8 | -1.1 | 112.2 | L159 E160 I161 M166 A167 | L159-R163 WeakPolarHBondContact O-CB 3.38Å; L159-R163 PolarHBondContact O-N 2.87Å; E160-R163 PolarHBondContact O-N 2.93Å; I161-R163 VanDerWaalsContact C-N 3.32Å; I161-R163 PolarHBondContact O-N 2.86Å; R163-M166 PolarHBondContact O-N 3.19Å; R163-A167 WeakPolarHBondContact O-CB 3.41Å; R163-A167 PolarHBondContact O-N 3.07Å |
| 164 | D | 97.1 | Very high | 94.8 | Very high | 83 Ų | 83 | 90.9 Ų | 90.9 | 44% | 0.444 | 49% | 0.487 | S | S | . | . | H | α-helix | trans | -73.1 | -35.9 | -175.9 | -72.9 | -14.2 | 0 | 0 | 0 | 111.8 | E160 I161 A167 A168 | E160-D164 WeakPolarHBondContact O-CB 3.4Å; E160-D164 PolarHBondContact O-N 2.9Å; I161-D164 PolarHBondContact O-N 2.67Å; D164-A167 PolarHBondContact O-N 3.38Å; D164-A168 PolarHBondContact O-N 3.36Å |
| 165 | N | 94.9 | Very high | 94.4 | Very high | 94 Ų | 94 | 93.6 Ų | 93.6 | 50% | 0.503 | 49% | 0.489 | S | S | . | . | H | α-helix | trans | -58.4 | -49.2 | 167.8 | -71.2 | -29.7 | 0 | 0 | 0 | 111.3 | I161 A167 A168 D169 | I161-N165 WeakPolarHBondContact O-CB 3.44Å; I161-N165 VanDerWaalsContact O-CG 3.24Å; I161-N165 PolarHBondContact O-N 2.84Å; I161-N165 PolarHBondContact O-ND2 3.35Å; I161-N165 VanDerWaalsContact O-ND2 3.16Å; N165-A167 VanDerWaalsContact C-N 3.27Å; N165-A167 PolarHBondContact O-N 2.93Å; N165-A168 WeakPolarHBondContact O-CB 3.42Å; N165-A168 PolarHBondContact O-N 3.25Å; N165-A168 VanDerWaalsContact O-N 3.14Å; N165-D169 PolarHBondContact O-N 2.97Å |
| 166 | M | 91.8 | Very high | 94 | Very high | 127 Ų | 127 | 99.9 Ų | 99.9 | 63% | 0.626 | 50% | 0.502 | S | S | * | . | H | α-helix | trans | -63.4 | -32.2 | 177.3 | -68.4 | -76.9 | 165.7 | 0 | 0 | 112.4 | E162 R163 V170 | E162-M166 WeakPolarHBondContact O-CB 3.31Å; E162-M166 WeakPolarHBondContact O-CG 3.35Å; E162-M166 PolarHBondContact O-N 3.42Å; E162-M166 VanDerWaalsContact O-N 3.13Å; R163-M166 PolarHBondContact O-N 3.19Å; M166-V170 WeakPolarHBondContact O-CB 3.42Å; M166-V170 VanDerWaalsContact O-CG2 3.26Å; M166-V170 WeakPolarHBondContact O-CG2 3.3Å; M166-V170 PolarHBondContact O-N 3.44Å |
| 167 | A | 93.3 | Very high | 93.5 | Very high | 43 Ų | 43 | 99.2 Ų | 99.2 | 36% | 0.355 | 50% | 0.504 | S | S | . | . | H | α-helix | trans | -68.5 | -39 | 174.1 | 0 | 0 | 0 | 0 | 0 | 112.1 | R163 D164 N165 A171 | R163-A167 WeakPolarHBondContact O-CB 3.41Å; R163-A167 PolarHBondContact O-N 3.07Å; D164-A167 PolarHBondContact O-N 3.38Å; N165-A167 VanDerWaalsContact C-N 3.27Å; N165-A167 PolarHBondContact O-N 2.93Å; A167-A171 WeakPolarHBondContact O-CB 3.43Å; A167-A171 PolarHBondContact O-N 3.08Å |
| 168 | A | 94.9 | Very high | 93.1 | Very high | 52 Ų | 52 | 103.5 Ų | 103.5 | 43% | 0.43 | 52% | 0.517 | S | S | . | . | H | α-helix | trans | -66.8 | -43.6 | 173.7 | 0 | 0 | 0 | 0 | 0 | 112.1 | D164 N165 V170 A171 T172 | D164-A168 PolarHBondContact O-N 3.36Å; N165-A168 WeakPolarHBondContact O-CB 3.42Å; N165-A168 PolarHBondContact O-N 3.25Å; N165-A168 VanDerWaalsContact O-N 3.14Å; A168-V170 PolarHBondContact O-N 3.12Å; A168-A171 WeakPolarHBondContact O-CB 3.38Å; A168-A171 PolarHBondContact O-N 2.87Å; A168-A171 VanDerWaalsContact O-N 3.14Å; A168-T172 WeakPolarHBondContact O-CG2 3.18Å; A168-T172 PolarHBondContact O-N 2.71Å |
| 169 | D | 93.4 | Very high | 92.6 | Very high | 91 Ų | 91 | 99.6 Ų | 99.6 | 49% | 0.487 | 51% | 0.508 | S | S | . | . | H | α-helix | trans | -59.2 | -46.7 | 173.9 | -77.3 | -25.3 | 0 | 0 | 0 | 111.1 | N165 A171 T172 L173 | N165-D169 PolarHBondContact O-N 2.97Å; D169-A171 VanDerWaalsContact C-N 3.29Å; D169-A171 PolarHBondContact O-N 2.99Å; D169-T172 PolarHBondContact O-N 2.93Å; D169-T172 PolarHBondContact O-OG1 2.85Å; D169-T172 VanDerWaalsContact O-OG1 3.07Å; D169-L173 WeakPolarHBondContact O-CB 3.2Å; D169-L173 VanDerWaalsContact O-CG 3.29Å; D169-L173 WeakPolarHBondContact O-CG 3.35Å; D169-L173 PolarHBondContact O-N 3.42Å |
| 170 | V | 91.9 | Very high | 92.3 | Very high | 74 Ų | 74 | 100.3 Ų | 100.3 | 45% | 0.448 | 51% | 0.508 | S | S | . | . | H | α-helix | trans | -61.8 | -35.3 | 174.9 | 167.4 | 0 | 0 | 0 | 0 | 112.2 | M166 A168 K174 | M166-V170 WeakPolarHBondContact O-CB 3.42Å; M166-V170 VanDerWaalsContact O-CG2 3.26Å; M166-V170 WeakPolarHBondContact O-CG2 3.3Å; M166-V170 PolarHBondContact O-N 3.44Å; A168-V170 PolarHBondContact O-N 3.12Å; V170-K174 HydrophobicContact CG1-CD 4.2Å; V170-K174 WeakPolarHBondContact O-CB 3.36Å; V170-K174 VanDerWaalsContact O-CG 3.25Å; V170-K174 WeakPolarHBondContact O-CG 3.34Å; V170-K174 PolarHBondContact O-N 3.21Å |
| 171 | A | 92.4 | Very high | 91.4 | Very high | 57 Ų | 57 | 101.3 Ų | 101.3 | 47% | 0.471 | 51% | 0.514 | S | S | . | . | H | α-helix | trans | -67.5 | -47.1 | 175.5 | 0 | 0 | 0 | 0 | 0 | 112 | A167 A168 D169 L173 K174 Q175 | A167-A171 WeakPolarHBondContact O-CB 3.43Å; A167-A171 PolarHBondContact O-N 3.08Å; A168-A171 WeakPolarHBondContact O-CB 3.38Å; A168-A171 PolarHBondContact O-N 2.87Å; A168-A171 VanDerWaalsContact O-N 3.14Å; D169-A171 VanDerWaalsContact C-N 3.29Å; D169-A171 PolarHBondContact O-N 2.99Å; A171-L173 PolarHBondContact O-N 3.22Å; A171-K174 PolarHBondContact O-N 2.88Å; A171-Q175 PolarHBondContact O-N 3.49Å |
| 172 | T | 92.6 | Very high | 90.9 | Very high | 60 Ų | 60 | 99.8 Ų | 99.8 | 37% | 0.368 | 51% | 0.509 | S | S | . | . | H | α-helix | trans | -67.1 | -34.8 | 178.5 | 64.2 | 0 | 0 | 0 | 0 | 112.6 | A168 D169 Q175 R176 | A168-T172 WeakPolarHBondContact O-CG2 3.18Å; A168-T172 PolarHBondContact O-N 2.71Å; D169-T172 PolarHBondContact O-N 2.93Å; D169-T172 PolarHBondContact O-OG1 2.85Å; D169-T172 VanDerWaalsContact O-OG1 3.07Å; T172-Q175 PolarHBondContact O-N 3.28Å; T172-R176 WeakPolarHBondContact O-CG 3.4Å; T172-R176 PolarHBondContact O-N 3.02Å |
| 173 | L | 86.9 | Confident | 90.5 | Very high | 104 Ų | 104 | 101 Ų | 101 | 55% | 0.545 | 52% | 0.518 | S | S | . | . | H | α-helix | trans | -67.3 | -38.7 | 173.4 | -71.8 | 172.7 | 0 | 0 | 0 | 112.2 | D169 A171 L177 | D169-L173 WeakPolarHBondContact O-CB 3.2Å; D169-L173 VanDerWaalsContact O-CG 3.29Å; D169-L173 WeakPolarHBondContact O-CG 3.35Å; D169-L173 PolarHBondContact O-N 3.42Å; A171-L173 PolarHBondContact O-N 3.22Å; L173-L177 WeakPolarHBondContact O-CB 3.41Å; L173-L177 PolarHBondContact O-N 3.14Å |
| 174 | K | 89.7 | Confident | 90.2 | Very high | 139 Ų | 139 | 99 Ų | 99 | 60% | 0.604 | 51% | 0.511 | S | S | * | . | H | α-helix | trans | -64 | -42.5 | 172.9 | -77.7 | 173.6 | -179 | -179.8 | 0 | 112.1 | V170 A171 L177 Q178 | V170-K174 HydrophobicContact CG1-CD 4.2Å; V170-K174 WeakPolarHBondContact O-CB 3.36Å; V170-K174 VanDerWaalsContact O-CG 3.25Å; V170-K174 WeakPolarHBondContact O-CG 3.34Å; V170-K174 PolarHBondContact O-N 3.21Å; A171-K174 PolarHBondContact O-N 2.88Å; K174-L177 PolarHBondContact O-N 3.36Å; K174-Q178 PolarHBondContact O-N 3.01Å |
| 175 | Q | 90.3 | Very high | 89.6 | Confident | 121 Ų | 121 | 100.9 Ų | 100.9 | 57% | 0.565 | 52% | 0.517 | S | S | * | . | H | α-helix | trans | -61.1 | -51.7 | 176 | -176.2 | 178 | -6.4 | 0 | 0 | 110.9 | A171 T172 L177 Q178 D179 | A171-Q175 PolarHBondContact O-N 3.49Å; T172-Q175 PolarHBondContact O-N 3.28Å; Q175-L177 VanDerWaalsContact C-N 3.28Å; Q175-L177 PolarHBondContact O-N 3.28Å; Q175-Q178 WeakPolarHBondContact O-CA 3.48Å; Q175-Q178 WeakPolarHBondContact O-CB 3.44Å; Q175-Q178 PolarHBondContact O-N 2.85Å; Q175-D179 VanDerWaalsContact O-CG 3.28Å; Q175-D179 PolarHBondContact O-N 2.87Å |
| 176 | R | 90.1 | Very high | 89.2 | Confident | 165 Ų | 165 | 100.5 Ų | 100.5 | 62% | 0.623 | 51% | 0.514 | S | S | * | . | H | α-helix | trans | -57.5 | -39.1 | 177 | -72.3 | 175.2 | -176.7 | 170.7 | 4.4 | 112.9 | T172 Q178 D179 E180 | T172-R176 WeakPolarHBondContact O-CG 3.4Å; T172-R176 PolarHBondContact O-N 3.02Å; R176-Q178 VanDerWaalsContact C-N 3.33Å; R176-D179 PolarHBondContact O-N 2.97Å; R176-E180 WeakPolarHBondContact O-CB 3.42Å; R176-E180 VanDerWaalsContact O-CG 3.3Å; R176-E180 WeakPolarHBondContact O-CG 3.37Å; R176-E180 PolarHBondContact O-N 2.88Å |
| 177 | L | 86.8 | Confident | 88.7 | Confident | 110 Ų | 110 | 97.1 Ų | 97.1 | 58% | 0.576 | 51% | 0.507 | S | S | * | . | H | α-helix | trans | -63.2 | -39.8 | 174.7 | 177.9 | 62.7 | 0 | 0 | 0 | 111.8 | L173 K174 Q175 M181 | L173-L177 WeakPolarHBondContact O-CB 3.41Å; L173-L177 PolarHBondContact O-N 3.14Å; K174-L177 PolarHBondContact O-N 3.36Å; Q175-L177 VanDerWaalsContact C-N 3.28Å; Q175-L177 PolarHBondContact O-N 3.28Å; L177-M181 HydrophobicContact CG-SD 4.44Å; L177-M181 WeakPolarHBondContact O-CB 3.4Å; L177-M181 VanDerWaalsContact O-CG 3.25Å; L177-M181 WeakPolarHBondContact O-CG 3.34Å; L177-M181 PolarHBondContact O-N 2.95Å |
| 178 | Q | 89.7 | Confident | 88.5 | Confident | 136 Ų | 136 | 99.3 Ų | 99.3 | 64% | 0.636 | 51% | 0.51 | S | S | * | . | H | α-helix | trans | -67.9 | -42.5 | 176.3 | -175 | 172.1 | -9.5 | 0 | 0 | 111.7 | K174 Q175 R176 M181 V182 | K174-Q178 PolarHBondContact O-N 3.01Å; Q175-Q178 WeakPolarHBondContact O-CA 3.48Å; Q175-Q178 WeakPolarHBondContact O-CB 3.44Å; Q175-Q178 PolarHBondContact O-N 2.85Å; R176-Q178 VanDerWaalsContact C-N 3.33Å; Q178-M181 PolarHBondContact O-N 3.49Å; Q178-V182 WeakPolarHBondContact O-CG2 3.42Å; Q178-V182 PolarHBondContact O-N 2.9Å; Q178-V182 VanDerWaalsContact O-N 3.09Å |
| 179 | D | 87.3 | Confident | 88.2 | Confident | 80 Ų | 80 | 100.5 Ų | 100.5 | 43% | 0.428 | 52% | 0.515 | S | S | . | . | H | α-helix | trans | -61.4 | -47.6 | 176.1 | -60.3 | -31.8 | 0 | 0 | 0 | 111.1 | Q175 R176 M181 V182 L183 | Q175-D179 VanDerWaalsContact O-CG 3.28Å; Q175-D179 PolarHBondContact O-N 2.87Å; R176-D179 PolarHBondContact O-N 2.97Å; D179-M181 VanDerWaalsContact C-N 3.35Å; D179-M181 PolarHBondContact O-N 3.21Å; D179-V182 PolarHBondContact O-N 2.88Å; D179-L183 WeakPolarHBondContact O-CG 3.22Å; D179-L183 PolarHBondContact O-N 2.82Å |
| 180 | E | 89.2 | Confident | 88 | Confident | 128 Ų | 128 | 100.4 Ų | 100.4 | 60% | 0.598 | 52% | 0.515 | S | S | * | . | H | α-helix | trans | -63.5 | -35.6 | 174.7 | -73.2 | -70.9 | 170.6 | 0 | 0 | 112.6 | R176 V182 L183 R184 | R176-E180 WeakPolarHBondContact O-CB 3.42Å; R176-E180 VanDerWaalsContact O-CG 3.3Å; R176-E180 WeakPolarHBondContact O-CG 3.37Å; R176-E180 PolarHBondContact O-N 2.88Å; E180-V182 VanDerWaalsContact C-N 3.33Å; E180-V182 PolarHBondContact O-N 3.34Å; E180-L183 PolarHBondContact O-N 3.35Å; E180-R184 WeakPolarHBondContact O-CB 3.23Å; E180-R184 PolarHBondContact O-N 3.3Å |
| 181 | M | 79.1 | Confident | 87.8 | Confident | 113 Ų | 113 | 101 Ų | 101 | 56% | 0.557 | 51% | 0.514 | S | S | * | . | H | α-helix | trans | -63.6 | -38.2 | 174.3 | -82.3 | -179.6 | 64.6 | 0 | 0 | 112.4 | L177 Q178 D179 Q185 | L177-M181 HydrophobicContact CG-SD 4.44Å; L177-M181 WeakPolarHBondContact O-CB 3.4Å; L177-M181 VanDerWaalsContact O-CG 3.25Å; L177-M181 WeakPolarHBondContact O-CG 3.34Å; L177-M181 PolarHBondContact O-N 2.95Å; Q178-M181 PolarHBondContact O-N 3.49Å; D179-M181 VanDerWaalsContact C-N 3.35Å; D179-M181 PolarHBondContact O-N 3.21Å; M181-Q185 WeakPolarHBondContact O-CB 3.43Å; M181-Q185 PolarHBondContact O-N 3.21Å |
| 182 | V | 87.9 | Confident | 87.6 | Confident | 73 Ų | 73 | 101.7 Ų | 101.7 | 44% | 0.442 | 51% | 0.511 | S | S | . | . | H | α-helix | trans | -68.6 | -50.4 | 174.5 | 174.3 | 0 | 0 | 0 | 0 | 110.5 | Q178 D179 E180 R184 Q185 D186 | Q178-V182 WeakPolarHBondContact O-CG2 3.42Å; Q178-V182 PolarHBondContact O-N 2.9Å; Q178-V182 VanDerWaalsContact O-N 3.09Å; D179-V182 PolarHBondContact O-N 2.88Å; E180-V182 VanDerWaalsContact C-N 3.33Å; E180-V182 PolarHBondContact O-N 3.34Å; V182-R184 VanDerWaalsContact C-N 3.26Å; V182-R184 PolarHBondContact O-N 3.31Å; V182-Q185 WeakPolarHBondContact O-CA 3.43Å; V182-Q185 WeakPolarHBondContact O-CB 3.44Å; V182-Q185 PolarHBondContact O-N 2.89Å; V182-D186 PolarHBondContact O-N 3.09Å |
| 183 | L | 86.8 | Confident | 87.5 | Confident | 104 Ų | 104 | 100.9 Ų | 100.9 | 55% | 0.545 | 51% | 0.51 | S | S | . | . | H | α-helix | trans | -56.6 | -40.1 | 177.6 | -70.6 | 170.9 | 0 | 0 | 0 | 112.4 | D179 E180 A187 | D179-L183 WeakPolarHBondContact O-CG 3.22Å; D179-L183 PolarHBondContact O-N 2.82Å; E180-L183 PolarHBondContact O-N 3.35Å; L183-A187 VanDerWaalsContact O-CB 3.3Å; L183-A187 WeakPolarHBondContact O-CB 3.47Å; L183-A187 PolarHBondContact O-N 3.24Å |
| 184 | R | 87.5 | Confident | 87.9 | Confident | 125 Ų | 125 | 102.2 Ų | 102.2 | 47% | 0.472 | 51% | 0.511 | S | S | . | . | H | α-helix | trans | -65.3 | -40.4 | 174.4 | -171.1 | -155.7 | 73.3 | 75.3 | 27.9 | 112.1 | E180 V182 A187 E188 | E180-R184 WeakPolarHBondContact O-CB 3.23Å; E180-R184 PolarHBondContact O-N 3.3Å; V182-R184 VanDerWaalsContact C-N 3.26Å; V182-R184 PolarHBondContact O-N 3.31Å; R184-A187 PolarHBondContact O-N 2.9Å; R184-E188 IonicContact CZ-OE1 3.34Å; R184-E188 IonicContact CZ-OE2 2.69Å; R184-E188 IonicContact NH1-OE1 3.74Å; R184-E188 PolarHBondContact NH1-OE1 2.87Å; R184-E188 IonicContact NH1-OE2 3.59Å; R184-E188 PolarHBondContact NH1-OE2 2.9Å; R184-E188 IonicContact NH2-OE1 2.74Å; R184-E188 IonicContact NH2-OE2 3.15Å; R184-E188 PolarHBondContact NH2-OE2 3.14Å; R184-E188 WeakPolarHBondContact O-CG 3.41Å; R184-E188 PolarHBondContact O-N 2.93Å |
| 185 | Q | 85.3 | Confident | 88 | Confident | 123 Ų | 123 | 102.7 Ų | 102.7 | 58% | 0.575 | 51% | 0.509 | S | S | * | . | H | α-helix | trans | -67.6 | -41.5 | 176.5 | 178.9 | 173.8 | -18.7 | 0 | 0 | 112 | M181 V182 E188 S189 | M181-Q185 WeakPolarHBondContact O-CB 3.43Å; M181-Q185 PolarHBondContact O-N 3.21Å; V182-Q185 WeakPolarHBondContact O-CA 3.43Å; V182-Q185 WeakPolarHBondContact O-CB 3.44Å; V182-Q185 PolarHBondContact O-N 2.89Å; Q185-E188 PolarHBondContact O-N 3.35Å; Q185-S189 WeakPolarHBondContact O-CB 3.49Å; Q185-S189 PolarHBondContact O-N 3.02Å |
| 186 | D | 87.3 | Confident | 88.3 | Confident | 85 Ų | 85 | 103.4 Ų | 103.4 | 46% | 0.455 | 51% | 0.513 | S | S | . | . | H | α-helix | trans | -65.1 | -41.3 | 175 | -71 | -20.7 | 0 | 0 | 0 | 111.1 | V182 S189 N190 | V182-D186 PolarHBondContact O-N 3.09Å; D186-S189 WeakPolarHBondContact O-CB 3.38Å; D186-S189 PolarHBondContact O-N 3.32Å; D186-N190 WeakPolarHBondContact O-CB 3.16Å; D186-N190 VanDerWaalsContact O-CG 3.24Å; D186-N190 PolarHBondContact O-N 3.47Å; D186-N190 PolarHBondContact O-ND2 3.15Å |
| 187 | A | 81.1 | Confident | 88.5 | Confident | 56 Ų | 56 | 99.9 Ų | 99.9 | 46% | 0.463 | 51% | 0.506 | S | S | . | . | H | α-helix | trans | -62.4 | -41.2 | 173.8 | 0 | 0 | 0 | 0 | 0 | 112.6 | L183 R184 L191 | L183-A187 VanDerWaalsContact O-CB 3.3Å; L183-A187 WeakPolarHBondContact O-CB 3.47Å; L183-A187 PolarHBondContact O-N 3.24Å; R184-A187 PolarHBondContact O-N 2.9Å; A187-L191 VanDerWaalsContact O-CB 3.24Å; A187-L191 WeakPolarHBondContact O-CB 3.35Å; A187-L191 PolarHBondContact O-N 3.48Å |
| 188 | E | 88.1 | Confident | 89.1 | Confident | 89 Ų | 89 | 98.8 Ų | 98.8 | 42% | 0.416 | 50% | 0.504 | S | S | . | . | H | α-helix | trans | -66.2 | -38.8 | 173.6 | -77.7 | -179.7 | 156.1 | 0 | 0 | 112.5 | R184 Q185 L191 N192 | R184-E188 IonicContact CZ-OE1 3.34Å; R184-E188 IonicContact CZ-OE2 2.69Å; R184-E188 IonicContact NH1-OE1 3.74Å; R184-E188 PolarHBondContact NH1-OE1 2.87Å; R184-E188 IonicContact NH1-OE2 3.59Å; R184-E188 PolarHBondContact NH1-OE2 2.9Å; R184-E188 IonicContact NH2-OE1 2.74Å; R184-E188 IonicContact NH2-OE2 3.15Å; R184-E188 PolarHBondContact NH2-OE2 3.14Å; R184-E188 WeakPolarHBondContact O-CG 3.41Å; R184-E188 PolarHBondContact O-N 2.93Å; Q185-E188 PolarHBondContact O-N 3.35Å; E188-L191 PolarHBondContact O-N 2.88Å; E188-N192 WeakPolarHBondContact O-CB 3.36Å; E188-N192 VanDerWaalsContact O-CG 3.26Å; E188-N192 PolarHBondContact O-N 3.21Å; E188-N192 PolarHBondContact O-ND2 3.46Å |
| 189 | S | 87.9 | Confident | 89.3 | Confident | 77 Ų | 77 | 97.6 Ų | 97.6 | 54% | 0.538 | 50% | 0.502 | S | S | . | . | H | α-helix | trans | -61 | -51.1 | 174.7 | -169 | 0 | 0 | 0 | 0 | 111.1 | Q185 D186 L191 N192 A193 | Q185-S189 WeakPolarHBondContact O-CB 3.49Å; Q185-S189 PolarHBondContact O-N 3.02Å; D186-S189 WeakPolarHBondContact O-CB 3.38Å; D186-S189 PolarHBondContact O-N 3.32Å; S189-L191 PolarHBondContact O-N 3.3Å; S189-N192 PolarHBondContact O-N 3.05Å; S189-A193 PolarHBondContact O-N 3.41Å |
| 190 | N | 90 | Very high | 89.8 | Confident | 90 Ų | 90 | 99.7 Ų | 99.7 | 48% | 0.481 | 51% | 0.509 | S | S | . | . | H | α-helix | trans | -61.9 | -40.3 | 177.3 | -69 | -37.2 | 0 | 0 | 0 | 112.2 | D186 N192 A193 F194 | D186-N190 WeakPolarHBondContact O-CB 3.16Å; D186-N190 VanDerWaalsContact O-CG 3.24Å; D186-N190 PolarHBondContact O-N 3.47Å; D186-N190 PolarHBondContact O-ND2 3.15Å; N190-N192 VanDerWaalsContact C-N 3.33Å; N190-N192 PolarHBondContact O-N 3.21Å; N190-A193 PolarHBondContact O-N 2.72Å; N190-F194 HydrophobicContact CB-CE2 4.36Å; N190-F194 WeakPolarHBondContact O-CD2 3.35Å; N190-F194 WeakPolarHBondContact O-CG 3.42Å; N190-F194 PolarHBondContact O-N 3.18Å |
| 191 | L | 88.4 | Confident | 90.1 | Very high | 85 Ų | 85 | 96.4 Ų | 96.4 | 45% | 0.445 | 50% | 0.504 | S | S | . | . | H | α-helix | trans | -64.1 | -37.6 | 176 | -173.9 | 154.9 | 0 | 0 | 0 | 111.9 | A187 E188 S189 R195 | A187-L191 VanDerWaalsContact O-CB 3.24Å; A187-L191 WeakPolarHBondContact O-CB 3.35Å; A187-L191 PolarHBondContact O-N 3.48Å; E188-L191 PolarHBondContact O-N 2.88Å; S189-L191 PolarHBondContact O-N 3.3Å; L191-R195 HydrophobicContact CD2-CG 4.46Å; L191-R195 WeakPolarHBondContact O-CG 3.24Å; L191-R195 PolarHBondContact O-N 3.47Å; L191-R195 VanDerWaalsContact O-N 3.07Å |
| 192 | N | 87.8 | Confident | 91 | Very high | 73 Ų | 73 | 93.5 Ų | 93.5 | 39% | 0.39 | 50% | 0.495 | S | S | . | . | H | α-helix | trans | -72.4 | -32.9 | 175.4 | -71 | -35.4 | 0 | 0 | 0 | 112.6 | E188 S189 N190 R195 Q196 | E188-N192 WeakPolarHBondContact O-CB 3.36Å; E188-N192 VanDerWaalsContact O-CG 3.26Å; E188-N192 PolarHBondContact O-N 3.21Å; E188-N192 PolarHBondContact O-ND2 3.46Å; S189-N192 PolarHBondContact O-N 3.05Å; N190-N192 VanDerWaalsContact C-N 3.33Å; N190-N192 PolarHBondContact O-N 3.21Å; N192-R195 PolarHBondContact O-N 2.92Å; N192-R195 PolarHBondContact OD1-NH1 2.91Å; N192-Q196 WeakPolarHBondContact O-CG 3.41Å; N192-Q196 PolarHBondContact O-N 2.93Å |
| 193 | A | 91.3 | Very high | 91.5 | Very high | 42 Ų | 42 | 94.7 Ų | 94.7 | 35% | 0.347 | 50% | 0.498 | S | S | . | . | H | α-helix | trans | -63 | -51.7 | 169.4 | 0 | 0 | 0 | 0 | 0 | 111.2 | S189 N190 R195 Q196 D197 | S189-A193 PolarHBondContact O-N 3.41Å; N190-A193 PolarHBondContact O-N 2.72Å; A193-R195 PolarHBondContact O-N 3.14Å; A193-R195 VanDerWaalsContact O-N 3.14Å; A193-Q196 WeakPolarHBondContact O-CA 3.42Å; A193-Q196 WeakPolarHBondContact O-CB 3.2Å; A193-Q196 PolarHBondContact O-N 3.34Å; A193-D197 PolarHBondContact O-N 2.85Å |
| 194 | F | 93.4 | Very high | 92 | Very high | 133 Ų | 133 | 92.8 Ų | 92.8 | 58% | 0.583 | 49% | 0.488 | S | S | * | . | H | α-helix | trans | -60.5 | -26.9 | 177.5 | -62.9 | -39.1 | 0 | 0 | 0 | 113.7 | N190 V198 | N190-F194 HydrophobicContact CB-CE2 4.36Å; N190-F194 WeakPolarHBondContact O-CD2 3.35Å; N190-F194 WeakPolarHBondContact O-CG 3.42Å; N190-F194 PolarHBondContact O-N 3.18Å; F194-V198 WeakPolarHBondContact O-CB 3.43Å; F194-V198 VanDerWaalsContact O-CG2 3.24Å; F194-V198 WeakPolarHBondContact O-CG2 3.36Å; F194-V198 PolarHBondContact O-N 2.98Å; F194-V198 VanDerWaalsContact O-N 3.08Å |
| 195 | R | 93.2 | Very high | 92.5 | Very high | 148 Ų | 148 | 93.3 Ų | 93.3 | 56% | 0.558 | 49% | 0.49 | S | S | * | . | H | α-helix | trans | -66.6 | -46.5 | 169.4 | -79.3 | 173.4 | 170.6 | 159.2 | -4.3 | 111.9 | L191 N192 A193 D197 V198 D199 | L191-R195 HydrophobicContact CD2-CG 4.46Å; L191-R195 WeakPolarHBondContact O-CG 3.24Å; L191-R195 PolarHBondContact O-N 3.47Å; L191-R195 VanDerWaalsContact O-N 3.07Å; N192-R195 PolarHBondContact O-N 2.92Å; N192-R195 PolarHBondContact OD1-NH1 2.91Å; A193-R195 PolarHBondContact O-N 3.14Å; A193-R195 VanDerWaalsContact O-N 3.14Å; R195-D197 VanDerWaalsContact C-N 3.34Å; R195-D197 PolarHBondContact O-N 3.07Å; R195-V198 PolarHBondContact O-N 3.08Å; R195-D199 PolarHBondContact O-N 2.99Å |
| 196 | Q | 95.4 | Very high | 93.1 | Very high | 136 Ų | 136 | 89.8 Ų | 89.8 | 64% | 0.636 | 48% | 0.477 | S | S | * | . | H | α-helix | trans | -62.1 | -41.9 | 176.5 | -67 | 172.2 | 21.7 | 0 | 0 | 111.2 | N192 A193 V198 D199 E200 | N192-Q196 WeakPolarHBondContact O-CG 3.41Å; N192-Q196 PolarHBondContact O-N 2.93Å; A193-Q196 WeakPolarHBondContact O-CA 3.42Å; A193-Q196 WeakPolarHBondContact O-CB 3.2Å; A193-Q196 PolarHBondContact O-N 3.34Å; Q196-V198 VanDerWaalsContact C-N 3.32Å; Q196-V198 PolarHBondContact O-N 3.44Å; Q196-D199 PolarHBondContact O-N 2.89Å; Q196-E200 WeakPolarHBondContact O-CB 3.29Å; Q196-E200 PolarHBondContact O-N 3.4Å |
| 197 | D | 96.2 | Very high | 93.6 | Very high | 91 Ų | 91 | 91.2 Ų | 91.2 | 49% | 0.487 | 48% | 0.481 | S | S | . | . | H | α-helix | trans | -59.3 | -41.4 | 174.4 | -60.6 | -29.2 | 0 | 0 | 0 | 111.9 | A193 R195 A201 | A193-D197 PolarHBondContact O-N 2.85Å; R195-D197 VanDerWaalsContact C-N 3.34Å; R195-D197 PolarHBondContact O-N 3.07Å; D197-A201 WeakPolarHBondContact O-CB 3.45Å; D197-A201 PolarHBondContact O-N 3.34Å |
| 198 | V | 97.4 | Very high | 94.4 | Very high | 88 Ų | 88 | 93.8 Ų | 93.8 | 53% | 0.533 | 49% | 0.486 | S | S | . | . | H | α-helix | trans | -71.4 | -38.4 | 178.2 | 165.7 | 0 | 0 | 0 | 0 | 112.1 | F194 R195 Q196 S202 | F194-V198 WeakPolarHBondContact O-CB 3.43Å; F194-V198 VanDerWaalsContact O-CG2 3.24Å; F194-V198 WeakPolarHBondContact O-CG2 3.36Å; F194-V198 PolarHBondContact O-N 2.98Å; F194-V198 VanDerWaalsContact O-N 3.08Å; R195-V198 PolarHBondContact O-N 3.08Å; Q196-V198 VanDerWaalsContact C-N 3.32Å; Q196-V198 PolarHBondContact O-N 3.44Å; V198-S202 VanDerWaalsContact O-CB 3.23Å; V198-S202 WeakPolarHBondContact O-CB 3.41Å; V198-S202 PolarHBondContact O-N 3.28Å; V198-S202 PolarHBondContact O-OG 2.7Å |
| 199 | D | 95.6 | Very high | 94.9 | Very high | 111 Ų | 111 | 93 Ų | 93 | 59% | 0.594 | 48% | 0.483 | S | S | * | . | H | α-helix | trans | -67.7 | -42.3 | 175.4 | -73.2 | -27.8 | 0 | 0 | 0 | 111 | R195 Q196 S202 L203 | R195-D199 PolarHBondContact O-N 2.99Å; Q196-D199 PolarHBondContact O-N 2.89Å; D199-S202 PolarHBondContact O-N 3.45Å; D199-L203 WeakPolarHBondContact O-CB 3.42Å; D199-L203 PolarHBondContact O-N 2.92Å |
| 200 | E | 97.2 | Very high | 95.3 | Very high | 124 Ų | 124 | 97.8 Ų | 97.8 | 58% | 0.579 | 49% | 0.489 | S | S | * | . | H | α-helix | trans | -64.5 | -46.9 | 173.7 | -178.9 | 174.5 | 164.7 | 0 | 0 | 111.4 | Q196 S202 L203 N204 | Q196-E200 WeakPolarHBondContact O-CB 3.29Å; Q196-E200 PolarHBondContact O-N 3.4Å; E200-S202 VanDerWaalsContact C-N 3.26Å; E200-S202 PolarHBondContact O-N 2.91Å; E200-L203 PolarHBondContact O-N 2.95Å; E200-N204 WeakPolarHBondContact CG-ND2 3.44Å; E200-N204 WeakPolarHBondContact O-CB 3.35Å; E200-N204 PolarHBondContact O-N 2.65Å; E200-N204 PolarHBondContact O-ND2 2.94Å |
| 201 | A | 95.7 | Very high | 95.7 | Very high | 59 Ų | 59 | 100.2 Ų | 100.2 | 49% | 0.488 | 50% | 0.495 | S | S | . | . | H | α-helix | trans | -60.1 | -36.9 | 175.5 | 0 | 0 | 0 | 0 | 0 | 112.1 | D197 R205 | D197-A201 WeakPolarHBondContact O-CB 3.45Å; D197-A201 PolarHBondContact O-N 3.34Å; A201-R205 WeakPolarHBondContact O-CB 3.45Å; A201-R205 PolarHBondContact O-N 3.34Å |
| 202 | S | 97.6 | Very high | 96.2 | Very high | 52 Ų | 52 | 100.5 Ų | 100.5 | 36% | 0.364 | 50% | 0.496 | S | S | . | . | H | α-helix | trans | -68.4 | -40.8 | 175.9 | -63.6 | 0 | 0 | 0 | 0 | 112.3 | V198 D199 E200 R205 V206 | V198-S202 VanDerWaalsContact O-CB 3.23Å; V198-S202 WeakPolarHBondContact O-CB 3.41Å; V198-S202 PolarHBondContact O-N 3.28Å; V198-S202 PolarHBondContact O-OG 2.7Å; D199-S202 PolarHBondContact O-N 3.45Å; E200-S202 VanDerWaalsContact C-N 3.26Å; E200-S202 PolarHBondContact O-N 2.91Å; S202-R205 PolarHBondContact O-N 3.28Å; S202-V206 WeakPolarHBondContact O-CG2 3.3Å; S202-V206 PolarHBondContact O-N 2.94Å; S202-V206 VanDerWaalsContact O-N 3.07Å |
| 203 | L | 97.4 | Very high | 96.7 | Very high | 98 Ų | 98 | 101 Ų | 101 | 51% | 0.513 | 50% | 0.499 | S | S | . | . | H | α-helix | trans | -65.8 | -44.3 | 175 | -179 | 151.3 | 0 | 0 | 0 | 111.1 | D199 E200 V206 Q207 | D199-L203 WeakPolarHBondContact O-CB 3.42Å; D199-L203 PolarHBondContact O-N 2.92Å; E200-L203 PolarHBondContact O-N 2.95Å; L203-V206 PolarHBondContact O-N 2.91Å; L203-Q207 HydrophobicContact CD2-CG 4.35Å; L203-Q207 VanDerWaalsContact CD2-NE2 3.25Å; L203-Q207 WeakPolarHBondContact O-CG 3.35Å; L203-Q207 PolarHBondContact O-N 3.29Å |
| 204 | N | 97.8 | Very high | 97 | Very high | 63 Ų | 63 | 101.8 Ų | 101.8 | 34% | 0.337 | 51% | 0.506 | S | S | . | . | H | α-helix | trans | -62.7 | -40 | 175.1 | -76 | -31.5 | 0 | 0 | 0 | 111.8 | E200 Q207 L208 | E200-N204 WeakPolarHBondContact CG-ND2 3.44Å; E200-N204 WeakPolarHBondContact O-CB 3.35Å; E200-N204 PolarHBondContact O-N 2.65Å; E200-N204 PolarHBondContact O-ND2 2.94Å; N204-Q207 PolarHBondContact O-N 2.88Å; N204-L208 WeakPolarHBondContact O-CG 3.44Å; N204-L208 PolarHBondContact O-N 2.93Å |
| 205 | R | 98.3 | Very high | 97.2 | Very high | 136 Ų | 136 | 100.1 Ų | 100.1 | 51% | 0.513 | 50% | 0.502 | S | S | . | . | H | α-helix | trans | -57.7 | -50.7 | 171.4 | -177.3 | -175.6 | 66.2 | 91.4 | 4 | 111.3 | A201 S202 Q207 L208 E209 | A201-R205 WeakPolarHBondContact O-CB 3.45Å; A201-R205 PolarHBondContact O-N 3.34Å; S202-R205 PolarHBondContact O-N 3.28Å; R205-Q207 VanDerWaalsContact C-N 3.31Å; R205-Q207 PolarHBondContact O-N 3.09Å; R205-L208 PolarHBondContact O-N 3.5Å; R205-L208 VanDerWaalsContact O-N 3.12Å; R205-E209 WeakPolarHBondContact CD-OE1 3.14Å; R205-E209 HydrophobicContact CG-CG 4.37Å; R205-E209 VanDerWaalsContact CG-OE1 3.3Å; R205-E209 WeakPolarHBondContact CG-OE1 3.44Å; R205-E209 IonicContact CZ-OE1 3.42Å; R205-E209 IonicContact CZ-OE2 2.69Å; R205-E209 IonicContact NE-OE1 3.25Å; R205-E209 IonicContact NH1-OE1 3.11Å; R205-E209 PolarHBondContact NH1-OE1 3.45Å; R205-E209 IonicContact NH1-OE2 3.33Å; R205-E209 PolarHBondContact NH1-OE2 2.92Å; R205-E209 WeakPolarHBondContact O-CG 3.24Å; R205-E209 PolarHBondContact O-N 3.43Å |
| 206 | V | 98.1 | Very high | 97.5 | Very high | 49 Ų | 49 | 98.8 Ų | 98.8 | 30% | 0.297 | 50% | 0.502 | S | S | . | . | H | α-helix | trans | -65.3 | -32.3 | -179.2 | 171.7 | 0 | 0 | 0 | 0 | 112.3 | S202 L203 R210 | S202-V206 WeakPolarHBondContact O-CG2 3.3Å; S202-V206 PolarHBondContact O-N 2.94Å; S202-V206 VanDerWaalsContact O-N 3.07Å; L203-V206 PolarHBondContact O-N 2.91Å; V206-R210 VanDerWaalsContact O-CG 3.31Å; V206-R210 WeakPolarHBondContact O-CG 3.4Å; V206-R210 PolarHBondContact O-N 3.44Å; V206-R210 VanDerWaalsContact O-N 3.11Å |
| 207 | Q | 97.9 | Very high | 97.6 | Very high | 115 Ų | 115 | 97.8 Ų | 97.8 | 54% | 0.537 | 50% | 0.501 | S | S | . | . | H | α-helix | trans | -66.6 | -41.7 | 171.2 | -72.5 | -171.7 | 15.5 | 0 | 0 | 112.4 | L203 N204 R205 K211 | L203-Q207 HydrophobicContact CD2-CG 4.35Å; L203-Q207 VanDerWaalsContact CD2-NE2 3.25Å; L203-Q207 WeakPolarHBondContact O-CG 3.35Å; L203-Q207 PolarHBondContact O-N 3.29Å; N204-Q207 PolarHBondContact O-N 2.88Å; R205-Q207 VanDerWaalsContact C-N 3.31Å; R205-Q207 PolarHBondContact O-N 3.09Å; Q207-K211 WeakPolarHBondContact O-CB 3.43Å; Q207-K211 PolarHBondContact O-N 3.45Å; Q207-K211 VanDerWaalsContact O-N 3.08Å |
| 208 | L | 97.8 | Very high | 97.7 | Very high | 110 Ų | 110 | 98 Ų | 98 | 58% | 0.576 | 50% | 0.499 | S | S | * | . | H | α-helix | trans | -68.4 | -39 | 177.2 | -71.1 | 171.4 | 0 | 0 | 0 | 112 | N204 R205 K211 I212 | N204-L208 WeakPolarHBondContact O-CG 3.44Å; N204-L208 PolarHBondContact O-N 2.93Å; R205-L208 PolarHBondContact O-N 3.5Å; R205-L208 VanDerWaalsContact O-N 3.12Å; L208-K211 PolarHBondContact O-N 2.78Å; L208-I212 WeakPolarHBondContact O-CG1 3.25Å; L208-I212 PolarHBondContact O-N 3.31Å |
| 209 | E | 98 | Very high | 97.7 | Very high | 73 Ų | 73 | 98.2 Ų | 98.2 | 34% | 0.341 | 50% | 0.496 | S | S | . | . | H | α-helix | trans | -59.2 | -53.3 | 173.9 | -74.6 | 167.7 | 173.8 | 0 | 0 | 110.6 | R205 K211 I212 D213 | R205-E209 WeakPolarHBondContact CD-OE1 3.14Å; R205-E209 HydrophobicContact CG-CG 4.37Å; R205-E209 VanDerWaalsContact CG-OE1 3.3Å; R205-E209 WeakPolarHBondContact CG-OE1 3.44Å; R205-E209 IonicContact CZ-OE1 3.42Å; R205-E209 IonicContact CZ-OE2 2.69Å; R205-E209 IonicContact NE-OE1 3.25Å; R205-E209 IonicContact NH1-OE1 3.11Å; R205-E209 PolarHBondContact NH1-OE1 3.45Å; R205-E209 IonicContact NH1-OE2 3.33Å; R205-E209 PolarHBondContact NH1-OE2 2.92Å; R205-E209 WeakPolarHBondContact O-CG 3.24Å; R205-E209 PolarHBondContact O-N 3.43Å; E209-K211 PolarHBondContact O-N 3.28Å; E209-K211 VanDerWaalsContact O-N 3.14Å; E209-I212 CarbonylContact O-C 3.6Å; E209-I212 WeakPolarHBondContact O-CA 3.34Å; E209-I212 WeakPolarHBondContact O-CB 3.29Å; E209-I212 PolarHBondContact O-N 3.29Å; E209-D213 PolarHBondContact O-N 2.99Å |
| 210 | R | 97.9 | Very high | 97.8 | Very high | 178 Ų | 178 | 95.6 Ų | 95.6 | 67% | 0.672 | 49% | 0.49 | S | S | * | . | H | α-helix | trans | -57.2 | -32.2 | 174.6 | -70.9 | 172.5 | -177.8 | -179.4 | 1.8 | 113.8 | V206 A214 | V206-R210 VanDerWaalsContact O-CG 3.31Å; V206-R210 WeakPolarHBondContact O-CG 3.4Å; V206-R210 PolarHBondContact O-N 3.44Å; V206-R210 VanDerWaalsContact O-N 3.11Å; R210-A214 WeakPolarHBondContact O-CB 3.37Å; R210-A214 PolarHBondContact O-N 2.97Å |
| 211 | K | 98.2 | Very high | 97.8 | Very high | 140 Ų | 140 | 95.4 Ų | 95.4 | 61% | 0.609 | 49% | 0.488 | S | S | * | . | H | α-helix | trans | -75.4 | -32.9 | 176.5 | -173.2 | 174.4 | -179.6 | 178.7 | 0 | 112.1 | Q207 L208 E209 L215 | Q207-K211 WeakPolarHBondContact O-CB 3.43Å; Q207-K211 PolarHBondContact O-N 3.45Å; Q207-K211 VanDerWaalsContact O-N 3.08Å; L208-K211 PolarHBondContact O-N 2.78Å; E209-K211 PolarHBondContact O-N 3.28Å; E209-K211 VanDerWaalsContact O-N 3.14Å; K211-L215 HydrophobicContact CG-CD1 4.33Å; K211-L215 WeakPolarHBondContact O-CB 3.39Å; K211-L215 WeakPolarHBondContact O-CD1 3.44Å; K211-L215 WeakPolarHBondContact O-CG 3.32Å; K211-L215 PolarHBondContact O-N 3.2Å |
| 212 | I | 98.3 | Very high | 97.9 | Very high | 92 Ų | 92 | 96.1 Ų | 96.1 | 47% | 0.472 | 48% | 0.483 | S | S | . | . | H | α-helix | trans | -66.6 | -47.3 | 170.8 | -72.3 | 164.3 | 0 | 0 | 0 | 109.4 | L208 E209 L215 Q216 | L208-I212 WeakPolarHBondContact O-CG1 3.25Å; L208-I212 PolarHBondContact O-N 3.31Å; E209-I212 CarbonylContact O-C 3.6Å; E209-I212 WeakPolarHBondContact O-CA 3.34Å; E209-I212 WeakPolarHBondContact O-CB 3.29Å; E209-I212 PolarHBondContact O-N 3.29Å; I212-L215 PolarHBondContact O-N 3.29Å; I212-Q216 WeakPolarHBondContact O-CG 3.2Å; I212-Q216 PolarHBondContact O-N 3.09Å |
| 213 | D | 98.1 | Very high | 97.9 | Very high | 84 Ų | 84 | 99.7 Ų | 99.7 | 45% | 0.449 | 49% | 0.492 | S | S | . | . | H | α-helix | trans | -58.1 | -51.7 | 178.5 | -58 | -27 | 0 | 0 | 0 | 111 | E209 L215 Q216 D217 | E209-D213 PolarHBondContact O-N 2.99Å; D213-L215 VanDerWaalsContact C-N 3.25Å; D213-L215 PolarHBondContact O-N 2.93Å; D213-Q216 WeakPolarHBondContact O-CA 3.42Å; D213-Q216 WeakPolarHBondContact O-CB 3.3Å; D213-Q216 PolarHBondContact O-N 3.22Å; D213-D217 PolarHBondContact O-N 3.48Å |
| 214 | A | 98 | Very high | 97.9 | Very high | 58 Ų | 58 | 100.5 Ų | 100.5 | 48% | 0.479 | 49% | 0.491 | S | S | . | . | H | α-helix | trans | -61 | -30.4 | 177.8 | 0 | 0 | 0 | 0 | 0 | 113.8 | R210 E218 | R210-A214 WeakPolarHBondContact O-CB 3.37Å; R210-A214 PolarHBondContact O-N 2.97Å; A214-E218 WeakPolarHBondContact O-CB 3.46Å; A214-E218 PolarHBondContact O-N 3.06Å; A214-E218 VanDerWaalsContact O-N 3.13Å |
| 215 | L | 97.9 | Very high | 97.9 | Very high | 98 Ų | 98 | 100 Ų | 100 | 51% | 0.513 | 49% | 0.488 | S | S | . | . | H | α-helix | trans | -78 | -28.4 | 173.2 | -73.3 | 170.4 | 0 | 0 | 0 | 112.5 | K211 I212 D213 I219 | K211-L215 HydrophobicContact CG-CD1 4.33Å; K211-L215 WeakPolarHBondContact O-CB 3.39Å; K211-L215 WeakPolarHBondContact O-CD1 3.44Å; K211-L215 WeakPolarHBondContact O-CG 3.32Å; K211-L215 PolarHBondContact O-N 3.2Å; I212-L215 PolarHBondContact O-N 3.29Å; D213-L215 VanDerWaalsContact C-N 3.25Å; D213-L215 PolarHBondContact O-N 2.93Å; L215-I219 WeakPolarHBondContact O-CB 3.42Å; L215-I219 WeakPolarHBondContact O-CD1 3.27Å; L215-I219 WeakPolarHBondContact O-CG1 3.38Å; L215-I219 PolarHBondContact O-N 3.27Å |
| 216 | Q | 98.2 | Very high | 97.8 | Very high | 119 Ų | 119 | 98.4 Ų | 98.4 | 56% | 0.556 | 49% | 0.486 | S | S | * | . | H | α-helix | trans | -70.6 | -41.7 | 171.4 | -71.4 | -178.6 | 41.3 | 0 | 0 | 111.2 | I212 D213 I219 A220 | I212-Q216 WeakPolarHBondContact O-CG 3.2Å; I212-Q216 PolarHBondContact O-N 3.09Å; D213-Q216 WeakPolarHBondContact O-CA 3.42Å; D213-Q216 WeakPolarHBondContact O-CB 3.3Å; D213-Q216 PolarHBondContact O-N 3.22Å; Q216-I219 PolarHBondContact O-N 3.45Å; Q216-A220 WeakPolarHBondContact O-CB 3.42Å; Q216-A220 PolarHBondContact O-N 2.86Å |
| 217 | D | 97.9 | Very high | 97.7 | Very high | 116 Ų | 116 | 101.7 Ų | 101.7 | 62% | 0.62 | 50% | 0.499 | S | S | * | . | H | α-helix | trans | -60.2 | -46.6 | 174 | -73.8 | -25.1 | 0 | 0 | 0 | 111.3 | D213 I219 A220 F221 | D213-D217 PolarHBondContact O-N 3.48Å; D217-I219 PolarHBondContact O-N 2.93Å; D217-A220 PolarHBondContact O-N 2.99Å; D217-F221 WeakPolarHBondContact O-CB 3.46Å; D217-F221 PolarHBondContact O-N 3.26Å |
| 218 | E | 97.8 | Very high | 97.6 | Very high | 95 Ų | 95 | 99.5 Ų | 99.5 | 44% | 0.444 | 49% | 0.488 | S | S | . | . | H | α-helix | trans | -60.4 | -43.3 | 175 | -176.3 | 64.8 | -162.3 | 0 | 0 | 111.8 | A214 A220 F221 L222 | A214-E218 WeakPolarHBondContact O-CB 3.46Å; A214-E218 PolarHBondContact O-N 3.06Å; A214-E218 VanDerWaalsContact O-N 3.13Å; E218-A220 VanDerWaalsContact C-N 3.34Å; E218-A220 PolarHBondContact O-N 2.96Å; E218-F221 PolarHBondContact O-N 3.02Å; E218-L222 HydrophobicContact CG-CD1 4.09Å; E218-L222 WeakPolarHBondContact O-CB 3.48Å; E218-L222 VanDerWaalsContact O-CG 3.3Å; E218-L222 WeakPolarHBondContact O-CG 3.38Å; E218-L222 PolarHBondContact O-N 3Å |
| 219 | I | 97.4 | Very high | 97.4 | Very high | 92 Ų | 92 | 98.7 Ų | 98.7 | 47% | 0.472 | 48% | 0.482 | S | S | . | . | H | α-helix | trans | -64.9 | -36.7 | 175.7 | -72.7 | 166.1 | 0 | 0 | 0 | 111.6 | L215 Q216 D217 K223 | L215-I219 WeakPolarHBondContact O-CB 3.42Å; L215-I219 WeakPolarHBondContact O-CD1 3.27Å; L215-I219 WeakPolarHBondContact O-CG1 3.38Å; L215-I219 PolarHBondContact O-N 3.27Å; Q216-I219 PolarHBondContact O-N 3.45Å; D217-I219 PolarHBondContact O-N 2.93Å; I219-K223 HydrophobicContact CG2-CD 4.21Å; I219-K223 WeakPolarHBondContact O-CB 3.3Å; I219-K223 VanDerWaalsContact O-CG 3.23Å; I219-K223 WeakPolarHBondContact O-CG 3.25Å; I219-K223 PolarHBondContact O-N 3Å; I219-K223 VanDerWaalsContact O-N 3.08Å |
| 220 | A | 97.9 | Very high | 97.2 | Very high | 56 Ų | 56 | 100.6 Ų | 100.6 | 46% | 0.463 | 49% | 0.494 | S | S | . | . | H | α-helix | trans | -69.8 | -40.4 | 176.4 | 0 | 0 | 0 | 0 | 0 | 111.7 | Q216 D217 E218 K223 K224 | Q216-A220 WeakPolarHBondContact O-CB 3.42Å; Q216-A220 PolarHBondContact O-N 2.86Å; D217-A220 PolarHBondContact O-N 2.99Å; E218-A220 VanDerWaalsContact C-N 3.34Å; E218-A220 PolarHBondContact O-N 2.96Å; A220-K223 PolarHBondContact O-N 3.47Å; A220-K224 WeakPolarHBondContact O-CB 3.41Å; A220-K224 PolarHBondContact O-N 3.08Å |
| 221 | F | 97.9 | Very high | 97 | Very high | 120 Ų | 120 | 97.7 Ų | 97.7 | 53% | 0.526 | 48% | 0.483 | S | S | . | . | H | α-helix | trans | -62.3 | -50.8 | 175.1 | 178.7 | -114.1 | 0 | 0 | 0 | 111.7 | D217 E218 K223 K224 I225 | D217-F221 WeakPolarHBondContact O-CB 3.46Å; D217-F221 PolarHBondContact O-N 3.26Å; E218-F221 PolarHBondContact O-N 3.02Å; F221-K223 VanDerWaalsContact C-N 3.34Å; F221-K223 PolarHBondContact O-N 2.88Å; F221-K224 PolarHBondContact O-N 2.93Å; F221-I225 HydrophobicContact CD1-CD1 4.02Å; F221-I225 HydrophobicContact CD2-CD1 4.38Å; F221-I225 HydrophobicContact CE1-CD1 3.56Å; F221-I225 HydrophobicContact CE2-CD1 3.96Å; F221-I225 HydrophobicContact CG-CD1 4.41Å; F221-I225 HydrophobicContact CZ-CD1 3.53Å; F221-I225 PolarHBondContact O-N 3.45Å |
| 222 | L | 97.8 | Very high | 96.7 | Very high | 75 Ų | 75 | 96.8 Ų | 96.8 | 39% | 0.393 | 48% | 0.48 | S | S | . | . | H | α-helix | trans | -61.8 | -39 | 176.9 | -69.8 | 170.4 | 0 | 0 | 0 | 112.5 | E218 I225 H226 | E218-L222 HydrophobicContact CG-CD1 4.09Å; E218-L222 WeakPolarHBondContact O-CB 3.48Å; E218-L222 VanDerWaalsContact O-CG 3.3Å; E218-L222 WeakPolarHBondContact O-CG 3.38Å; E218-L222 PolarHBondContact O-N 3Å; L222-I225 PolarHBondContact O-N 3.33Å; L222-H226 PolarHBondContact O-CD2 3.02Å; L222-H226 PolarHBondContact O-N 2.86Å |
| 223 | K | 97.4 | Very high | 96.3 | Very high | 126 Ų | 126 | 97.3 Ų | 97.3 | 55% | 0.548 | 48% | 0.483 | S | S | . | . | H | α-helix | trans | -62 | -46.5 | 172.3 | -79 | 171.8 | 179.8 | 177.2 | 0 | 112.1 | I219 A220 F221 I225 H226 E227 | I219-K223 HydrophobicContact CG2-CD 4.21Å; I219-K223 WeakPolarHBondContact O-CB 3.3Å; I219-K223 VanDerWaalsContact O-CG 3.23Å; I219-K223 WeakPolarHBondContact O-CG 3.25Å; I219-K223 PolarHBondContact O-N 3Å; I219-K223 VanDerWaalsContact O-N 3.08Å; A220-K223 PolarHBondContact O-N 3.47Å; F221-K223 VanDerWaalsContact C-N 3.34Å; F221-K223 PolarHBondContact O-N 2.88Å; K223-I225 VanDerWaalsContact C-N 3.33Å; K223-I225 PolarHBondContact O-N 2.97Å; K223-H226 PolarHBondContact O-N 2.81Å; K223-E227 WeakPolarHBondContact O-CB 3.47Å; K223-E227 WeakPolarHBondContact O-CG 3.38Å; K223-E227 PolarHBondContact O-N 3.38Å |
| 224 | K | 97.7 | Very high | 95.8 | Very high | 116 Ų | 116 | 99.3 Ų | 99.3 | 50% | 0.504 | 49% | 0.49 | S | S | . | . | H | α-helix | trans | -61.7 | -41.6 | 179.2 | -175.4 | 177.3 | 178.7 | -72.1 | 0 | 111.5 | A220 F221 E227 E228 | A220-K224 WeakPolarHBondContact O-CB 3.41Å; A220-K224 PolarHBondContact O-N 3.08Å; F221-K224 PolarHBondContact O-N 2.93Å; K224-E227 PolarHBondContact O-N 3.02Å; K224-E228 WeakPolarHBondContact CE-OE1 3.4Å; K224-E228 IonicContact NZ-OE1 3.98Å; K224-E228 PolarHBondContact NZ-OE1 3.27Å; K224-E228 IonicContact NZ-OE2 2.66Å; K224-E228 PolarHBondContact NZ-OE2 3.45Å; K224-E228 WeakPolarHBondContact O-CB 3.46Å; K224-E228 WeakPolarHBondContact O-CG 3.43Å; K224-E228 PolarHBondContact O-N 3.04Å |
| 225 | I | 97.3 | Very high | 95.3 | Very high | 52 Ų | 52 | 102.4 Ų | 102.4 | 27% | 0.267 | 50% | 0.495 | S | S | . | . | H | α-helix | trans | -59.8 | -51.2 | 172.6 | -72.3 | 173.2 | 0 | 0 | 0 | 110.4 | F221 L222 K223 E227 E228 E229 | F221-I225 HydrophobicContact CD1-CD1 4.02Å; F221-I225 HydrophobicContact CD2-CD1 4.38Å; F221-I225 HydrophobicContact CE1-CD1 3.56Å; F221-I225 HydrophobicContact CE2-CD1 3.96Å; F221-I225 HydrophobicContact CG-CD1 4.41Å; F221-I225 HydrophobicContact CZ-CD1 3.53Å; F221-I225 PolarHBondContact O-N 3.45Å; L222-I225 PolarHBondContact O-N 3.33Å; K223-I225 VanDerWaalsContact C-N 3.33Å; K223-I225 PolarHBondContact O-N 2.97Å; I225-E227 VanDerWaalsContact C-N 3.3Å; I225-E227 PolarHBondContact O-N 2.85Å; I225-E228 CarbonylContact O-C 3.49Å; I225-E228 WeakPolarHBondContact O-CA 3.41Å; I225-E228 WeakPolarHBondContact O-CB 3.48Å; I225-E228 PolarHBondContact O-N 3.03Å; I225-E229 HydrophobicContact CG2-CG 4.09Å; I225-E229 WeakPolarHBondContact O-CG 3.28Å; I225-E229 PolarHBondContact O-N 2.92Å |
| 226 | H | 95.9 | Very high | 94.6 | Very high | 102 Ų | 102 | 102.6 Ų | 102.6 | 47% | 0.472 | 49% | 0.493 | S | S | . | . | H | α-helix | trans | -63.8 | -32.5 | 179 | -69.1 | -31.8 | 0 | 0 | 0 | 113.2 | L222 K223 E228 E229 L230 | L222-H226 PolarHBondContact O-CD2 3.02Å; L222-H226 PolarHBondContact O-N 2.86Å; K223-H226 PolarHBondContact O-N 2.81Å; H226-E228 VanDerWaalsContact C-N 3.33Å; H226-E229 IonicContact CE1-OE2 2.71Å; H226-E229 IonicContact CG-OE2 3.55Å; H226-E229 IonicContact ND1-OE2 3.63Å; H226-E229 PolarHBondContact ND1-OE2 2.97Å; H226-L230 WeakPolarHBondContact O-CB 3.26Å; H226-L230 WeakPolarHBondContact O-CD1 3.49Å; H226-L230 WeakPolarHBondContact O-CG 3.4Å; H226-L230 PolarHBondContact O-N 3.47Å |
| 227 | E | 96.3 | Very high | 93.6 | Very high | 119 Ų | 119 | 101.8 Ų | 101.8 | 56% | 0.556 | 49% | 0.492 | S | S | * | . | H | α-helix | trans | -70 | -28.2 | 171.6 | -74.5 | 177 | -157.4 | 0 | 0 | 112.9 | K223 K224 I225 R231 | K223-E227 WeakPolarHBondContact O-CB 3.47Å; K223-E227 WeakPolarHBondContact O-CG 3.38Å; K223-E227 PolarHBondContact O-N 3.38Å; K224-E227 PolarHBondContact O-N 3.02Å; I225-E227 VanDerWaalsContact C-N 3.3Å; I225-E227 PolarHBondContact O-N 2.85Å; E227-R231 WeakPolarHBondContact O-CB 3.29Å; E227-R231 PolarHBondContact O-N 2.98Å; E227-R231 PolarHBondContact O-NH2 3.42Å |
| 228 | E | 95.1 | Very high | 92.7 | Very high | 68 Ų | 68 | 100.6 Ų | 100.6 | 32% | 0.318 | 48% | 0.484 | S | S | . | . | H | α-helix | trans | -76.5 | -49.1 | 172.7 | -78.7 | 162.7 | 178 | 0 | 0 | 111.1 | K224 I225 H226 L230 R231 E232 | K224-E228 WeakPolarHBondContact CE-OE1 3.4Å; K224-E228 IonicContact NZ-OE1 3.98Å; K224-E228 PolarHBondContact NZ-OE1 3.27Å; K224-E228 IonicContact NZ-OE2 2.66Å; K224-E228 PolarHBondContact NZ-OE2 3.45Å; K224-E228 WeakPolarHBondContact O-CB 3.46Å; K224-E228 WeakPolarHBondContact O-CG 3.43Å; K224-E228 PolarHBondContact O-N 3.04Å; I225-E228 CarbonylContact O-C 3.49Å; I225-E228 WeakPolarHBondContact O-CA 3.41Å; I225-E228 WeakPolarHBondContact O-CB 3.48Å; I225-E228 PolarHBondContact O-N 3.03Å; H226-E228 VanDerWaalsContact C-N 3.33Å; E228-L230 PolarHBondContact O-N 3.43Å; E228-R231 VanDerWaalsContact CG-NH1 3.34Å; E228-R231 WeakPolarHBondContact O-CB 3.25Å; E228-R231 PolarHBondContact O-N 2.98Å; E228-R231 VanDerWaalsContact O-N 3.11Å; E228-E232 PolarHBondContact O-N 2.88Å |
| 229 | E | 94.2 | Very high | 91.3 | Very high | 94 Ų | 94 | 99.6 Ų | 99.6 | 44% | 0.439 | 49% | 0.492 | S | S | . | . | H | α-helix | trans | -57.7 | -44.6 | 173.7 | -69.2 | 175.4 | 143.7 | 0 | 0 | 112.2 | I225 H226 R231 E232 L233 | I225-E229 HydrophobicContact CG2-CG 4.09Å; I225-E229 WeakPolarHBondContact O-CG 3.28Å; I225-E229 PolarHBondContact O-N 2.92Å; H226-E229 IonicContact CE1-OE2 2.71Å; H226-E229 IonicContact CG-OE2 3.55Å; H226-E229 IonicContact ND1-OE2 3.63Å; H226-E229 PolarHBondContact ND1-OE2 2.97Å; E229-R231 VanDerWaalsContact C-N 3.31Å; E229-R231 PolarHBondContact O-N 2.97Å; E229-E232 PolarHBondContact O-N 3.07Å; E229-L233 WeakPolarHBondContact O-CB 3.46Å; E229-L233 VanDerWaalsContact O-CG 3.27Å; E229-L233 WeakPolarHBondContact O-CG 3.48Å; E229-L233 PolarHBondContact O-N 2.73Å |
| 230 | L | 93.6 | Very high | 89.4 | Confident | 113 Ų | 113 | 103.1 Ų | 103.1 | 59% | 0.592 | 51% | 0.507 | S | S | * | . | H | α-helix | trans | -65.1 | -35.3 | 176.3 | -76.2 | 170.1 | 0 | 0 | 0 | 111.9 | H226 E228 Q234 | H226-L230 WeakPolarHBondContact O-CB 3.26Å; H226-L230 WeakPolarHBondContact O-CD1 3.49Å; H226-L230 WeakPolarHBondContact O-CG 3.4Å; H226-L230 PolarHBondContact O-N 3.47Å; E228-L230 PolarHBondContact O-N 3.43Å; L230-Q234 WeakPolarHBondContact O-CB 3.4Å; L230-Q234 PolarHBondContact O-N 2.92Å |
| 231 | R | 94.6 | Very high | 86.9 | Confident | 117 Ų | 117 | 107.1 Ų | 107.1 | 44% | 0.442 | 52% | 0.516 | S | S | . | . | H | α-helix | trans | -69 | -45.9 | 175.7 | -169.1 | -175.3 | -48.4 | 106.6 | 13.4 | 111.2 | E227 E228 E229 L233 Q234 E235 | E227-R231 WeakPolarHBondContact O-CB 3.29Å; E227-R231 PolarHBondContact O-N 2.98Å; E227-R231 PolarHBondContact O-NH2 3.42Å; E228-R231 VanDerWaalsContact CG-NH1 3.34Å; E228-R231 WeakPolarHBondContact O-CB 3.25Å; E228-R231 PolarHBondContact O-N 2.98Å; E228-R231 VanDerWaalsContact O-N 3.11Å; E229-R231 VanDerWaalsContact C-N 3.31Å; E229-R231 PolarHBondContact O-N 2.97Å; R231-L233 PolarHBondContact O-N 3.37Å; R231-Q234 PolarHBondContact O-N 3.27Å; R231-E235 WeakPolarHBondContact O-CB 3.4Å; R231-E235 WeakPolarHBondContact O-CG 3.33Å; R231-E235 PolarHBondContact O-N 3.35Å |
| 232 | E | 92.3 | Very high | 84.3 | Confident | 121 Ų | 121 | 105.2 Ų | 105.2 | 57% | 0.565 | 51% | 0.514 | S | S | * | . | H | α-helix | trans | -60.1 | -44.2 | 174.7 | -73.1 | -173.1 | -172.2 | 0 | 0 | 111.7 | E228 E229 Q234 E235 Q236 | E228-E232 PolarHBondContact O-N 2.88Å; E229-E232 PolarHBondContact O-N 3.07Å; E232-Q234 VanDerWaalsContact C-N 3.34Å; E232-Q234 PolarHBondContact O-N 3.03Å; E232-E235 PolarHBondContact O-N 3.38Å; E232-Q236 WeakPolarHBondContact O-CB 3.35Å; E232-Q236 WeakPolarHBondContact O-CG 3.48Å; E232-Q236 PolarHBondContact O-N 3.38Å |
| 233 | L | 88.8 | Confident | 81.9 | Confident | 102 Ų | 102 | 110 Ų | 110 | 53% | 0.534 | 53% | 0.534 | S | S | . | . | H | α-helix | trans | -63.8 | -38.8 | 175 | -74.2 | 170 | 0 | 0 | 0 | 111.9 | E229 R231 Q236 L237 | E229-L233 WeakPolarHBondContact O-CB 3.46Å; E229-L233 VanDerWaalsContact O-CG 3.27Å; E229-L233 WeakPolarHBondContact O-CG 3.48Å; E229-L233 PolarHBondContact O-N 2.73Å; R231-L233 PolarHBondContact O-N 3.37Å; L233-Q236 PolarHBondContact O-N 3.12Å; L233-L237 VanDerWaalsContact O-CB 3.31Å; L233-L237 WeakPolarHBondContact O-CB 3.29Å; L233-L237 PolarHBondContact O-N 2.89Å |
| 234 | Q | 87.7 | Confident | 79.1 | Confident | 126 Ų | 126 | 108.3 Ų | 108.3 | 59% | 0.589 | 53% | 0.534 | S | S | * | . | H | α-helix | trans | -70.9 | -37 | 177.8 | -168.4 | 167.3 | 21.7 | 0 | 0 | 111.9 | L230 R231 E232 L237 M238 | L230-Q234 WeakPolarHBondContact O-CB 3.4Å; L230-Q234 PolarHBondContact O-N 2.92Å; R231-Q234 PolarHBondContact O-N 3.27Å; E232-Q234 VanDerWaalsContact C-N 3.34Å; E232-Q234 PolarHBondContact O-N 3.03Å; Q234-L237 PolarHBondContact O-N 3.37Å; Q234-M238 WeakPolarHBondContact O-CB 3.18Å; Q234-M238 WeakPolarHBondContact O-CG 3.4Å; Q234-M238 PolarHBondContact O-N 3.3Å |
| 235 | E | 87.9 | Confident | 76.3 | Confident | 124 Ų | 124 | 109.6 Ų | 109.6 | 58% | 0.579 | 55% | 0.546 | S | S | * | . | H | α-helix | trans | -66.3 | -41.6 | 171 | -75.8 | 177.8 | -159.2 | 0 | 0 | 111.7 | R231 E232 M238 A239 | R231-E235 WeakPolarHBondContact O-CB 3.4Å; R231-E235 WeakPolarHBondContact O-CG 3.33Å; R231-E235 PolarHBondContact O-N 3.35Å; E232-E235 PolarHBondContact O-N 3.38Å; E235-M238 PolarHBondContact O-N 3.42Å; E235-A239 VanDerWaalsContact O-CB 3.27Å; E235-A239 WeakPolarHBondContact O-CB 3.41Å; E235-A239 PolarHBondContact O-N 3.01Å |
| 236 | Q | 82.9 | Confident | 73.8 | Confident | 101 Ų | 101 | 112.7 Ų | 112.7 | 47% | 0.472 | 57% | 0.567 | S | S | . | * | H | α-helix | trans | -62.8 | -42.1 | 173.4 | -73.6 | 170.1 | 39.4 | 0 | 0 | 112 | E232 L233 A239 Q240 | E232-Q236 WeakPolarHBondContact O-CB 3.35Å; E232-Q236 WeakPolarHBondContact O-CG 3.48Å; E232-Q236 PolarHBondContact O-N 3.38Å; L233-Q236 PolarHBondContact O-N 3.12Å; Q236-A239 PolarHBondContact O-N 2.99Å; Q236-Q240 WeakPolarHBondContact O-CG 3.25Å; Q236-Q240 PolarHBondContact O-N 3.25Å |
| 237 | L | 77.9 | Confident | 71.1 | Confident | 102 Ų | 102 | 114.9 Ų | 114.9 | 53% | 0.534 | 58% | 0.582 | S | S | . | * | H | α-helix | trans | -68.7 | -40.5 | 178.5 | -150.6 | 167.3 | 0 | 0 | 0 | 110.7 | L233 Q234 Q240 Q241 | L233-L237 VanDerWaalsContact O-CB 3.31Å; L233-L237 WeakPolarHBondContact O-CB 3.29Å; L233-L237 PolarHBondContact O-N 2.89Å; Q234-L237 PolarHBondContact O-N 3.37Å; L237-Q240 PolarHBondContact O-N 3.34Å; L237-Q241 VanDerWaalsContact O-CB 3.31Å; L237-Q241 WeakPolarHBondContact O-CB 3.49Å; L237-Q241 PolarHBondContact O-N 2.86Å |
| 238 | M | 78 | Confident | 68.4 | Low | 91 Ų | 91 | 113.7 Ų | 113.7 | 45% | 0.448 | 58% | 0.583 | S | S | . | * | H | α-helix | trans | -62.3 | -45.1 | 170.9 | -71.4 | -69.6 | 149.5 | 0 | 0 | 111.4 | Q234 E235 Q240 Q241 V242 | Q234-M238 WeakPolarHBondContact O-CB 3.18Å; Q234-M238 WeakPolarHBondContact O-CG 3.4Å; Q234-M238 PolarHBondContact O-N 3.3Å; E235-M238 PolarHBondContact O-N 3.42Å; M238-Q240 VanDerWaalsContact C-N 3.26Å; M238-Q240 PolarHBondContact O-N 2.98Å; M238-Q241 CarbonylContact O-C 3.57Å; M238-Q241 PolarHBondContact O-N 2.88Å; M238-V242 WeakPolarHBondContact O-CB 3.2Å; M238-V242 WeakPolarHBondContact O-CG2 3.45Å; M238-V242 PolarHBondContact O-N 3.35Å |
| 239 | A | 68.6 | Low | 66.4 | Low | 75 Ų | 75 | 115.4 Ų | 115.4 | 62% | 0.62 | 60% | 0.602 | S | S | * | * | H | α-helix | trans | -62.8 | -30.1 | 176.2 | 0 | 0 | 0 | 0 | 0 | 113.2 | E235 Q236 | E235-A239 VanDerWaalsContact O-CB 3.27Å; E235-A239 WeakPolarHBondContact O-CB 3.41Å; E235-A239 PolarHBondContact O-N 3.01Å; Q236-A239 PolarHBondContact O-N 2.99Å |
| 240 | Q | 57.3 | Low | 64.7 | Low | 166 Ų | 166 | 120.5 Ų | 120.5 | 78% | 0.776 | 62% | 0.623 | S | S | * | * | H | α-helix | trans | -77.3 | -30.6 | 171.3 | -72.8 | 177.5 | 15.6 | 0 | 0 | 113.1 | Q236 L237 M238 | Q236-Q240 WeakPolarHBondContact O-CG 3.25Å; Q236-Q240 PolarHBondContact O-N 3.25Å; L237-Q240 PolarHBondContact O-N 3.34Å; M238-Q240 VanDerWaalsContact C-N 3.26Å; M238-Q240 PolarHBondContact O-N 2.98Å |
| 241 | Q | 45.4 | Very low | 63.2 | Low | 140 Ų | 140 | 119.2 Ų | 119.2 | 65% | 0.654 | 62% | 0.622 | S | S | * | * | H | α-helix | trans | -84.7 | -19.5 | 179 | -165.1 | 167.3 | 22.2 | 0 | 0 | 113 | L237 M238 H243 | L237-Q241 VanDerWaalsContact O-CB 3.31Å; L237-Q241 WeakPolarHBondContact O-CB 3.49Å; L237-Q241 PolarHBondContact O-N 2.86Å; M238-Q241 CarbonylContact O-C 3.57Å; M238-Q241 PolarHBondContact O-N 2.88Å; Q241-H243 PolarHBondContact O-N 2.96Å |
| 242 | V | 44.3 | Very low | 61.6 | Low | 80 Ų | 80 | 117.6 Ų | 117.6 | 49% | 0.485 | 62% | 0.621 | S | S | . | * | trans | -101.7 | 75.5 | -177.3 | 178.1 | 0 | 0 | 0 | 0 | 109.7 | M238 V244 | M238-V242 WeakPolarHBondContact O-CB 3.2Å; M238-V242 WeakPolarHBondContact O-CG2 3.45Å; M238-V242 PolarHBondContact O-N 3.35Å; V242-V244 VanDerWaalsContact C-N 3.28Å; V242-V244 HydrophobicContact CG1-CB 3.81Å; V242-V244 HydrophobicContact CG1-CG2 3.46Å; V242-V244 VanDerWaalsContact CG1-CG2 3.46Å; V242-V244 PolarHBondContact O-N 3.14Å | ||
| 243 | H | 46.7 | Very low | 60.5 | Low | 175 Ų | 175 | 117.5 Ų | 117.5 | 81% | 0.81 | 62% | 0.624 | S | S | * | * | trans | -72.2 | 90.5 | 156.3 | 178.5 | 63.6 | 0 | 0 | 0 | 108.3 | Q241 | Q241-H243 PolarHBondContact O-N 2.96Š| ||
| 244 | V | 37.9 | Very low | 59.9 | Low | 91 Ų | 91 | 117 Ų | 117 | 55% | 0.552 | 63% | 0.625 | S | S | * | * | trans | -118.8 | 122.1 | 175.6 | 161.7 | 0 | 0 | 0 | 0 | 109.3 | V242 V246 | V242-V244 VanDerWaalsContact C-N 3.28Å; V242-V244 HydrophobicContact CG1-CB 3.81Å; V242-V244 HydrophobicContact CG1-CG2 3.46Å; V242-V244 VanDerWaalsContact CG1-CG2 3.46Å; V242-V244 PolarHBondContact O-N 3.14Å; V244-V246 PolarHBondContact O-N 3.36Å | ||
| 245 | D | 39.8 | Very low | 59.5 | Low | 143 Ų | 143 | 112.1 Ų | 112.1 | 77% | 0.765 | 61% | 0.607 | S | S | * | * | trans | -58.7 | 105.9 | 160.4 | -80.1 | -51.1 | 0 | 0 | 0 | 108.9 | D247 | D245-D247 VanDerWaalsContact C-N 3.33Å; D245-D247 PolarHBondContact O-N 3.47Å | ||
| 246 | V | 44.7 | Very low | 59.2 | Low | 117 Ų | 117 | 108.1 Ų | 108.1 | 71% | 0.709 | 60% | 0.595 | S | S | * | * | trans | -77 | 91.1 | 167.4 | -171.4 | 0 | 0 | 0 | 0 | 106.9 | V244 V248 | V244-V246 PolarHBondContact O-N 3.36Å; V246-V248 VanDerWaalsContact C-N 3.27Å; V246-V248 HydrophobicContact CB-CG2 4.37Å; V246-V248 HydrophobicContact CG1-CG2 3.73Å; V246-V248 WeakPolarHBondContact O-CG2 3.45Å; V246-V248 PolarHBondContact O-N 2.96Å | ||
| 247 | D | 38.3 | Very low | 59.2 | Low | 148 Ų | 148 | 108.3 Ų | 108.3 | 79% | 0.791 | 60% | 0.599 | S | S | * | * | trans | -69.5 | 87.6 | 171.2 | -171.5 | 8.5 | 0 | 0 | 0 | 109.3 | D245 S249 | D245-D247 VanDerWaalsContact C-N 3.33Å; D245-D247 PolarHBondContact O-N 3.47Å; D247-S249 PolarHBondContact O-N 3.14Å | ||
| 248 | V | 41.1 | Very low | 59.7 | Low | 93 Ų | 93 | 109.5 Ų | 109.5 | 56% | 0.564 | 60% | 0.596 | S | S | * | * | trans | -71.5 | 77.7 | -178.2 | -175.9 | 0 | 0 | 0 | 0 | 109.6 | V246 K250 P251 | V246-V248 VanDerWaalsContact C-N 3.27Å; V246-V248 HydrophobicContact CB-CG2 4.37Å; V246-V248 HydrophobicContact CG1-CG2 3.73Å; V246-V248 WeakPolarHBondContact O-CG2 3.45Å; V246-V248 PolarHBondContact O-N 2.96Å; V248-K250 PolarHBondContact O-N 2.92Å; V248-P251 HydrophobicContact CG1-CG 4.34Å | ||
| 249 | S | 53 | Low | 60.2 | Low | 104 Ų | 104 | 109.7 Ų | 109.7 | 73% | 0.727 | 60% | 0.599 | S | S | * | * | trans | -54.9 | 108.7 | 159.3 | 59.3 | 0 | 0 | 0 | 0 | 108.2 | D247 P251 | D247-S249 PolarHBondContact O-N 3.14Å; S249-P251 WeakPolarHBondContact O-CD 3.47Å | ||
| 250 | K | 56.7 | Low | 61.2 | Low | 202 Ų | 202 | 110.4 Ų | 110.4 | 88% | 0.878 | 59% | 0.592 | S | S | * | * | trans | -48.5 | 109 | -159.4 | -70.2 | 177.4 | 177.9 | 176 | 0 | 113.2 | V248 | V248-K250 PolarHBondContact O-N 2.92Š| ||
| 251 | P | 62.8 | Low | 62.8 | Low | 86 Ų | 86 | 110.1 Ų | 110.1 | 56% | 0.558 | 58% | 0.583 | S | S | * | * | trans | -63.2 | 157.7 | 160.6 | -13.7 | 29.7 | 0 | 0 | 0 | 108.7 | V248 S249 L253 | V248-P251 HydrophobicContact CG1-CG 4.34Å; S249-P251 WeakPolarHBondContact O-CD 3.47Å; P251-L253 VanDerWaalsContact C-N 3.27Å; P251-L253 PolarHBondContact O-N 3.46Å | ||
| 252 | D | 61.7 | Low | 65.1 | Low | 82 Ų | 82 | 107.7 Ų | 107.7 | 44% | 0.439 | 58% | 0.578 | S | S | . | * | trans | -67.6 | 94.5 | 162.3 | 179.2 | 22.7 | 0 | 0 | 0 | 108.3 | T254 A255 A256 R258 | D252-T254 PolarHBondContact O-N 3.27Å; D252-T254 VanDerWaalsContact O-N 3.14Å; D252-T254 WeakPolarHBondContact OD1-CA 3.14Å; D252-T254 WeakPolarHBondContact OD1-CB 3.48Å; D252-T254 PolarHBondContact OD1-N 2.87Å; D252-T254 PolarHBondContact OD1-OG1 2.91Å; D252-A255 HydrophobicContact CB-CB 3.92Å; D252-A255 VanDerWaalsContact CG-N 3.35Å; D252-A255 WeakPolarHBondContact O-CA 3.45Å; D252-A255 WeakPolarHBondContact O-CB 3.49Å; D252-A255 PolarHBondContact O-N 2.73Å; D252-A255 WeakPolarHBondContact OD2-CB 3.36Å; D252-A255 PolarHBondContact OD2-N 2.74Å; D252-A255 VanDerWaalsContact OD2-N 3.12Å; D252-A256 PolarHBondContact O-N 3.32Å; D252-R258 IonicContact OD2-NH2 3.19Å; D252-R258 PolarHBondContact OD2-NH2 3.33Å | ||
| 253 | L | 68.7 | Low | 67.4 | Low | 120 Ų | 120 | 110.5 Ų | 110.5 | 63% | 0.628 | 59% | 0.586 | S | S | * | * | H | α-helix | trans | -55.8 | -28.9 | 175.6 | -172.4 | 66.8 | 0 | 0 | 0 | 110.8 | P251 A255 L257 | P251-L253 VanDerWaalsContact C-N 3.27Å; P251-L253 PolarHBondContact O-N 3.46Å; L253-A255 VanDerWaalsContact C-N 3.32Å; L253-L257 HydrophobicContact CD1-CD1 4.36Å; L253-L257 HydrophobicContact CD1-CG 4.32Å; L253-L257 HydrophobicContact CD2-CD1 4.46Å; L253-L257 HydrophobicContact CG-CD1 3.9Å; L253-L257 HydrophobicContact CG-CG 4.29Å; L253-L257 VanDerWaalsContact O-CB 3.25Å; L253-L257 WeakPolarHBondContact O-CB 3.38Å; L253-L257 WeakPolarHBondContact O-CG 3.11Å; L253-L257 PolarHBondContact O-N 3.27Å |
| 254 | T | 77 | Confident | 69.6 | Low | 90 Ų | 90 | 110.6 Ų | 110.6 | 55% | 0.552 | 58% | 0.58 | S | S | * | * | H | α-helix | trans | -67.7 | -30.4 | 173.8 | -21.6 | 0 | 0 | 0 | 0 | 112.4 | D252 R258 | D252-T254 PolarHBondContact O-N 3.27Å; D252-T254 VanDerWaalsContact O-N 3.14Å; D252-T254 WeakPolarHBondContact OD1-CA 3.14Å; D252-T254 WeakPolarHBondContact OD1-CB 3.48Å; D252-T254 PolarHBondContact OD1-N 2.87Å; D252-T254 PolarHBondContact OD1-OG1 2.91Å; T254-R258 WeakPolarHBondContact O-CB 3.49Å; T254-R258 VanDerWaalsContact O-CG 3.26Å; T254-R258 WeakPolarHBondContact O-CG 3.48Å; T254-R258 VanDerWaalsContact O-CZ 3.29Å; T254-R258 PolarHBondContact O-N 3.13Å; T254-R258 PolarHBondContact O-NE 2.71Å; T254-R258 PolarHBondContact O-NH2 2.94Å |
| 255 | A | 77.9 | Confident | 72.2 | Confident | 25 Ų | 25 | 110.9 Ų | 110.9 | 21% | 0.207 | 58% | 0.576 | C | S | . | * | H | α-helix | trans | -77.7 | -51.7 | 172.4 | 0 | 0 | 0 | 0 | 0 | 110.9 | D252 L253 L257 R258 D259 | D252-A255 HydrophobicContact CB-CB 3.92Å; D252-A255 VanDerWaalsContact CG-N 3.35Å; D252-A255 WeakPolarHBondContact O-CA 3.45Å; D252-A255 WeakPolarHBondContact O-CB 3.49Å; D252-A255 PolarHBondContact O-N 2.73Å; D252-A255 WeakPolarHBondContact OD2-CB 3.36Å; D252-A255 PolarHBondContact OD2-N 2.74Å; D252-A255 VanDerWaalsContact OD2-N 3.12Å; L253-A255 VanDerWaalsContact C-N 3.32Å; A255-L257 VanDerWaalsContact C-N 3.3Å; A255-L257 PolarHBondContact O-N 3.49Å; A255-R258 VanDerWaalsContact CA-CZ 3.49Å; A255-R258 VanDerWaalsContact CA-NH2 3.3Å; A255-R258 CarbonylContact O-C 3.6Å; A255-R258 WeakPolarHBondContact O-CA 3.5Å; A255-R258 WeakPolarHBondContact O-CB 3.45Å; A255-R258 PolarHBondContact O-N 2.82Å; A255-D259 VanDerWaalsContact O-CG 3.31Å; A255-D259 PolarHBondContact O-N 2.91Å |
| 256 | A | 82.3 | Confident | 74.9 | Confident | 40 Ų | 40 | 107.3 Ų | 107.3 | 33% | 0.331 | 56% | 0.562 | S | S | . | * | H | α-helix | trans | -56 | -43.5 | 178.8 | 0 | 0 | 0 | 0 | 0 | 112.2 | D252 D259 I260 | D252-A256 PolarHBondContact O-N 3.32Å; A256-D259 PolarHBondContact O-N 3.27Å; A256-I260 WeakPolarHBondContact O-CB 3.46Å; A256-I260 WeakPolarHBondContact O-CD1 3.5Å; A256-I260 WeakPolarHBondContact O-CG1 3.11Å; A256-I260 PolarHBondContact O-N 3.4Å |
| 257 | L | 84.1 | Confident | 77.2 | Confident | 105 Ų | 105 | 106.2 Ų | 106.2 | 55% | 0.55 | 56% | 0.555 | S | S | . | * | H | α-helix | trans | -69.7 | -29.3 | 175.5 | -69.3 | 173.1 | 0 | 0 | 0 | 113.5 | L253 A255 R261 | L253-L257 HydrophobicContact CD1-CD1 4.36Å; L253-L257 HydrophobicContact CD1-CG 4.32Å; L253-L257 HydrophobicContact CD2-CD1 4.46Å; L253-L257 HydrophobicContact CG-CD1 3.9Å; L253-L257 HydrophobicContact CG-CG 4.29Å; L253-L257 VanDerWaalsContact O-CB 3.25Å; L253-L257 WeakPolarHBondContact O-CB 3.38Å; L253-L257 WeakPolarHBondContact O-CG 3.11Å; L253-L257 PolarHBondContact O-N 3.27Å; A255-L257 VanDerWaalsContact C-N 3.3Å; A255-L257 PolarHBondContact O-N 3.49Å; L257-R261 WeakPolarHBondContact O-CB 3.27Å; L257-R261 PolarHBondContact O-N 3.37Å; L257-R261 VanDerWaalsContact O-N 3.13Å |
| 258 | R | 87.8 | Confident | 79.8 | Confident | 126 Ų | 126 | 101.7 Ų | 101.7 | 48% | 0.475 | 54% | 0.538 | S | S | . | . | H | α-helix | trans | -68.9 | -45.7 | 170.9 | -87.5 | -178.2 | -76.2 | 103.8 | -4.6 | 111.1 | D252 T254 A255 R261 V262 | D252-R258 IonicContact OD2-NH2 3.19Å; D252-R258 PolarHBondContact OD2-NH2 3.33Å; T254-R258 WeakPolarHBondContact O-CB 3.49Å; T254-R258 VanDerWaalsContact O-CG 3.26Å; T254-R258 WeakPolarHBondContact O-CG 3.48Å; T254-R258 VanDerWaalsContact O-CZ 3.29Å; T254-R258 PolarHBondContact O-N 3.13Å; T254-R258 PolarHBondContact O-NE 2.71Å; T254-R258 PolarHBondContact O-NH2 2.94Å; A255-R258 VanDerWaalsContact CA-CZ 3.49Å; A255-R258 VanDerWaalsContact CA-NH2 3.3Å; A255-R258 CarbonylContact O-C 3.6Å; A255-R258 WeakPolarHBondContact O-CA 3.5Å; A255-R258 WeakPolarHBondContact O-CB 3.45Å; A255-R258 PolarHBondContact O-N 2.82Å; R258-R261 WeakPolarHBondContact O-CB 3.34Å; R258-R261 PolarHBondContact O-N 3.23Å; R258-V262 WeakPolarHBondContact O-CG2 3.49Å; R258-V262 PolarHBondContact O-N 3.27Å |
| 259 | D | 88.3 | Confident | 82.3 | Confident | 96 Ų | 96 | 99.8 Ų | 99.8 | 51% | 0.513 | 53% | 0.529 | S | S | . | . | H | α-helix | trans | -70.7 | -41.3 | -175.7 | -61.8 | -15.1 | 0 | 0 | 0 | 111 | A255 A256 R261 V262 Q263 | A255-D259 VanDerWaalsContact O-CG 3.31Å; A255-D259 PolarHBondContact O-N 2.91Å; A256-D259 PolarHBondContact O-N 3.27Å; D259-R261 VanDerWaalsContact C-N 3.33Å; D259-R261 PolarHBondContact O-N 3.43Å; D259-V262 PolarHBondContact O-N 2.84Å; D259-Q263 WeakPolarHBondContact O-CG 3.26Å; D259-Q263 PolarHBondContact O-N 2.82Å |
| 260 | I | 90.1 | Very high | 84.4 | Confident | 90 Ų | 90 | 97.2 Ų | 97.2 | 46% | 0.462 | 51% | 0.511 | S | S | . | . | H | α-helix | trans | -57.6 | -45.8 | 169.5 | -70.8 | 164.9 | 0 | 0 | 0 | 110.5 | A256 Q263 Y264 | A256-I260 WeakPolarHBondContact O-CB 3.46Å; A256-I260 WeakPolarHBondContact O-CD1 3.5Å; A256-I260 WeakPolarHBondContact O-CG1 3.11Å; A256-I260 PolarHBondContact O-N 3.4Å; I260-Q263 PolarHBondContact O-N 3.47Å; I260-Y264 HydrophobicContact CG2-CD2 3.8Å; I260-Y264 HydrophobicContact CG2-CE2 3.92Å; I260-Y264 WeakPolarHBondContact O-CD2 3.34Å; I260-Y264 PolarHBondContact O-N 3.01Å |
| 261 | R | 90.8 | Very high | 86.2 | Confident | 159 Ų | 159 | 91.9 Ų | 91.9 | 60% | 0.6 | 49% | 0.492 | S | S | * | . | H | α-helix | trans | -62.9 | -45.1 | 177.7 | 177.4 | 176.7 | 171.6 | 164.8 | 3.4 | 112.1 | L257 R258 D259 Q263 Y264 E265 | L257-R261 WeakPolarHBondContact O-CB 3.27Å; L257-R261 PolarHBondContact O-N 3.37Å; L257-R261 VanDerWaalsContact O-N 3.13Å; R258-R261 WeakPolarHBondContact O-CB 3.34Å; R258-R261 PolarHBondContact O-N 3.23Å; D259-R261 VanDerWaalsContact C-N 3.33Å; D259-R261 PolarHBondContact O-N 3.43Å; R261-Q263 VanDerWaalsContact C-N 3.31Å; R261-Q263 PolarHBondContact O-N 2.87Å; R261-Y264 PolarHBondContact O-N 3.02Å; R261-E265 HydrophobicContact CG-CG 4.37Å; R261-E265 IonicContact CZ-OE1 3.18Å; R261-E265 IonicContact NE-OE1 2.73Å; R261-E265 PolarHBondContact NE-OE1 2.9Å; R261-E265 IonicContact NE-OE2 3.72Å; R261-E265 IonicContact NH2-OE1 2.74Å; R261-E265 PolarHBondContact NH2-OE1 3.45Å; R261-E265 WeakPolarHBondContact O-CB 3.43Å; R261-E265 WeakPolarHBondContact O-CG 2.99Å; R261-E265 PolarHBondContact O-N 3.1Å |
| 262 | V | 93.4 | Very high | 87.7 | Confident | 89 Ų | 89 | 92.6 Ų | 92.6 | 54% | 0.539 | 49% | 0.49 | S | S | . | . | H | α-helix | trans | -64.1 | -36.9 | 177.8 | 169.6 | 0 | 0 | 0 | 0 | 110.9 | R258 D259 S266 | R258-V262 WeakPolarHBondContact O-CG2 3.49Å; R258-V262 PolarHBondContact O-N 3.27Å; D259-V262 PolarHBondContact O-N 2.84Å; V262-S266 WeakPolarHBondContact O-CB 3.22Å; V262-S266 PolarHBondContact O-N 3.16Å |
| 263 | Q | 91.9 | Very high | 89.4 | Confident | 140 Ų | 140 | 94.1 Ų | 94.1 | 65% | 0.654 | 50% | 0.495 | S | S | * | . | H | α-helix | trans | -67 | -41.5 | 172.5 | -73.9 | -165.2 | -2 | 0 | 0 | 112.4 | D259 I260 R261 S266 V267 | D259-Q263 WeakPolarHBondContact O-CG 3.26Å; D259-Q263 PolarHBondContact O-N 2.82Å; I260-Q263 PolarHBondContact O-N 3.47Å; R261-Q263 VanDerWaalsContact C-N 3.31Å; R261-Q263 PolarHBondContact O-N 2.87Å; Q263-S266 PolarHBondContact O-N 2.99Å; Q263-V267 WeakPolarHBondContact O-CB 3.49Å; Q263-V267 VanDerWaalsContact O-CG2 3.3Å; Q263-V267 WeakPolarHBondContact O-CG2 3.36Å; Q263-V267 PolarHBondContact O-N 3.49Å |
| 264 | Y | 93.6 | Very high | 90.7 | Very high | 176 Ų | 176 | 93.7 Ų | 93.7 | 69% | 0.69 | 49% | 0.49 | S | S | * | . | H | α-helix | trans | -64 | -42.1 | 173.7 | -90.7 | -71 | 0 | 0 | 0 | 112.8 | I260 R261 A268 | I260-Y264 HydrophobicContact CG2-CD2 3.8Å; I260-Y264 HydrophobicContact CG2-CE2 3.92Å; I260-Y264 WeakPolarHBondContact O-CD2 3.34Å; I260-Y264 PolarHBondContact O-N 3.01Å; R261-Y264 PolarHBondContact O-N 3.02Å; Y264-A268 WeakPolarHBondContact O-CB 2.78Å; Y264-A268 PolarHBondContact O-N 2.89Å |
| 265 | E | 93.3 | Very high | 91.5 | Very high | 97 Ų | 97 | 92.3 Ų | 92.3 | 45% | 0.453 | 48% | 0.481 | S | S | . | . | H | α-helix | trans | -65.3 | -39.1 | 175.6 | -72.7 | 174.9 | 167.9 | 0 | 0 | 111.1 | R261 S269 | R261-E265 HydrophobicContact CG-CG 4.37Å; R261-E265 IonicContact CZ-OE1 3.18Å; R261-E265 IonicContact NE-OE1 2.73Å; R261-E265 PolarHBondContact NE-OE1 2.9Å; R261-E265 IonicContact NE-OE2 3.72Å; R261-E265 IonicContact NH2-OE1 2.74Å; R261-E265 PolarHBondContact NH2-OE1 3.45Å; R261-E265 WeakPolarHBondContact O-CB 3.43Å; R261-E265 WeakPolarHBondContact O-CG 2.99Å; R261-E265 PolarHBondContact O-N 3.1Å; E265-S269 WeakPolarHBondContact O-CB 3.44Å; E265-S269 PolarHBondContact O-N 3.26Å; E265-S269 PolarHBondContact O-OG 3.46Å |
| 266 | S | 95.1 | Very high | 92.4 | Very high | 68 Ų | 68 | 95.5 Ų | 95.5 | 48% | 0.476 | 49% | 0.492 | S | S | . | . | H | α-helix | trans | -63.6 | -53.2 | 173.9 | -173.8 | 0 | 0 | 0 | 0 | 112.2 | V262 Q263 A268 S269 S270 | V262-S266 WeakPolarHBondContact O-CB 3.22Å; V262-S266 PolarHBondContact O-N 3.16Å; Q263-S266 PolarHBondContact O-N 2.99Å; S266-A268 VanDerWaalsContact C-N 3.34Å; S266-A268 PolarHBondContact O-N 3.33Å; S266-S269 PolarHBondContact O-N 2.69Å; S266-S269 VanDerWaalsContact O-N 3.08Å; S266-S269 PolarHBondContact O-OG 2.85Å; S266-S270 PolarHBondContact O-N 2.92Å |
| 267 | V | 93.7 | Very high | 93 | Very high | 94 Ų | 94 | 99.4 Ų | 99.4 | 57% | 0.57 | 50% | 0.503 | S | S | * | . | H | α-helix | trans | -62.7 | -39.4 | 179.6 | 170 | 0 | 0 | 0 | 0 | 111.5 | Q263 S269 S270 N271 | Q263-V267 WeakPolarHBondContact O-CB 3.49Å; Q263-V267 VanDerWaalsContact O-CG2 3.3Å; Q263-V267 WeakPolarHBondContact O-CG2 3.36Å; Q263-V267 PolarHBondContact O-N 3.49Å; V267-S269 VanDerWaalsContact C-N 3.35Å; V267-S270 PolarHBondContact O-N 3.03Å; V267-N271 VanDerWaalsContact O-CB 3.29Å; V267-N271 WeakPolarHBondContact O-CB 3.41Å; V267-N271 PolarHBondContact O-N 3.32Å |
| 268 | A | 93.4 | Very high | 93.6 | Very high | 53 Ų | 53 | 102 Ų | 102 | 44% | 0.438 | 51% | 0.506 | S | S | . | . | H | α-helix | trans | -62.7 | -41.2 | 173.1 | 0 | 0 | 0 | 0 | 0 | 111.9 | Y264 S266 I272 | Y264-A268 WeakPolarHBondContact O-CB 2.78Å; Y264-A268 PolarHBondContact O-N 2.89Å; S266-A268 VanDerWaalsContact C-N 3.34Å; S266-A268 PolarHBondContact O-N 3.33Å; A268-I272 WeakPolarHBondContact O-CD1 3.29Å; A268-I272 VanDerWaalsContact O-CG1 3.29Å; A268-I272 WeakPolarHBondContact O-CG1 3.29Å; A268-I272 PolarHBondContact O-N 2.81Å; A268-I272 VanDerWaalsContact O-N 3.1Å |
| 269 | S | 94.1 | Very high | 94.1 | Very high | 54 Ų | 54 | 102.2 Ų | 102.2 | 38% | 0.378 | 51% | 0.508 | S | S | . | . | H | α-helix | trans | -68 | -38 | 176.6 | 76.3 | 0 | 0 | 0 | 0 | 113 | E265 S266 V267 I272 Q273 | E265-S269 WeakPolarHBondContact O-CB 3.44Å; E265-S269 PolarHBondContact O-N 3.26Å; E265-S269 PolarHBondContact O-OG 3.46Å; S266-S269 PolarHBondContact O-N 2.69Å; S266-S269 VanDerWaalsContact O-N 3.08Å; S266-S269 PolarHBondContact O-OG 2.85Å; V267-S269 VanDerWaalsContact C-N 3.35Å; S269-I272 PolarHBondContact O-N 3.43Å; S269-Q273 WeakPolarHBondContact O-CG 3.45Å; S269-Q273 PolarHBondContact O-N 2.72Å |
| 270 | S | 95.3 | Very high | 94.5 | Very high | 49 Ų | 49 | 104.4 Ų | 104.4 | 34% | 0.343 | 51% | 0.509 | S | S | . | . | H | α-helix | trans | -64.2 | -49.1 | 175.3 | -157.6 | 0 | 0 | 0 | 0 | 110.5 | S266 V267 I272 Q273 E274 | S266-S270 PolarHBondContact O-N 2.92Å; V267-S270 PolarHBondContact O-N 3.03Å; S270-I272 VanDerWaalsContact C-N 3.31Å; S270-I272 PolarHBondContact O-N 2.96Å; S270-Q273 CarbonylContact O-C 3.48Å; S270-Q273 PolarHBondContact O-N 3.01Å; S270-E274 VanDerWaalsContact C-OE1 3.3Å; S270-E274 VanDerWaalsContact CB-OE1 3.29Å; S270-E274 WeakPolarHBondContact CB-OE1 3.3Å; S270-E274 WeakPolarHBondContact O-CB 3.35Å; S270-E274 VanDerWaalsContact O-CG 3.28Å; S270-E274 WeakPolarHBondContact O-CG 3.47Å; S270-E274 PolarHBondContact O-N 3.18Å; S270-E274 PolarHBondContact OG-OE1 3.25Å |
| 271 | N | 94.8 | Very high | 94.9 | Very high | 91 Ų | 91 | 103.4 Ų | 103.4 | 49% | 0.487 | 51% | 0.51 | S | S | . | . | H | α-helix | trans | -58.9 | -39.5 | 177.8 | -168.6 | -67.8 | 0 | 0 | 0 | 112.5 | V267 T275 | V267-N271 VanDerWaalsContact O-CB 3.29Å; V267-N271 WeakPolarHBondContact O-CB 3.41Å; V267-N271 PolarHBondContact O-N 3.32Å; N271-T275 WeakPolarHBondContact O-CB 3.49Å; N271-T275 WeakPolarHBondContact O-CG2 3.37Å; N271-T275 PolarHBondContact O-N 2.95Å; N271-T275 PolarHBondContact O-OG1 2.87Å |
| 272 | I | 95.8 | Very high | 95.2 | Very high | 100 Ų | 100 | 100.3 Ų | 100.3 | 51% | 0.513 | 50% | 0.5 | S | S | . | . | H | α-helix | trans | -65.5 | -42.8 | 174.1 | -69.5 | 166.3 | 0 | 0 | 0 | 111.3 | A268 S269 S270 T275 E276 | A268-I272 WeakPolarHBondContact O-CD1 3.29Å; A268-I272 VanDerWaalsContact O-CG1 3.29Å; A268-I272 WeakPolarHBondContact O-CG1 3.29Å; A268-I272 PolarHBondContact O-N 2.81Å; A268-I272 VanDerWaalsContact O-N 3.1Å; S269-I272 PolarHBondContact O-N 3.43Å; S270-I272 VanDerWaalsContact C-N 3.31Å; S270-I272 PolarHBondContact O-N 2.96Å; I272-T275 PolarHBondContact O-OG1 2.68Å; I272-E276 WeakPolarHBondContact O-CB 3.46Å; I272-E276 WeakPolarHBondContact O-CG 3.5Å; I272-E276 PolarHBondContact O-N 3.34Å |
| 273 | Q | 96.5 | Very high | 95.4 | Very high | 114 Ų | 114 | 102.6 Ų | 102.6 | 53% | 0.533 | 50% | 0.503 | S | S | . | . | H | α-helix | trans | -67.2 | -47 | 177.5 | -71.4 | 172.9 | 20.6 | 0 | 0 | 111.9 | S269 S270 T275 E276 E277 | S269-Q273 WeakPolarHBondContact O-CG 3.45Å; S269-Q273 PolarHBondContact O-N 2.72Å; S270-Q273 CarbonylContact O-C 3.48Å; S270-Q273 PolarHBondContact O-N 3.01Å; Q273-T275 VanDerWaalsContact C-N 3.34Å; Q273-T275 PolarHBondContact O-N 3.26Å; Q273-E276 PolarHBondContact O-N 2.93Å; Q273-E277 WeakPolarHBondContact O-CB 3.46Å; Q273-E277 WeakPolarHBondContact O-CG 3.37Å; Q273-E277 PolarHBondContact O-N 3.36Å |
| 274 | E | 95.6 | Very high | 95.7 | Very high | 112 Ų | 112 | 98.6 Ų | 98.6 | 52% | 0.523 | 50% | 0.495 | S | S | . | . | H | α-helix | trans | -58.9 | -42.5 | 176.4 | -71.3 | 162.8 | -128.8 | 0 | 0 | 111.8 | S270 W278 | S270-E274 VanDerWaalsContact C-OE1 3.3Å; S270-E274 VanDerWaalsContact CB-OE1 3.29Å; S270-E274 WeakPolarHBondContact CB-OE1 3.3Å; S270-E274 WeakPolarHBondContact O-CB 3.35Å; S270-E274 VanDerWaalsContact O-CG 3.28Å; S270-E274 WeakPolarHBondContact O-CG 3.47Å; S270-E274 PolarHBondContact O-N 3.18Å; S270-E274 PolarHBondContact OG-OE1 3.25Å; E274-W278 WeakPolarHBondContact O-CB 3.22Å; E274-W278 PolarHBondContact O-N 3.48Å |
| 275 | T | 94.1 | Very high | 95.9 | Very high | 61 Ų | 61 | 94.1 Ų | 94.1 | 37% | 0.374 | 48% | 0.483 | S | S | . | . | H | α-helix | trans | -71 | -41 | 176.1 | 51.3 | 0 | 0 | 0 | 0 | 112.2 | N271 I272 Q273 E277 W278 Y279 | N271-T275 WeakPolarHBondContact O-CB 3.49Å; N271-T275 WeakPolarHBondContact O-CG2 3.37Å; N271-T275 PolarHBondContact O-N 2.95Å; N271-T275 PolarHBondContact O-OG1 2.87Å; I272-T275 PolarHBondContact O-OG1 2.68Å; Q273-T275 VanDerWaalsContact C-N 3.34Å; Q273-T275 PolarHBondContact O-N 3.26Å; T275-E277 PolarHBondContact O-N 3.49Å; T275-W278 PolarHBondContact O-N 3.41Å; T275-Y279 WeakPolarHBondContact O-CB 3.49Å; T275-Y279 WeakPolarHBondContact O-CD2 3.39Å; T275-Y279 PolarHBondContact O-N 2.88Å |
| 276 | E | 96.1 | Very high | 96 | Very high | 92 Ų | 92 | 94.5 Ų | 94.5 | 43% | 0.43 | 49% | 0.487 | S | S | . | . | H | α-helix | trans | -59.3 | -44.3 | 171.8 | -80.6 | -168.7 | 173.3 | 0 | 0 | 112.3 | I272 Q273 Y279 R280 | I272-E276 WeakPolarHBondContact O-CB 3.46Å; I272-E276 WeakPolarHBondContact O-CG 3.5Å; I272-E276 PolarHBondContact O-N 3.34Å; Q273-E276 PolarHBondContact O-N 2.93Å; E276-Y279 PolarHBondContact O-N 3.06Å; E276-R280 WeakPolarHBondContact O-CB 3.18Å; E276-R280 VanDerWaalsContact O-CG 3.25Å; E276-R280 WeakPolarHBondContact O-CG 3.33Å; E276-R280 PolarHBondContact O-N 3.29Å; E276-R280 IonicContact OE2-CZ 3.79Å; E276-R280 IonicContact OE2-NH1 3.41Å; E276-R280 PolarHBondContact OE2-NH1 2.91Å; E276-R280 IonicContact OE2-NH2 2.74Å; E276-R280 PolarHBondContact OE2-NH2 2.83Å |
| 277 | E | 96.3 | Very high | 96.1 | Very high | 121 Ų | 121 | 95.5 Ų | 95.5 | 57% | 0.565 | 49% | 0.49 | S | S | * | . | H | α-helix | trans | -69.2 | -39.2 | 178.8 | -72.7 | -175.6 | 177.5 | 0 | 0 | 112.1 | Q273 T275 R280 S281 | Q273-E277 WeakPolarHBondContact O-CB 3.46Å; Q273-E277 WeakPolarHBondContact O-CG 3.37Å; Q273-E277 PolarHBondContact O-N 3.36Å; T275-E277 PolarHBondContact O-N 3.49Å; E277-R280 PolarHBondContact O-N 2.93Å; E277-S281 VanDerWaalsContact O-CB 3.28Å; E277-S281 WeakPolarHBondContact O-CB 3.18Å; E277-S281 PolarHBondContact O-N 3.23Å |
| 278 | W | 96.7 | Very high | 96.3 | Very high | 160 Ų | 160 | 94.6 Ų | 94.6 | 61% | 0.606 | 48% | 0.483 | S | S | * | . | H | α-helix | trans | -60.4 | -46.2 | 171.7 | -174.6 | 89.4 | 0 | 0 | 0 | 111.5 | E274 T275 S281 K282 | E274-W278 WeakPolarHBondContact O-CB 3.22Å; E274-W278 PolarHBondContact O-N 3.48Å; T275-W278 PolarHBondContact O-N 3.41Å; W278-S281 PolarHBondContact O-N 3.36Å; W278-K282 WeakPolarHBondContact O-CB 3.49Å; W278-K282 PolarHBondContact O-N 2.71Å |
| 279 | Y | 97.1 | Very high | 96.4 | Very high | 131 Ų | 131 | 94.7 Ų | 94.7 | 51% | 0.514 | 48% | 0.483 | S | S | . | . | H | α-helix | trans | -63.8 | -45.3 | 174.5 | -79.1 | -60.9 | 0 | 0 | 0 | 112 | T275 E276 S281 K282 F283 | T275-Y279 WeakPolarHBondContact O-CB 3.49Å; T275-Y279 WeakPolarHBondContact O-CD2 3.39Å; T275-Y279 PolarHBondContact O-N 2.88Å; E276-Y279 PolarHBondContact O-N 3.06Å; Y279-S281 VanDerWaalsContact C-N 3.35Å; Y279-S281 PolarHBondContact O-N 3.45Å; Y279-K282 PolarHBondContact O-N 2.85Å; Y279-F283 HydrophobicContact CD1-CE2 4.49Å; Y279-F283 WeakPolarHBondContact O-CD2 3.34Å; Y279-F283 PolarHBondContact O-N 2.93Å |
| 280 | R | 97.9 | Very high | 96.6 | Very high | 141 Ų | 141 | 95 Ų | 95 | 53% | 0.532 | 49% | 0.489 | S | S | . | . | H | α-helix | trans | -57 | -47.6 | 175.7 | -76.5 | 172.2 | -170.3 | 124.7 | 11.1 | 111.4 | E276 E277 F283 A284 | E276-R280 WeakPolarHBondContact O-CB 3.18Å; E276-R280 VanDerWaalsContact O-CG 3.25Å; E276-R280 WeakPolarHBondContact O-CG 3.33Å; E276-R280 PolarHBondContact O-N 3.29Å; E276-R280 IonicContact OE2-CZ 3.79Å; E276-R280 IonicContact OE2-NH1 3.41Å; E276-R280 PolarHBondContact OE2-NH1 2.91Å; E276-R280 IonicContact OE2-NH2 2.74Å; E276-R280 PolarHBondContact OE2-NH2 2.83Å; E277-R280 PolarHBondContact O-N 2.93Å; R280-F283 PolarHBondContact O-N 3.42Å; R280-A284 WeakPolarHBondContact O-CB 3.25Å; R280-A284 PolarHBondContact O-N 3.13Å |
| 281 | S | 97.8 | Very high | 96.7 | Very high | 69 Ų | 69 | 95.9 Ų | 95.9 | 48% | 0.483 | 49% | 0.493 | S | S | . | . | H | α-helix | trans | -60.6 | -45.1 | 176.7 | -168.6 | 0 | 0 | 0 | 0 | 111 | E277 W278 Y279 F283 A284 D285 | E277-S281 VanDerWaalsContact O-CB 3.28Å; E277-S281 WeakPolarHBondContact O-CB 3.18Å; E277-S281 PolarHBondContact O-N 3.23Å; W278-S281 PolarHBondContact O-N 3.36Å; Y279-S281 VanDerWaalsContact C-N 3.35Å; Y279-S281 PolarHBondContact O-N 3.45Å; S281-F283 PolarHBondContact O-N 3.24Å; S281-A284 WeakPolarHBondContact O-CB 3.32Å; S281-A284 PolarHBondContact O-N 2.88Å; S281-D285 PolarHBondContact O-N 3.17Å |
| 282 | K | 97.6 | Very high | 96.8 | Very high | 94 Ų | 94 | 99 Ų | 99 | 41% | 0.409 | 50% | 0.497 | S | S | . | . | H | α-helix | trans | -66.3 | -36.3 | 178.1 | -152.8 | 73.9 | -157.1 | 153.9 | 0 | 113.7 | W278 Y279 D285 L286 | W278-K282 WeakPolarHBondContact O-CB 3.49Å; W278-K282 PolarHBondContact O-N 2.71Å; Y279-K282 PolarHBondContact O-N 2.85Å; K282-D285 IonicContact NZ-OD2 2.74Å; K282-D285 PolarHBondContact NZ-OD2 2.98Å; K282-L286 WeakPolarHBondContact O-CB 3.17Å; K282-L286 WeakPolarHBondContact O-CD1 3.45Å; K282-L286 VanDerWaalsContact O-CG 3.23Å; K282-L286 WeakPolarHBondContact O-CG 3.45Å; K282-L286 PolarHBondContact O-N 2.82Å; K282-L286 VanDerWaalsContact O-N 3.1Å |
| 283 | F | 97.3 | Very high | 96.8 | Very high | 137 Ų | 137 | 99.6 Ų | 99.6 | 60% | 0.601 | 50% | 0.502 | S | S | * | . | H | α-helix | trans | -70.1 | -35.6 | 172.4 | -77.4 | -60.9 | 0 | 0 | 0 | 112.1 | Y279 R280 S281 T287 | Y279-F283 HydrophobicContact CD1-CE2 4.49Å; Y279-F283 WeakPolarHBondContact O-CD2 3.34Å; Y279-F283 PolarHBondContact O-N 2.93Å; R280-F283 PolarHBondContact O-N 3.42Å; S281-F283 PolarHBondContact O-N 3.24Å; F283-T287 WeakPolarHBondContact O-CB 3.47Å; F283-T287 PolarHBondContact O-N 3.44Å; F283-T287 PolarHBondContact O-OG1 2.74Å |
| 284 | A | 97.8 | Very high | 96.8 | Very high | 57 Ų | 57 | 97 Ų | 97 | 47% | 0.471 | 50% | 0.5 | S | S | . | . | H | α-helix | trans | -61.5 | -59.1 | 170.9 | 0 | 0 | 0 | 0 | 0 | 110.1 | R280 S281 L286 T287 D288 | R280-A284 WeakPolarHBondContact O-CB 3.25Å; R280-A284 PolarHBondContact O-N 3.13Å; S281-A284 WeakPolarHBondContact O-CB 3.32Å; S281-A284 PolarHBondContact O-N 2.88Å; A284-L286 VanDerWaalsContact C-N 3.28Å; A284-L286 PolarHBondContact O-N 3Å; A284-L286 VanDerWaalsContact O-N 3.16Å; A284-T287 WeakPolarHBondContact O-CA 3.45Å; A284-T287 WeakPolarHBondContact O-CB 3.48Å; A284-T287 PolarHBondContact O-N 3.19Å; A284-D288 VanDerWaalsContact O-CB 3.31Å; A284-D288 WeakPolarHBondContact O-CB 3.31Å; A284-D288 PolarHBondContact O-N 3.18Å |
| 285 | D | 97.1 | Very high | 96.8 | Very high | 82 Ų | 82 | 95.4 Ų | 95.4 | 44% | 0.439 | 50% | 0.495 | S | S | . | . | H | α-helix | trans | -43.5 | -50.6 | 175.6 | -79.6 | -11.9 | 0 | 0 | 0 | 112.8 | S281 K282 D288 A289 | S281-D285 PolarHBondContact O-N 3.17Å; K282-D285 IonicContact NZ-OD2 2.74Å; K282-D285 PolarHBondContact NZ-OD2 2.98Å; D285-D288 PolarHBondContact O-N 2.99Å; D285-A289 VanDerWaalsContact O-CB 3.31Å; D285-A289 WeakPolarHBondContact O-CB 3.2Å; D285-A289 PolarHBondContact O-N 2.84Å |
| 286 | L | 96.6 | Very high | 96.8 | Very high | 105 Ų | 105 | 95.1 Ų | 95.1 | 55% | 0.55 | 50% | 0.499 | S | S | . | . | H | α-helix | trans | -68.6 | -38.3 | -177.7 | -72.9 | 170.3 | 0 | 0 | 0 | 112.3 | K282 A284 A290 | K282-L286 WeakPolarHBondContact O-CB 3.17Å; K282-L286 WeakPolarHBondContact O-CD1 3.45Å; K282-L286 VanDerWaalsContact O-CG 3.23Å; K282-L286 WeakPolarHBondContact O-CG 3.45Å; K282-L286 PolarHBondContact O-N 2.82Å; K282-L286 VanDerWaalsContact O-N 3.1Å; A284-L286 VanDerWaalsContact C-N 3.28Å; A284-L286 PolarHBondContact O-N 3Å; A284-L286 VanDerWaalsContact O-N 3.16Å; L286-A290 WeakPolarHBondContact O-CB 3.43Å; L286-A290 PolarHBondContact O-N 3.37Å |
| 287 | T | 97.3 | Very high | 96.8 | Very high | 88 Ų | 88 | 95 Ų | 95 | 54% | 0.54 | 50% | 0.501 | S | S | . | . | H | α-helix | trans | -65.6 | -43.2 | 174.2 | -56.9 | 0 | 0 | 0 | 0 | 110.5 | F283 A284 A290 T291 | F283-T287 WeakPolarHBondContact O-CB 3.47Å; F283-T287 PolarHBondContact O-N 3.44Å; F283-T287 PolarHBondContact O-OG1 2.74Å; A284-T287 WeakPolarHBondContact O-CA 3.45Å; A284-T287 WeakPolarHBondContact O-CB 3.48Å; A284-T287 PolarHBondContact O-N 3.19Å; T287-A290 WeakPolarHBondContact O-CB 3.33Å; T287-A290 PolarHBondContact O-N 3.37Å; T287-T291 WeakPolarHBondContact O-CG2 3.29Å; T287-T291 PolarHBondContact O-N 3.24Å; T287-T291 PolarHBondContact O-OG1 2.91Å |
| 288 | D | 97.8 | Very high | 96.9 | Very high | 76 Ų | 76 | 94.4 Ų | 94.4 | 41% | 0.406 | 49% | 0.493 | S | S | . | . | H | α-helix | trans | -72.5 | -27.8 | -177.8 | -133.9 | 43.3 | 0 | 0 | 0 | 112.2 | A284 D285 T291 R292 | A284-D288 VanDerWaalsContact O-CB 3.31Å; A284-D288 WeakPolarHBondContact O-CB 3.31Å; A284-D288 PolarHBondContact O-N 3.18Å; D285-D288 PolarHBondContact O-N 2.99Å; D288-T291 WeakPolarHBondContact CA-OG1 3.44Å; D288-T291 PolarHBondContact O-OG1 3.15Å; D288-R292 VanDerWaalsContact C-NH1 3.27Å; D288-R292 VanDerWaalsContact CB-NH1 3.3Å; D288-R292 WeakPolarHBondContact O-CD 3.42Å; D288-R292 VanDerWaalsContact O-CG 3.22Å; D288-R292 WeakPolarHBondContact O-CG 3.48Å; D288-R292 PolarHBondContact O-N 3.02Å; D288-R292 PolarHBondContact O-NH1 3.41Å; D288-R292 IonicContact OD2-CZ 3.52Å; D288-R292 IonicContact OD2-NH1 3.18Å; D288-R292 PolarHBondContact OD2-NH1 3.47Å; D288-R292 IonicContact OD2-NH2 2.73Å; D288-R292 PolarHBondContact OD2-NH2 3.13Å |
| 289 | A | 96.2 | Very high | 96.8 | Very high | 55 Ų | 55 | 90.6 Ų | 90.6 | 46% | 0.455 | 48% | 0.484 | S | S | . | . | H | α-helix | trans | -73.6 | -40.1 | 167.8 | 0 | 0 | 0 | 0 | 0 | 111.6 | D285 N293 | D285-A289 VanDerWaalsContact O-CB 3.31Å; D285-A289 WeakPolarHBondContact O-CB 3.2Å; D285-A289 PolarHBondContact O-N 2.84Å; A289-N293 WeakPolarHBondContact O-CB 3.36Å; A289-N293 PolarHBondContact O-N 3Å |
| 290 | A | 96.6 | Very high | 96.5 | Very high | 61 Ų | 61 | 87 Ų | 87 | 50% | 0.504 | 48% | 0.482 | S | S | . | . | H | α-helix | trans | -66.4 | -40.9 | 178.3 | 0 | 0 | 0 | 0 | 0 | 112.7 | L286 T287 N293 A294 | L286-A290 WeakPolarHBondContact O-CB 3.43Å; L286-A290 PolarHBondContact O-N 3.37Å; T287-A290 WeakPolarHBondContact O-CB 3.33Å; T287-A290 PolarHBondContact O-N 3.37Å; A290-N293 PolarHBondContact O-N 2.98Å; A290-A294 WeakPolarHBondContact O-CB 3.34Å; A290-A294 PolarHBondContact O-N 3.27Å |
| 291 | T | 97.2 | Very high | 96.4 | Very high | 67 Ų | 67 | 86.2 Ų | 86.2 | 41% | 0.411 | 48% | 0.482 | S | S | . | . | H | α-helix | trans | -64.5 | -48.2 | 175.2 | 52.3 | 0 | 0 | 0 | 0 | 111.5 | T287 D288 N293 A294 D295 | T287-T291 WeakPolarHBondContact O-CG2 3.29Å; T287-T291 PolarHBondContact O-N 3.24Å; T287-T291 PolarHBondContact O-OG1 2.91Å; D288-T291 WeakPolarHBondContact CA-OG1 3.44Å; D288-T291 PolarHBondContact O-OG1 3.15Å; T291-N293 VanDerWaalsContact C-N 3.31Å; T291-N293 PolarHBondContact O-N 3.02Å; T291-A294 PolarHBondContact O-N 2.76Å; T291-A294 VanDerWaalsContact O-N 3.15Å; T291-D295 PolarHBondContact O-N 3.04Å |
| 292 | R | 96.8 | Very high | 96.3 | Very high | 155 Ų | 155 | 88 Ų | 88 | 59% | 0.585 | 48% | 0.483 | S | S | * | . | H | α-helix | trans | -57.2 | -41.9 | 175.8 | -72.9 | 177 | -172.7 | 99.5 | 4.2 | 112.5 | D288 D295 A296 | D288-R292 VanDerWaalsContact C-NH1 3.27Å; D288-R292 VanDerWaalsContact CB-NH1 3.3Å; D288-R292 WeakPolarHBondContact O-CD 3.42Å; D288-R292 VanDerWaalsContact O-CG 3.22Å; D288-R292 WeakPolarHBondContact O-CG 3.48Å; D288-R292 PolarHBondContact O-N 3.02Å; D288-R292 PolarHBondContact O-NH1 3.41Å; D288-R292 IonicContact OD2-CZ 3.52Å; D288-R292 IonicContact OD2-NH1 3.18Å; D288-R292 PolarHBondContact OD2-NH1 3.47Å; D288-R292 IonicContact OD2-NH2 2.73Å; D288-R292 PolarHBondContact OD2-NH2 3.13Å; R292-D295 PolarHBondContact O-N 2.99Å; R292-A296 WeakPolarHBondContact O-CB 3.3Å; R292-A296 PolarHBondContact O-N 3.31Å |
| 293 | N | 96.4 | Very high | 96.1 | Very high | 113 Ų | 113 | 88.5 Ų | 88.5 | 60% | 0.604 | 49% | 0.487 | S | S | * | . | H | α-helix | trans | -68.2 | -40.2 | 177 | -166 | -3.1 | 0 | 0 | 0 | 111.8 | A289 A290 T291 D295 A296 L297 | A289-N293 WeakPolarHBondContact O-CB 3.36Å; A289-N293 PolarHBondContact O-N 3Å; A290-N293 PolarHBondContact O-N 2.98Å; T291-N293 VanDerWaalsContact C-N 3.31Å; T291-N293 PolarHBondContact O-N 3.02Å; N293-D295 PolarHBondContact O-N 3.05Å; N293-A296 PolarHBondContact O-N 2.92Å; N293-L297 WeakPolarHBondContact O-CB 3.2Å; N293-L297 PolarHBondContact O-N 3.36Å |
| 294 | A | 96.3 | Very high | 95.8 | Very high | 61 Ų | 61 | 84 Ų | 84 | 50% | 0.504 | 48% | 0.479 | S | S | . | . | H | α-helix | trans | -62.9 | -40 | 174.6 | 0 | 0 | 0 | 0 | 0 | 112.6 | A290 T291 R298 | A290-A294 WeakPolarHBondContact O-CB 3.34Å; A290-A294 PolarHBondContact O-N 3.27Å; T291-A294 PolarHBondContact O-N 2.76Å; T291-A294 VanDerWaalsContact O-N 3.15Å; A294-R298 WeakPolarHBondContact O-CB 3.23Å; A294-R298 PolarHBondContact O-N 2.88Å |
| 295 | D | 97.1 | Very high | 95.6 | Very high | 77 Ų | 77 | 84.5 Ų | 84.5 | 41% | 0.412 | 47% | 0.474 | S | S | . | . | H | α-helix | trans | -70.6 | -40.3 | 175.2 | -95.5 | -47.6 | 0 | 0 | 0 | 112.8 | T291 R292 N293 L297 R298 L299 | T291-D295 PolarHBondContact O-N 3.04Å; R292-D295 PolarHBondContact O-N 2.99Å; N293-D295 PolarHBondContact O-N 3.05Å; D295-L297 VanDerWaalsContact C-N 3.34Å; D295-L297 PolarHBondContact O-N 2.92Å; D295-R298 WeakPolarHBondContact O-CB 3.43Å; D295-R298 PolarHBondContact O-N 3.26Å; D295-R298 VanDerWaalsContact O-N 3.12Å; D295-R298 IonicContact OD1-CZ 3.53Å; D295-R298 IonicContact OD1-NE 2.63Å; D295-R298 PolarHBondContact OD1-NE 2.93Å; D295-R298 IonicContact OD1-NH2 3.41Å; D295-R298 PolarHBondContact OD1-NH2 3.35Å; D295-L299 WeakPolarHBondContact O-CG 3.25Å; D295-L299 PolarHBondContact O-N 2.95Å |
| 296 | A | 93.8 | Very high | 95.5 | Very high | 55 Ų | 55 | 84.4 Ų | 84.4 | 46% | 0.455 | 47% | 0.47 | S | S | . | . | H | α-helix | trans | -59.4 | -44.9 | 172.4 | 0 | 0 | 0 | 0 | 0 | 111.4 | R292 N293 R298 L299 A300 | R292-A296 WeakPolarHBondContact O-CB 3.3Å; R292-A296 PolarHBondContact O-N 3.31Å; N293-A296 PolarHBondContact O-N 2.92Å; A296-R298 VanDerWaalsContact C-N 3.29Å; A296-R298 PolarHBondContact O-N 3.45Å; A296-L299 PolarHBondContact O-N 3.37Å; A296-A300 PolarHBondContact O-N 3.45Å |
| 297 | L | 96.3 | Very high | 95.2 | Very high | 90 Ų | 90 | 86.6 Ų | 86.6 | 47% | 0.471 | 47% | 0.472 | S | S | . | . | H | α-helix | trans | -64.3 | -32.2 | 174.4 | -177 | 62.8 | 0 | 0 | 0 | 112.6 | N293 D295 K301 | N293-L297 WeakPolarHBondContact O-CB 3.2Å; N293-L297 PolarHBondContact O-N 3.36Å; D295-L297 VanDerWaalsContact C-N 3.34Å; D295-L297 PolarHBondContact O-N 2.92Å; L297-K301 HydrophobicContact CG-CD 4.33Å; L297-K301 WeakPolarHBondContact O-CB 3.34Å; L297-K301 WeakPolarHBondContact O-CD 3.2Å; L297-K301 WeakPolarHBondContact O-CG 3.47Å; L297-K301 PolarHBondContact O-N 3.3Å |
| 298 | R | 96.9 | Very high | 94.9 | Very high | 109 Ų | 109 | 87.8 Ų | 87.8 | 41% | 0.411 | 47% | 0.467 | S | S | . | . | H | α-helix | trans | -69.8 | -43.1 | 174.4 | -176.8 | -173.6 | 58.6 | 67.5 | -1.5 | 111.5 | A294 D295 A296 K301 Q302 | A294-R298 WeakPolarHBondContact O-CB 3.23Å; A294-R298 PolarHBondContact O-N 2.88Å; D295-R298 WeakPolarHBondContact O-CB 3.43Å; D295-R298 PolarHBondContact O-N 3.26Å; D295-R298 VanDerWaalsContact O-N 3.12Å; D295-R298 IonicContact OD1-CZ 3.53Å; D295-R298 IonicContact OD1-NE 2.63Å; D295-R298 PolarHBondContact OD1-NE 2.93Å; D295-R298 IonicContact OD1-NH2 3.41Å; D295-R298 PolarHBondContact OD1-NH2 3.35Å; A296-R298 VanDerWaalsContact C-N 3.29Å; A296-R298 PolarHBondContact O-N 3.45Å; R298-K301 PolarHBondContact O-N 3.14Å; R298-Q302 WeakPolarHBondContact O-CG 3.44Å; R298-Q302 PolarHBondContact O-N 3.12Å |
| 299 | L | 95.7 | Very high | 94.7 | Very high | 80 Ų | 80 | 90.9 Ų | 90.9 | 42% | 0.419 | 47% | 0.473 | S | S | . | . | H | α-helix | trans | -64.8 | -50.4 | 177.7 | -70.6 | 170.3 | 0 | 0 | 0 | 111.2 | D295 A296 K301 Q302 E303 | D295-L299 WeakPolarHBondContact O-CG 3.25Å; D295-L299 PolarHBondContact O-N 2.95Å; A296-L299 PolarHBondContact O-N 3.37Å; L299-K301 PolarHBondContact O-N 2.85Å; L299-Q302 CarbonylContact O-C 3.6Å; L299-Q302 WeakPolarHBondContact O-CA 3.31Å; L299-Q302 WeakPolarHBondContact O-CB 3.42Å; L299-Q302 PolarHBondContact O-N 2.97Å; L299-E303 WeakPolarHBondContact O-CG 3.38Å; L299-E303 PolarHBondContact O-N 3.35Å |
| 300 | A | 91.1 | Very high | 94.6 | Very high | 55 Ų | 55 | 92.9 Ų | 92.9 | 46% | 0.455 | 47% | 0.473 | S | S | . | . | H | α-helix | trans | -57.8 | -34.8 | 176.3 | 0 | 0 | 0 | 0 | 0 | 112.8 | A296 G304 | A296-A300 PolarHBondContact O-N 3.45Å; A300-G304 PolarHBondContact O-N 3.24Å |
| 301 | K | 95.8 | Very high | 94.1 | Very high | 125 Ų | 125 | 95.7 Ų | 95.7 | 54% | 0.543 | 48% | 0.479 | S | S | . | . | H | α-helix | trans | -71.5 | -27.8 | 172.7 | -77.7 | 172.3 | -179.1 | 172.7 | 0 | 113.8 | L297 R298 L299 N305 | L297-K301 HydrophobicContact CG-CD 4.33Å; L297-K301 WeakPolarHBondContact O-CB 3.34Å; L297-K301 WeakPolarHBondContact O-CD 3.2Å; L297-K301 WeakPolarHBondContact O-CG 3.47Å; L297-K301 PolarHBondContact O-N 3.3Å; R298-K301 PolarHBondContact O-N 3.14Å; L299-K301 PolarHBondContact O-N 2.85Å; K301-N305 PolarHBondContact O-N 2.88Å; K301-N305 PolarHBondContact O-ND2 2.95Å |
| 302 | Q | 94.9 | Very high | 93.8 | Very high | 106 Ų | 106 | 97.6 Ų | 97.6 | 50% | 0.495 | 48% | 0.483 | S | S | . | . | H | α-helix | trans | -76.2 | -46.9 | 174.1 | -75.4 | 174.6 | -25.8 | 0 | 0 | 110.5 | R298 L299 N305 E306 | R298-Q302 WeakPolarHBondContact O-CG 3.44Å; R298-Q302 PolarHBondContact O-N 3.12Å; L299-Q302 CarbonylContact O-C 3.6Å; L299-Q302 WeakPolarHBondContact O-CA 3.31Å; L299-Q302 WeakPolarHBondContact O-CB 3.42Å; L299-Q302 PolarHBondContact O-N 2.97Å; Q302-N305 PolarHBondContact O-N 2.79Å; Q302-N305 VanDerWaalsContact O-N 3.14Å; Q302-E306 PolarHBondContact O-N 3.07Å |
| 303 | E | 92.6 | Very high | 93.5 | Very high | 105 Ų | 105 | 92.6 Ų | 92.6 | 49% | 0.491 | 48% | 0.475 | S | S | . | . | H | α-helix | trans | -57 | -50.8 | 174 | -68.9 | 163.5 | 178.5 | 0 | 0 | 111.5 | L299 N305 E306 Y307 | L299-E303 WeakPolarHBondContact O-CG 3.38Å; L299-E303 PolarHBondContact O-N 3.35Å; E303-N305 PolarHBondContact O-N 3.3Å; E303-E306 PolarHBondContact O-N 2.9Å; E303-Y307 HydrophobicContact CB-CE2 4.14Å; E303-Y307 WeakPolarHBondContact O-CD2 3.31Å; E303-Y307 PolarHBondContact O-N 2.93Å |
| 304 | G | 92.1 | Very high | 92.9 | Very high | 42 Ų | 42 | 93.4 Ų | 93.4 | 43% | 0.433 | 48% | 0.477 | S | S | . | . | H | α-helix | trans | -60.3 | -29.2 | 176 | 0 | 0 | 0 | 0 | 0 | 114.2 | A300 R308 | A300-G304 PolarHBondContact O-N 3.24Å; G304-R308 WeakPolarHBondContact O-CB 3.45Å; G304-R308 PolarHBondContact O-N 2.87Å |
| 305 | N | 93.4 | Very high | 92.5 | Very high | 68 Ų | 68 | 93.5 Ų | 93.5 | 36% | 0.364 | 47% | 0.471 | S | S | . | . | H | α-helix | trans | -77.3 | -32.2 | 171.6 | -90.5 | -74.7 | 0 | 0 | 0 | 112.9 | K301 Q302 E303 R308 R309 | K301-N305 PolarHBondContact O-N 2.88Å; K301-N305 PolarHBondContact O-ND2 2.95Å; Q302-N305 PolarHBondContact O-N 2.79Å; Q302-N305 VanDerWaalsContact O-N 3.14Å; E303-N305 PolarHBondContact O-N 3.3Å; N305-R308 PolarHBondContact O-N 3.16Å; N305-R308 PolarHBondContact OD1-NH2 2.98Å; N305-R309 WeakPolarHBondContact O-CG 3.3Å; N305-R309 PolarHBondContact O-N 3.28Å |
| 306 | E | 94.8 | Very high | 92.3 | Very high | 79 Ų | 79 | 93.3 Ų | 93.3 | 37% | 0.369 | 48% | 0.475 | S | S | . | . | H | α-helix | trans | -72.8 | -44.4 | 177.7 | -165.1 | 54.8 | -141.7 | 0 | 0 | 111.3 | Q302 E303 R308 R309 Q310 | Q302-E306 PolarHBondContact O-N 3.07Å; E303-E306 PolarHBondContact O-N 2.9Å; E306-R308 PolarHBondContact O-N 3.31Å; E306-R309 WeakPolarHBondContact O-CA 3.26Å; E306-R309 WeakPolarHBondContact O-CB 3.33Å; E306-R309 PolarHBondContact O-N 3.39Å; E306-R309 WeakPolarHBondContact OE2-CD 3.38Å; E306-R309 IonicContact OE2-CZ 2.67Å; E306-R309 IonicContact OE2-NE 3.26Å; E306-R309 IonicContact OE2-NH1 2.75Å; E306-R309 PolarHBondContact OE2-NH1 3.49Å; E306-Q310 WeakPolarHBondContact O-CG 3.23Å; E306-Q310 PolarHBondContact O-N 2.95Å |
| 307 | Y | 89.9 | Confident | 92.2 | Very high | 151 Ų | 151 | 95.1 Ų | 95.1 | 59% | 0.592 | 48% | 0.477 | S | S | * | . | H | α-helix | trans | -56.8 | -38.5 | 169.4 | -65.6 | -53.1 | 0 | 0 | 0 | 111.9 | E303 R309 Q310 L311 | E303-Y307 HydrophobicContact CB-CE2 4.14Å; E303-Y307 WeakPolarHBondContact O-CD2 3.31Å; E303-Y307 PolarHBondContact O-N 2.93Å; Y307-R309 PolarHBondContact O-N 3.49Å; Y307-Q310 PolarHBondContact O-N 2.91Å; Y307-L311 WeakPolarHBondContact O-CB 3.43Å; Y307-L311 PolarHBondContact O-N 2.87Å |
| 308 | R | 92 | Very high | 91.7 | Very high | 114 Ų | 114 | 94 Ų | 94 | 43% | 0.43 | 47% | 0.473 | S | S | . | . | H | α-helix | trans | -66.2 | -34.2 | 174.6 | -167.9 | -176.8 | 57.2 | 65.1 | 3.5 | 112.8 | G304 N305 E306 Q312 | G304-R308 WeakPolarHBondContact O-CB 3.45Å; G304-R308 PolarHBondContact O-N 2.87Å; N305-R308 PolarHBondContact O-N 3.16Å; N305-R308 PolarHBondContact OD1-NH2 2.98Å; E306-R308 PolarHBondContact O-N 3.31Å; R308-Q312 VanDerWaalsContact O-CG 3.29Å; R308-Q312 WeakPolarHBondContact O-CG 3.25Å; R308-Q312 PolarHBondContact O-N 3.08Å; R308-Q312 VanDerWaalsContact O-N 3.14Å |
| 309 | R | 93.6 | Very high | 91.4 | Very high | 141 Ų | 141 | 94.1 Ų | 94.1 | 53% | 0.532 | 48% | 0.479 | S | S | . | . | H | α-helix | trans | -68.5 | -45 | 172 | -72.4 | 176.5 | -175.4 | 131.6 | -0.6 | 111.6 | N305 E306 Y307 L311 Q312 A313 | N305-R309 WeakPolarHBondContact O-CG 3.3Å; N305-R309 PolarHBondContact O-N 3.28Å; E306-R309 WeakPolarHBondContact O-CA 3.26Å; E306-R309 WeakPolarHBondContact O-CB 3.33Å; E306-R309 PolarHBondContact O-N 3.39Å; E306-R309 WeakPolarHBondContact OE2-CD 3.38Å; E306-R309 IonicContact OE2-CZ 2.67Å; E306-R309 IonicContact OE2-NE 3.26Å; E306-R309 IonicContact OE2-NH1 2.75Å; E306-R309 PolarHBondContact OE2-NH1 3.49Å; Y307-R309 PolarHBondContact O-N 3.49Å; R309-L311 VanDerWaalsContact C-N 3.33Å; R309-L311 PolarHBondContact O-N 2.87Å; R309-Q312 PolarHBondContact O-N 3.23Å; R309-Q312 VanDerWaalsContact O-N 3.15Å; R309-A313 PolarHBondContact O-N 3.49Å |
| 310 | Q | 92.7 | Very high | 91 | Very high | 97 Ų | 97 | 93 Ų | 93 | 45% | 0.453 | 48% | 0.482 | S | S | . | . | H | α-helix | trans | -61.4 | -42.5 | 178 | -68.3 | 171.1 | 9.4 | 0 | 0 | 111.2 | E306 Y307 Q312 A313 M314 | E306-Q310 WeakPolarHBondContact O-CG 3.23Å; E306-Q310 PolarHBondContact O-N 2.95Å; Y307-Q310 PolarHBondContact O-N 2.91Å; Q310-Q312 VanDerWaalsContact C-N 3.35Å; Q310-Q312 PolarHBondContact O-N 3.18Å; Q310-A313 PolarHBondContact O-N 2.96Å; Q310-M314 WeakPolarHBondContact O-CB 3.4Å; Q310-M314 WeakPolarHBondContact O-CG 3.48Å; Q310-M314 PolarHBondContact O-N 3.07Å |
| 311 | L | 87.3 | Confident | 90.6 | Very high | 119 Ų | 119 | 96 Ų | 96 | 62% | 0.623 | 49% | 0.489 | S | S | * | . | H | α-helix | trans | -58.7 | -44.9 | 172.4 | -167.9 | 81.5 | 0 | 0 | 0 | 111.6 | Y307 R309 T315 | Y307-L311 WeakPolarHBondContact O-CB 3.43Å; Y307-L311 PolarHBondContact O-N 2.87Å; R309-L311 VanDerWaalsContact C-N 3.33Å; R309-L311 PolarHBondContact O-N 2.87Å; L311-T315 WeakPolarHBondContact O-CB 3.49Å; L311-T315 PolarHBondContact O-N 2.86Å; L311-T315 PolarHBondContact O-OG1 2.97Å |
| 312 | Q | 91.3 | Very high | 90.2 | Very high | 108 Ų | 108 | 97.3 Ų | 97.3 | 51% | 0.505 | 49% | 0.491 | S | S | . | . | H | α-helix | trans | -65.1 | -43.1 | 178 | -75.4 | 179.1 | -44.3 | 0 | 0 | 112 | R308 R309 Q310 T315 C316 | R308-Q312 VanDerWaalsContact O-CG 3.29Å; R308-Q312 WeakPolarHBondContact O-CG 3.25Å; R308-Q312 PolarHBondContact O-N 3.08Å; R308-Q312 VanDerWaalsContact O-N 3.14Å; R309-Q312 PolarHBondContact O-N 3.23Å; R309-Q312 VanDerWaalsContact O-N 3.15Å; Q310-Q312 VanDerWaalsContact C-N 3.35Å; Q310-Q312 PolarHBondContact O-N 3.18Å; Q312-T315 PolarHBondContact O-N 3.44Å; Q312-C316 PolarHBondContact O-N 3.03Å; Q312-C316 PolarHBondContact O-SG 2.83Å; Q312-C316 VanDerWaalsContact O-SG 3.34Å |
| 313 | A | 89.3 | Confident | 89.8 | Confident | 50 Ų | 50 | 94 Ų | 94 | 41% | 0.413 | 49% | 0.485 | S | S | . | . | H | α-helix | trans | -61 | -52.6 | 175.8 | 0 | 0 | 0 | 0 | 0 | 111.9 | R309 Q310 T315 C316 D317 | R309-A313 PolarHBondContact O-N 3.49Å; Q310-A313 PolarHBondContact O-N 2.96Å; A313-T315 PolarHBondContact O-N 3.39Å; A313-C316 PolarHBondContact O-N 3.34Å; A313-C316 VanDerWaalsContact O-N 3.09Å; A313-D317 PolarHBondContact O-N 2.73Å |
| 314 | M | 84.1 | Confident | 89.6 | Confident | 130 Ų | 130 | 92.7 Ų | 92.7 | 64% | 0.64 | 48% | 0.484 | S | S | * | . | H | α-helix | trans | -59.1 | -33.5 | 176.5 | -72.5 | -69.9 | -168.2 | 0 | 0 | 112.7 | Q310 V318 | Q310-M314 WeakPolarHBondContact O-CB 3.4Å; Q310-M314 WeakPolarHBondContact O-CG 3.48Å; Q310-M314 PolarHBondContact O-N 3.07Å; M314-V318 WeakPolarHBondContact O-CB 3.46Å; M314-V318 VanDerWaalsContact O-CG2 3.29Å; M314-V318 WeakPolarHBondContact O-CG2 3.19Å; M314-V318 PolarHBondContact O-N 3.41Å |
| 315 | T | 88.2 | Confident | 89 | Confident | 62 Ų | 62 | 94.7 Ų | 94.7 | 38% | 0.38 | 49% | 0.485 | S | S | . | . | H | α-helix | trans | -66.3 | -47.4 | 175.1 | -56.8 | 0 | 0 | 0 | 0 | 110.7 | L311 Q312 A313 D317 V318 E319 | L311-T315 WeakPolarHBondContact O-CB 3.49Å; L311-T315 PolarHBondContact O-N 2.86Å; L311-T315 PolarHBondContact O-OG1 2.97Å; Q312-T315 PolarHBondContact O-N 3.44Å; A313-T315 PolarHBondContact O-N 3.39Å; T315-D317 VanDerWaalsContact C-N 3.34Å; T315-D317 PolarHBondContact O-N 3.22Å; T315-V318 PolarHBondContact O-N 2.96Å; T315-E319 WeakPolarHBondContact O-CG 3.36Å; T315-E319 PolarHBondContact O-N 3.45Å |
| 316 | C | 93.1 | Very high | 88.9 | Confident | 73 Ų | 73 | 97.4 Ų | 97.4 | 49% | 0.493 | 50% | 0.495 | S | S | . | . | H | α-helix | trans | -62.8 | -37.8 | 175.9 | -66.7 | 0 | 0 | 0 | 0 | 112.7 | Q312 A313 E319 A320 | Q312-C316 PolarHBondContact O-N 3.03Å; Q312-C316 PolarHBondContact O-SG 2.83Å; Q312-C316 VanDerWaalsContact O-SG 3.34Å; A313-C316 PolarHBondContact O-N 3.34Å; A313-C316 VanDerWaalsContact O-N 3.09Å; C316-E319 PolarHBondContact O-N 2.83Å; C316-A320 VanDerWaalsContact O-CB 3.3Å; C316-A320 WeakPolarHBondContact O-CB 3.33Å; C316-A320 PolarHBondContact O-N 2.87Å |
| 317 | D | 90.9 | Very high | 88.7 | Confident | 93 Ų | 93 | 96.5 Ų | 96.5 | 50% | 0.497 | 50% | 0.498 | S | S | . | . | H | α-helix | trans | -66.7 | -40.4 | 176.1 | -69.2 | -26.3 | 0 | 0 | 0 | 111.4 | A313 T315 A320 L321 | A313-D317 PolarHBondContact O-N 2.73Å; T315-D317 VanDerWaalsContact C-N 3.34Å; T315-D317 PolarHBondContact O-N 3.22Å; D317-A320 PolarHBondContact O-N 3.36Å; D317-L321 WeakPolarHBondContact O-CB 3.45Å; D317-L321 VanDerWaalsContact O-CG 3.25Å; D317-L321 WeakPolarHBondContact O-CG 3.25Å; D317-L321 PolarHBondContact O-N 3.31Å |
| 318 | V | 85.7 | Confident | 88.6 | Confident | 66 Ų | 66 | 94.2 Ų | 94.2 | 40% | 0.4 | 50% | 0.495 | S | S | . | . | H | α-helix | trans | -65.2 | -40.4 | 173.5 | 166.4 | 0 | 0 | 0 | 0 | 111.9 | M314 T315 R322 | M314-V318 WeakPolarHBondContact O-CB 3.46Å; M314-V318 VanDerWaalsContact O-CG2 3.29Å; M314-V318 WeakPolarHBondContact O-CG2 3.19Å; M314-V318 PolarHBondContact O-N 3.41Å; T315-V318 PolarHBondContact O-N 2.96Å; V318-R322 WeakPolarHBondContact O-CB 3.38Å; V318-R322 VanDerWaalsContact O-CG 3.27Å; V318-R322 WeakPolarHBondContact O-CG 3.25Å; V318-R322 PolarHBondContact O-N 3.35Å |
| 319 | E | 90.6 | Very high | 88.4 | Confident | 112 Ų | 112 | 92.3 Ų | 92.3 | 52% | 0.523 | 49% | 0.491 | S | S | . | . | H | α-helix | trans | -66.4 | -41.7 | 175.3 | -73.4 | 171.6 | 175.7 | 0 | 0 | 111.9 | T315 C316 R322 G323 | T315-E319 WeakPolarHBondContact O-CG 3.36Å; T315-E319 PolarHBondContact O-N 3.45Å; C316-E319 PolarHBondContact O-N 2.83Å; E319-R322 PolarHBondContact O-N 3.14Å; E319-G323 PolarHBondContact O-N 2.92Å |
| 320 | A | 87.4 | Confident | 88.3 | Confident | 58 Ų | 58 | 90.9 Ų | 90.9 | 48% | 0.479 | 49% | 0.491 | S | S | . | . | H | α-helix | trans | -63.6 | -45.5 | 174.9 | 0 | 0 | 0 | 0 | 0 | 111.8 | C316 D317 G323 T324 | C316-A320 VanDerWaalsContact O-CB 3.3Å; C316-A320 WeakPolarHBondContact O-CB 3.33Å; C316-A320 PolarHBondContact O-N 2.87Å; D317-A320 PolarHBondContact O-N 3.36Å; A320-G323 PolarHBondContact O-N 3.49Å; A320-T324 PolarHBondContact O-N 2.92Å; A320-T324 PolarHBondContact O-OG1 3.03Å |
| 321 | L | 82.1 | Confident | 88.3 | Confident | 117 Ų | 117 | 91.2 Ų | 91.2 | 61% | 0.613 | 49% | 0.492 | S | S | * | . | H | α-helix | trans | -62.9 | -41.8 | 177.2 | -74.6 | 170.3 | 0 | 0 | 0 | 111.9 | D317 T324 N325 | D317-L321 WeakPolarHBondContact O-CB 3.45Å; D317-L321 VanDerWaalsContact O-CG 3.25Å; D317-L321 WeakPolarHBondContact O-CG 3.25Å; D317-L321 PolarHBondContact O-N 3.31Å; L321-T324 WeakPolarHBondContact CA-OG1 3.32Å; L321-T324 PolarHBondContact O-N 2.96Å; L321-T324 PolarHBondContact O-OG1 3.15Å; L321-N325 PolarHBondContact O-N 3.33Å |
| 322 | R | 87.8 | Confident | 88.4 | Confident | 153 Ų | 153 | 90.4 Ų | 90.4 | 58% | 0.577 | 49% | 0.488 | S | S | * | . | H | α-helix | trans | -57.1 | -51.1 | 171.8 | -77.2 | 170.1 | 179.1 | 159.1 | 1.1 | 111.6 | V318 E319 T324 N325 E326 | V318-R322 WeakPolarHBondContact O-CB 3.38Å; V318-R322 VanDerWaalsContact O-CG 3.27Å; V318-R322 WeakPolarHBondContact O-CG 3.25Å; V318-R322 PolarHBondContact O-N 3.35Å; E319-R322 PolarHBondContact O-N 3.14Å; R322-T324 VanDerWaalsContact C-N 3.29Å; R322-T324 PolarHBondContact O-N 3.03Å; R322-N325 PolarHBondContact O-N 3.36Å; R322-E326 WeakPolarHBondContact O-CG 3.34Å; R322-E326 PolarHBondContact O-N 2.87Å |
| 323 | G | 87.4 | Confident | 88.5 | Confident | 36 Ų | 36 | 91.5 Ų | 91.5 | 37% | 0.371 | 49% | 0.487 | S | S | . | . | H | α-helix | trans | -59.7 | -36 | 177.3 | 0 | 0 | 0 | 0 | 0 | 113.5 | E319 A320 S327 | E319-G323 PolarHBondContact O-N 2.92Å; A320-G323 PolarHBondContact O-N 3.49Å; G323-S327 WeakPolarHBondContact O-CB 3.42Å; G323-S327 PolarHBondContact O-N 3.29Å; G323-S327 VanDerWaalsContact O-N 3.09Å |
| 324 | T | 87.9 | Confident | 88.8 | Confident | 77 Ų | 77 | 92.4 Ų | 92.4 | 47% | 0.472 | 48% | 0.483 | S | S | . | . | H | α-helix | trans | -69.3 | -37.2 | 172.4 | 57.7 | 0 | 0 | 0 | 0 | 112.9 | A320 L321 R322 S327 L328 | A320-T324 PolarHBondContact O-N 2.92Å; A320-T324 PolarHBondContact O-OG1 3.03Å; L321-T324 WeakPolarHBondContact CA-OG1 3.32Å; L321-T324 PolarHBondContact O-N 2.96Å; L321-T324 PolarHBondContact O-OG1 3.15Å; R322-T324 VanDerWaalsContact C-N 3.29Å; R322-T324 PolarHBondContact O-N 3.03Å; T324-S327 PolarHBondContact O-N 2.99Å; T324-L328 VanDerWaalsContact O-CG 3.29Å; T324-L328 WeakPolarHBondContact O-CG 3.46Å; T324-L328 PolarHBondContact O-N 2.84Å |
| 325 | N | 79.8 | Confident | 89.2 | Confident | 84 Ų | 84 | 90 Ų | 90 | 45% | 0.449 | 47% | 0.472 | S | S | . | . | H | α-helix | trans | -69.2 | -45.4 | 177.4 | -171.1 | 55.6 | 0 | 0 | 0 | 111.4 | L321 R322 S327 L328 E329 | L321-N325 PolarHBondContact O-N 3.33Å; R322-N325 PolarHBondContact O-N 3.36Å; N325-S327 VanDerWaalsContact C-N 3.27Å; N325-S327 PolarHBondContact O-N 2.79Å; N325-L328 PolarHBondContact O-N 3.21Å; N325-L328 VanDerWaalsContact O-N 3.08Å; N325-E329 PolarHBondContact ND2-OE1 2.88Å; N325-E329 WeakPolarHBondContact O-CG 3.28Å; N325-E329 PolarHBondContact O-N 2.86Å |
| 326 | E | 90.9 | Very high | 89.3 | Confident | 125 Ų | 125 | 92.1 Ų | 92.1 | 58% | 0.584 | 48% | 0.477 | S | S | * | . | H | α-helix | trans | -56.3 | -41.4 | 173.5 | -71.5 | 167.6 | -158.3 | 0 | 0 | 111.6 | R322 Q330 | R322-E326 WeakPolarHBondContact O-CG 3.34Å; R322-E326 PolarHBondContact O-N 2.87Å; E326-Q330 WeakPolarHBondContact O-CB 3Å; E326-Q330 PolarHBondContact O-N 3.39Å |
| 327 | S | 90.9 | Very high | 89.4 | Confident | 60 Ų | 60 | 93.6 Ų | 93.6 | 42% | 0.42 | 48% | 0.48 | S | S | . | . | H | α-helix | trans | -67.5 | -35.4 | 175.3 | -171.6 | 0 | 0 | 0 | 0 | 113.4 | G323 T324 N325 Q331 | G323-S327 WeakPolarHBondContact O-CB 3.42Å; G323-S327 PolarHBondContact O-N 3.29Å; G323-S327 VanDerWaalsContact O-N 3.09Å; T324-S327 PolarHBondContact O-N 2.99Å; N325-S327 VanDerWaalsContact C-N 3.27Å; N325-S327 PolarHBondContact O-N 2.79Å; S327-Q331 WeakPolarHBondContact O-CB 3.25Å; S327-Q331 VanDerWaalsContact O-CG 3.28Å; S327-Q331 WeakPolarHBondContact O-CG 3.44Å; S327-Q331 PolarHBondContact O-N 2.89Å; S327-Q331 PolarHBondContact OG-NE2 2.87Å |
| 328 | L | 86.8 | Confident | 89.7 | Confident | 104 Ų | 104 | 95 Ų | 95 | 55% | 0.545 | 48% | 0.478 | S | S | . | . | H | α-helix | trans | -73.9 | -39.7 | 176.1 | -73.1 | 169.5 | 0 | 0 | 0 | 112 | T324 N325 Q330 Q331 L332 | T324-L328 VanDerWaalsContact O-CG 3.29Å; T324-L328 WeakPolarHBondContact O-CG 3.46Å; T324-L328 PolarHBondContact O-N 2.84Å; N325-L328 PolarHBondContact O-N 3.21Å; N325-L328 VanDerWaalsContact O-N 3.08Å; L328-Q330 VanDerWaalsContact C-N 3.34Å; L328-Q331 PolarHBondContact O-N 3.43Å; L328-L332 WeakPolarHBondContact O-CB 3.47Å; L328-L332 PolarHBondContact O-N 3.41Å |
| 329 | E | 88.3 | Confident | 90.1 | Very high | 73 Ų | 73 | 97.3 Ų | 97.3 | 34% | 0.341 | 48% | 0.483 | S | S | . | . | H | α-helix | trans | -61 | -41.4 | 171.5 | -75.1 | -176.6 | -156.1 | 0 | 0 | 111.7 | N325 L332 R333 | N325-E329 PolarHBondContact ND2-OE1 2.88Å; N325-E329 WeakPolarHBondContact O-CG 3.28Å; N325-E329 PolarHBondContact O-N 2.86Å; E329-L332 PolarHBondContact O-N 2.86Å; E329-R333 WeakPolarHBondContact O-CG 3.28Å; E329-R333 PolarHBondContact O-N 3.35Å; E329-R333 IonicContact OE2-CZ 3.56Å; E329-R333 IonicContact OE2-NH1 2.9Å; E329-R333 IonicContact OE2-NH2 3.55Å; E329-R333 PolarHBondContact OE2-NH2 2.83Å |
| 330 | Q | 92.8 | Very high | 90.3 | Very high | 112 Ų | 112 | 95.2 Ų | 95.2 | 52% | 0.523 | 48% | 0.48 | S | S | . | . | H | α-helix | trans | -66.9 | -41.7 | 175 | -178.2 | 169.6 | -22.5 | 0 | 0 | 111.7 | E326 L328 L332 R333 E334 | E326-Q330 WeakPolarHBondContact O-CB 3Å; E326-Q330 PolarHBondContact O-N 3.39Å; L328-Q330 VanDerWaalsContact C-N 3.34Å; Q330-L332 VanDerWaalsContact C-N 3.29Å; Q330-L332 PolarHBondContact O-N 3.45Å; Q330-R333 PolarHBondContact O-N 2.77Å; Q330-E334 HydrophobicContact CG-CG 4.39Å; Q330-E334 PolarHBondContact NE2-OE1 3.27Å; Q330-E334 WeakPolarHBondContact O-CB 3.45Å; Q330-E334 WeakPolarHBondContact O-CG 3.41Å; Q330-E334 PolarHBondContact O-N 2.76Å |
| 331 | Q | 91.8 | Very high | 90.7 | Very high | 103 Ų | 103 | 97.4 Ų | 97.4 | 48% | 0.481 | 49% | 0.488 | S | S | . | . | H | α-helix | trans | -62.8 | -35.3 | 174.4 | -75.4 | 172.7 | 37.5 | 0 | 0 | 112.5 | S327 L328 M335 | S327-Q331 WeakPolarHBondContact O-CB 3.25Å; S327-Q331 VanDerWaalsContact O-CG 3.28Å; S327-Q331 WeakPolarHBondContact O-CG 3.44Å; S327-Q331 PolarHBondContact O-N 2.89Å; S327-Q331 PolarHBondContact OG-NE2 2.87Å; L328-Q331 PolarHBondContact O-N 3.43Å; Q331-M335 VanDerWaalsContact O-CG 3.25Å; Q331-M335 WeakPolarHBondContact O-CG 3.47Å; Q331-M335 PolarHBondContact O-N 2.93Å; Q331-M335 VanDerWaalsContact O-N 3.12Å |
| 332 | L | 90.3 | Very high | 91.4 | Very high | 103 Ų | 103 | 96.7 Ų | 96.7 | 54% | 0.539 | 48% | 0.482 | S | S | . | . | H | α-helix | trans | -63.2 | -53.7 | 173.8 | -175.2 | 69.2 | 0 | 0 | 0 | 110.6 | L328 E329 Q330 E334 M335 E336 | L328-L332 WeakPolarHBondContact O-CB 3.47Å; L328-L332 PolarHBondContact O-N 3.41Å; E329-L332 PolarHBondContact O-N 2.86Å; Q330-L332 VanDerWaalsContact C-N 3.29Å; Q330-L332 PolarHBondContact O-N 3.45Å; L332-E334 VanDerWaalsContact C-N 3.34Å; L332-E334 PolarHBondContact O-N 2.78Å; L332-M335 WeakPolarHBondContact O-CA 3.34Å; L332-M335 WeakPolarHBondContact O-CB 3.5Å; L332-M335 PolarHBondContact O-N 3.4Å; L332-E336 HydrophobicContact CG-CG 4.45Å; L332-E336 WeakPolarHBondContact O-CG 3.23Å; L332-E336 PolarHBondContact O-N 3.07Å |
| 333 | R | 92.3 | Very high | 91.8 | Very high | 130 Ų | 130 | 93.1 Ų | 93.1 | 49% | 0.491 | 48% | 0.477 | S | S | . | . | H | α-helix | trans | -56.8 | -45.2 | 177.8 | -68.5 | 169.1 | -169.1 | 128.4 | 11.6 | 111.9 | E329 Q330 M335 E336 D337 | E329-R333 WeakPolarHBondContact O-CG 3.28Å; E329-R333 PolarHBondContact O-N 3.35Å; E329-R333 IonicContact OE2-CZ 3.56Å; E329-R333 IonicContact OE2-NH1 2.9Å; E329-R333 IonicContact OE2-NH2 3.55Å; E329-R333 PolarHBondContact OE2-NH2 2.83Å; Q330-R333 PolarHBondContact O-N 2.77Å; R333-M335 PolarHBondContact O-N 3.05Å; R333-E336 PolarHBondContact O-N 3.37Å; R333-D337 WeakPolarHBondContact O-CB 3.35Å; R333-D337 PolarHBondContact O-N 2.91Å |
| 334 | E | 96.2 | Very high | 92.2 | Very high | 69 Ų | 69 | 93.7 Ų | 93.7 | 32% | 0.322 | 48% | 0.478 | S | S | . | . | H | α-helix | trans | -61.2 | -30.2 | 175.8 | -79.3 | -177.2 | -151.6 | 0 | 0 | 113.5 | Q330 L332 R338 | Q330-E334 HydrophobicContact CG-CG 4.39Å; Q330-E334 PolarHBondContact NE2-OE1 3.27Å; Q330-E334 WeakPolarHBondContact O-CB 3.45Å; Q330-E334 WeakPolarHBondContact O-CG 3.41Å; Q330-E334 PolarHBondContact O-N 2.76Å; L332-E334 VanDerWaalsContact C-N 3.34Å; L332-E334 PolarHBondContact O-N 2.78Å; E334-R338 WeakPolarHBondContact O-CB 3.46Å; E334-R338 WeakPolarHBondContact O-CD 3.47Å; E334-R338 WeakPolarHBondContact O-CG 3.33Å; E334-R338 PolarHBondContact O-N 3.47Å; E334-R338 PolarHBondContact O-NE 2.89Å; E334-R338 IonicContact OE2-CZ 2.74Å; E334-R338 IonicContact OE2-NH1 2.78Å; E334-R338 IonicContact OE2-NH2 3.8Å; E334-R338 PolarHBondContact OE2-NH2 3.3Å |
| 335 | M | 91.1 | Very high | 92.7 | Very high | 81 Ų | 81 | 91.8 Ų | 91.8 | 40% | 0.399 | 47% | 0.474 | S | S | . | . | H | α-helix | trans | -80.6 | -39.1 | 175.1 | -71.8 | -63.8 | -59.5 | 0 | 0 | 111.9 | Q331 L332 R333 R338 F339 | Q331-M335 VanDerWaalsContact O-CG 3.25Å; Q331-M335 WeakPolarHBondContact O-CG 3.47Å; Q331-M335 PolarHBondContact O-N 2.93Å; Q331-M335 VanDerWaalsContact O-N 3.12Å; L332-M335 WeakPolarHBondContact O-CA 3.34Å; L332-M335 WeakPolarHBondContact O-CB 3.5Å; L332-M335 PolarHBondContact O-N 3.4Å; R333-M335 PolarHBondContact O-N 3.05Å; M335-R338 PolarHBondContact O-N 3.47Å; M335-R338 PolarHBondContact SD-NH1 3.05Å; M335-R338 VanDerWaalsContact SD-NH1 3.37Å; M335-F339 HydrophobicContact CE-CE2 3.72Å; M335-F339 HydrophobicContact CE-CZ 3.86Å; M335-F339 WeakPolarHBondContact O-CD2 3.26Å; M335-F339 WeakPolarHBondContact O-CG 3.43Å; M335-F339 PolarHBondContact O-N 2.97Å |
| 336 | E | 92.1 | Very high | 93.5 | Very high | 106 Ų | 106 | 95.1 Ų | 95.1 | 50% | 0.495 | 48% | 0.481 | S | S | . | . | H | α-helix | trans | -60.8 | -46.5 | 172.9 | -69.5 | 171 | 154 | 0 | 0 | 110.9 | L332 R333 R338 F339 S340 | L332-E336 HydrophobicContact CG-CG 4.45Å; L332-E336 WeakPolarHBondContact O-CG 3.23Å; L332-E336 PolarHBondContact O-N 3.07Å; R333-E336 PolarHBondContact O-N 3.37Å; E336-R338 PolarHBondContact O-N 2.89Å; E336-F339 PolarHBondContact O-N 3.04Å; E336-S340 WeakPolarHBondContact O-CB 3.33Å; E336-S340 PolarHBondContact O-N 3.37Å |
| 337 | D | 94.6 | Very high | 93.8 | Very high | 103 Ų | 103 | 95 Ų | 95 | 55% | 0.551 | 48% | 0.481 | S | S | * | . | H | α-helix | trans | -57.6 | -48.9 | 174.1 | -76.2 | -23.9 | 0 | 0 | 0 | 111.3 | R333 F339 S340 V341 | R333-D337 WeakPolarHBondContact O-CB 3.35Å; R333-D337 PolarHBondContact O-N 2.91Å; D337-F339 PolarHBondContact O-N 3.36Å; D337-S340 PolarHBondContact O-N 3.01Å; D337-S340 PolarHBondContact O-OG 3.35Å; D337-V341 WeakPolarHBondContact O-CG2 3.46Å; D337-V341 PolarHBondContact O-N 3.01Å |
| 338 | R | 97.3 | Very high | 94.1 | Very high | 123 Ų | 123 | 97.9 Ų | 97.9 | 46% | 0.464 | 49% | 0.491 | S | S | . | . | H | α-helix | trans | -58.6 | -48 | 177.1 | -75 | 164 | -164.5 | 143.9 | 12.7 | 111.7 | E334 M335 E336 S340 V341 E342 | E334-R338 WeakPolarHBondContact O-CB 3.46Å; E334-R338 WeakPolarHBondContact O-CD 3.47Å; E334-R338 WeakPolarHBondContact O-CG 3.33Å; E334-R338 PolarHBondContact O-N 3.47Å; E334-R338 PolarHBondContact O-NE 2.89Å; E334-R338 IonicContact OE2-CZ 2.74Å; E334-R338 IonicContact OE2-NH1 2.78Å; E334-R338 IonicContact OE2-NH2 3.8Å; E334-R338 PolarHBondContact OE2-NH2 3.3Å; M335-R338 PolarHBondContact O-N 3.47Å; M335-R338 PolarHBondContact SD-NH1 3.05Å; M335-R338 VanDerWaalsContact SD-NH1 3.37Å; E336-R338 PolarHBondContact O-N 2.89Å; R338-S340 VanDerWaalsContact C-N 3.3Å; R338-S340 PolarHBondContact O-N 3.43Å; R338-V341 PolarHBondContact O-N 3.46Å; R338-E342 PolarHBondContact O-N 3.44Å |
| 339 | F | 93.4 | Very high | 94.7 | Very high | 115 Ų | 115 | 98.2 Ų | 98.2 | 50% | 0.504 | 49% | 0.491 | S | S | . | . | H | α-helix | trans | -66.3 | -31.5 | 177.4 | -72.1 | -51.9 | 0 | 0 | 0 | 112.6 | M335 E336 D337 T343 | M335-F339 HydrophobicContact CE-CE2 3.72Å; M335-F339 HydrophobicContact CE-CZ 3.86Å; M335-F339 WeakPolarHBondContact O-CD2 3.26Å; M335-F339 WeakPolarHBondContact O-CG 3.43Å; M335-F339 PolarHBondContact O-N 2.97Å; E336-F339 PolarHBondContact O-N 3.04Å; D337-F339 PolarHBondContact O-N 3.36Å; F339-T343 VanDerWaalsContact O-CB 3.22Å; F339-T343 WeakPolarHBondContact O-CB 3.48Å; F339-T343 PolarHBondContact O-N 2.86Å; F339-T343 PolarHBondContact O-OG1 3.41Å |
| 340 | S | 95 | Very high | 95.1 | Very high | 67 Ų | 67 | 98 Ų | 98 | 47% | 0.469 | 50% | 0.495 | S | S | . | . | H | α-helix | trans | -65.4 | -41.6 | 173.7 | 83.2 | 0 | 0 | 0 | 0 | 111.8 | E336 D337 R338 T343 A344 | E336-S340 WeakPolarHBondContact O-CB 3.33Å; E336-S340 PolarHBondContact O-N 3.37Å; D337-S340 PolarHBondContact O-N 3.01Å; D337-S340 PolarHBondContact O-OG 3.35Å; R338-S340 VanDerWaalsContact C-N 3.3Å; R338-S340 PolarHBondContact O-N 3.43Å; S340-T343 PolarHBondContact O-N 3.48Å; S340-A344 WeakPolarHBondContact O-CB 3.33Å; S340-A344 PolarHBondContact O-N 2.91Å |
| 341 | V | 96.3 | Very high | 95.4 | Very high | 105 Ų | 105 | 94 Ų | 94 | 64% | 0.636 | 48% | 0.484 | S | S | * | . | H | α-helix | trans | -70.9 | -41.6 | 178 | 172.6 | 0 | 0 | 0 | 0 | 111.6 | D337 R338 A344 G345 | D337-V341 WeakPolarHBondContact O-CG2 3.46Å; D337-V341 PolarHBondContact O-N 3.01Å; R338-V341 PolarHBondContact O-N 3.46Å; V341-A344 PolarHBondContact O-N 3.21Å; V341-G345 PolarHBondContact O-N 2.86Å |
| 342 | E | 97.1 | Very high | 95.7 | Very high | 102 Ų | 102 | 93.9 Ų | 93.9 | 48% | 0.477 | 48% | 0.483 | S | S | . | . | H | α-helix | trans | -61.3 | -44.6 | 171.8 | -74.1 | -175.8 | -160.4 | 0 | 0 | 111.1 | R338 A344 G345 Y346 | R338-E342 PolarHBondContact O-N 3.44Å; E342-A344 PolarHBondContact O-N 3.4Å; E342-G345 PolarHBondContact O-N 2.85Å; E342-Y346 HydrophobicContact CB-CE2 4.11Å; E342-Y346 WeakPolarHBondContact O-CD2 3.32Å; E342-Y346 PolarHBondContact O-N 3.3Å |
| 343 | T | 94.9 | Very high | 96 | Very high | 78 Ų | 78 | 92.9 Ų | 92.9 | 48% | 0.479 | 48% | 0.478 | S | S | . | . | H | α-helix | trans | -62 | -44.1 | 177.4 | -58.3 | 0 | 0 | 0 | 0 | 111.6 | F339 S340 Y346 Q347 | F339-T343 VanDerWaalsContact O-CB 3.22Å; F339-T343 WeakPolarHBondContact O-CB 3.48Å; F339-T343 PolarHBondContact O-N 2.86Å; F339-T343 PolarHBondContact O-OG1 3.41Å; S340-T343 PolarHBondContact O-N 3.48Å; T343-Y346 PolarHBondContact O-N 2.88Å; T343-Q347 WeakPolarHBondContact O-CG 3.42Å; T343-Q347 PolarHBondContact O-N 3.43Å |
| 344 | A | 96.4 | Very high | 96.3 | Very high | 48 Ų | 48 | 92.8 Ų | 92.8 | 40% | 0.397 | 48% | 0.483 | S | S | . | . | H | α-helix | trans | -59 | -47.8 | 174.1 | 0 | 0 | 0 | 0 | 0 | 111.4 | S340 V341 E342 Y346 Q347 D348 | S340-A344 WeakPolarHBondContact O-CB 3.33Å; S340-A344 PolarHBondContact O-N 2.91Å; V341-A344 PolarHBondContact O-N 3.21Å; E342-A344 PolarHBondContact O-N 3.4Å; A344-Y346 VanDerWaalsContact C-N 3.28Å; A344-Y346 PolarHBondContact O-N 2.77Å; A344-Q347 WeakPolarHBondContact O-CA 3.45Å; A344-Q347 WeakPolarHBondContact O-CB 3.32Å; A344-Q347 PolarHBondContact O-N 2.79Å; A344-D348 PolarHBondContact O-N 2.9Å |
| 345 | G | 98.3 | Very high | 96.4 | Very high | 37 Ų | 37 | 95.5 Ų | 95.5 | 38% | 0.381 | 50% | 0.495 | S | S | . | . | H | α-helix | trans | -61.1 | -31.4 | 176.5 | 0 | 0 | 0 | 0 | 0 | 114.2 | V341 E342 M349 | V341-G345 PolarHBondContact O-N 2.86Å; E342-G345 PolarHBondContact O-N 2.85Å; G345-M349 WeakPolarHBondContact O-CB 3.25Å; G345-M349 PolarHBondContact O-N 3.32Å; G345-M349 VanDerWaalsContact O-N 3.13Å |
| 346 | Y | 96.3 | Very high | 96.8 | Very high | 153 Ų | 153 | 96.2 Ų | 96.2 | 60% | 0.6 | 50% | 0.498 | S | S | * | . | H | α-helix | trans | -72.2 | -37 | 170.6 | -65.5 | -55.1 | 0 | 0 | 0 | 112.6 | E342 T343 A344 M349 V350 | E342-Y346 HydrophobicContact CB-CE2 4.11Å; E342-Y346 WeakPolarHBondContact O-CD2 3.32Å; E342-Y346 PolarHBondContact O-N 3.3Å; T343-Y346 PolarHBondContact O-N 2.88Å; A344-Y346 VanDerWaalsContact C-N 3.28Å; A344-Y346 PolarHBondContact O-N 2.77Å; Y346-M349 PolarHBondContact O-N 2.99Å; Y346-V350 WeakPolarHBondContact O-CG2 3.44Å; Y346-V350 PolarHBondContact O-N 2.89Å |
| 347 | Q | 97.6 | Very high | 97 | Very high | 124 Ų | 124 | 95.3 Ų | 95.3 | 58% | 0.579 | 50% | 0.496 | S | S | * | . | H | α-helix | trans | -67 | -43.1 | 174.4 | -65.6 | -62.3 | -33.2 | 0 | 0 | 111.6 | T343 A344 M349 V350 G351 | T343-Q347 WeakPolarHBondContact O-CG 3.42Å; T343-Q347 PolarHBondContact O-N 3.43Å; A344-Q347 WeakPolarHBondContact O-CA 3.45Å; A344-Q347 WeakPolarHBondContact O-CB 3.32Å; A344-Q347 PolarHBondContact O-N 2.79Å; Q347-M349 VanDerWaalsContact C-N 3.3Å; Q347-M349 PolarHBondContact O-N 3.31Å; Q347-V350 PolarHBondContact O-N 3.45Å; Q347-G351 PolarHBondContact O-N 3.14Å |
| 348 | D | 98.1 | Very high | 97.2 | Very high | 120 Ų | 120 | 94.5 Ų | 94.5 | 64% | 0.642 | 49% | 0.488 | S | S | * | . | H | α-helix | trans | -59.3 | -41.9 | 175 | -66.8 | -21.5 | 0 | 0 | 0 | 111.2 | A344 G351 H352 | A344-D348 PolarHBondContact O-N 2.9Å; D348-G351 PolarHBondContact O-N 3.07Å; D348-H352 WeakPolarHBondContact O-CB 3.47Å; D348-H352 PolarHBondContact O-N 3.05Å |
| 349 | M | 98.3 | Very high | 97.2 | Very high | 110 Ų | 110 | 92.6 Ų | 92.6 | 54% | 0.542 | 49% | 0.491 | S | S | . | . | H | α-helix | trans | -65.7 | -39.4 | 175.5 | -175.7 | 61.8 | 60.8 | 0 | 0 | 112.5 | G345 Y346 Q347 L353 | G345-M349 WeakPolarHBondContact O-CB 3.25Å; G345-M349 PolarHBondContact O-N 3.32Å; G345-M349 VanDerWaalsContact O-N 3.13Å; Y346-M349 PolarHBondContact O-N 2.99Å; Q347-M349 VanDerWaalsContact C-N 3.3Å; Q347-M349 PolarHBondContact O-N 3.31Å; M349-L353 HydrophobicContact CG-CD1 4.38Å; M349-L353 VanDerWaalsContact O-CG 3.31Å; M349-L353 WeakPolarHBondContact O-CG 3.5Å; M349-L353 PolarHBondContact O-N 3.49Å; M349-L353 VanDerWaalsContact O-N 3.12Å |
| 350 | V | 97.8 | Very high | 97.5 | Very high | 70 Ų | 70 | 93.1 Ų | 93.1 | 42% | 0.424 | 50% | 0.498 | S | S | . | . | H | α-helix | trans | -64.8 | -48.2 | 174.3 | 168.5 | 0 | 0 | 0 | 0 | 110.4 | Y346 Q347 H352 L353 E354 | Y346-V350 WeakPolarHBondContact O-CG2 3.44Å; Y346-V350 PolarHBondContact O-N 2.89Å; Q347-V350 PolarHBondContact O-N 3.45Å; V350-H352 VanDerWaalsContact C-N 3.32Å; V350-H352 PolarHBondContact O-N 2.88Å; V350-L353 PolarHBondContact O-N 3.5Å; V350-L353 VanDerWaalsContact O-N 3.14Å; V350-E354 HydrophobicContact CG1-CG 4.37Å; V350-E354 WeakPolarHBondContact O-CG 3.38Å; V350-E354 PolarHBondContact O-N 3.5Å |
| 351 | G | 97.9 | Very high | 97.6 | Very high | 28 Ų | 28 | 95.6 Ų | 95.6 | 29% | 0.289 | 50% | 0.5 | S | S | . | . | H | α-helix | trans | -57.4 | -43.8 | 177.5 | 0 | 0 | 0 | 0 | 0 | 112.4 | Q347 D348 L353 E354 E355 | Q347-G351 PolarHBondContact O-N 3.14Å; D348-G351 PolarHBondContact O-N 3.07Å; G351-L353 PolarHBondContact O-N 2.77Å; G351-E354 PolarHBondContact O-N 2.92Å; G351-E355 WeakPolarHBondContact O-CG 3.48Å; G351-E355 PolarHBondContact O-N 3.27Å |
| 352 | H | 98.4 | Very high | 97.7 | Very high | 99 Ų | 99 | 94.9 Ų | 94.9 | 46% | 0.458 | 49% | 0.49 | S | S | . | . | H | α-helix | trans | -63.5 | -39.5 | 176.5 | -171.1 | 40.9 | 0 | 0 | 0 | 112.9 | D348 V350 E355 E356 | D348-H352 WeakPolarHBondContact O-CB 3.47Å; D348-H352 PolarHBondContact O-N 3.05Å; V350-H352 VanDerWaalsContact C-N 3.32Å; V350-H352 PolarHBondContact O-N 2.88Å; H352-E355 IonicContact ND1-OE2 3.98Å; H352-E355 WeakPolarHBondContact O-CB 3.43Å; H352-E355 PolarHBondContact O-N 3.07Å; H352-E356 PolarHBondContact O-N 3.49Å |
| 353 | L | 97.8 | Very high | 97.7 | Very high | 82 Ų | 82 | 90.7 Ų | 90.7 | 43% | 0.429 | 47% | 0.474 | S | S | . | . | H | α-helix | trans | -68.5 | -33.2 | 174.1 | -70.3 | 169.1 | 0 | 0 | 0 | 112.3 | M349 V350 G351 E356 I357 | M349-L353 HydrophobicContact CG-CD1 4.38Å; M349-L353 VanDerWaalsContact O-CG 3.31Å; M349-L353 WeakPolarHBondContact O-CG 3.5Å; M349-L353 PolarHBondContact O-N 3.49Å; M349-L353 VanDerWaalsContact O-N 3.12Å; V350-L353 PolarHBondContact O-N 3.5Å; V350-L353 VanDerWaalsContact O-N 3.14Å; G351-L353 PolarHBondContact O-N 2.77Å; L353-E356 PolarHBondContact O-N 3.39Å; L353-I357 WeakPolarHBondContact O-CB 3.33Å; L353-I357 WeakPolarHBondContact O-CD1 3.44Å; L353-I357 WeakPolarHBondContact O-CG1 3.17Å; L353-I357 PolarHBondContact O-N 3.23Å |
| 354 | E | 97.9 | Very high | 97.8 | Very high | 128 Ų | 128 | 92.7 Ų | 92.7 | 60% | 0.598 | 48% | 0.479 | S | S | * | . | H | α-helix | trans | -67.4 | -38.3 | 172.6 | -71.4 | -175.4 | 158.8 | 0 | 0 | 111.9 | V350 G351 I357 Q358 | V350-E354 HydrophobicContact CG1-CG 4.37Å; V350-E354 WeakPolarHBondContact O-CG 3.38Å; V350-E354 PolarHBondContact O-N 3.5Å; G351-E354 PolarHBondContact O-N 2.92Å; E354-I357 PolarHBondContact O-N 3.23Å; E354-Q358 VanDerWaalsContact O-CB 3.31Å; E354-Q358 WeakPolarHBondContact O-CB 3.48Å; E354-Q358 PolarHBondContact O-N 3.44Å |
| 355 | E | 98.2 | Very high | 97.9 | Very high | 126 Ų | 126 | 93.1 Ų | 93.1 | 59% | 0.589 | 48% | 0.483 | S | S | * | . | H | α-helix | trans | -63.9 | -44.7 | 170.8 | -71.6 | 179.4 | 161.9 | 0 | 0 | 112.6 | G351 H352 I357 Q358 T359 | G351-E355 WeakPolarHBondContact O-CG 3.48Å; G351-E355 PolarHBondContact O-N 3.27Å; H352-E355 IonicContact ND1-OE2 3.98Å; H352-E355 WeakPolarHBondContact O-CB 3.43Å; H352-E355 PolarHBondContact O-N 3.07Å; E355-I357 PolarHBondContact O-N 3.34Å; E355-Q358 PolarHBondContact O-N 2.93Å; E355-T359 WeakPolarHBondContact O-CG2 3.31Å; E355-T359 PolarHBondContact O-N 3.16Å; E355-T359 PolarHBondContact O-OG1 3.26Å |
| 356 | E | 98.3 | Very high | 97.9 | Very high | 96 Ų | 96 | 97.5 Ų | 97.5 | 45% | 0.449 | 49% | 0.488 | S | S | . | . | H | α-helix | trans | -59.6 | -46.2 | 173.7 | -75 | -162 | 145.8 | 0 | 0 | 111 | H352 L353 Q358 T359 L360 | H352-E356 PolarHBondContact O-N 3.49Å; L353-E356 PolarHBondContact O-N 3.39Å; E356-Q358 VanDerWaalsContact C-N 3.3Å; E356-Q358 PolarHBondContact O-N 2.77Å; E356-T359 PolarHBondContact O-OG1 2.9Å; E356-T359 VanDerWaalsContact O-OG1 3.08Å; E356-L360 VanDerWaalsContact O-CB 3.31Å; E356-L360 WeakPolarHBondContact O-CB 3.49Å; E356-L360 WeakPolarHBondContact O-CD1 3.26Å; E356-L360 WeakPolarHBondContact O-CG 3.48Å; E356-L360 PolarHBondContact O-N 2.83Å |
| 357 | I | 97.9 | Very high | 97.9 | Very high | 88 Ų | 88 | 94.5 Ų | 94.5 | 45% | 0.451 | 48% | 0.479 | S | S | . | . | H | α-helix | trans | -61.3 | -39.5 | 176.3 | -73.5 | 166.6 | 0 | 0 | 0 | 111.1 | L353 E354 E355 K361 | L353-I357 WeakPolarHBondContact O-CB 3.33Å; L353-I357 WeakPolarHBondContact O-CD1 3.44Å; L353-I357 WeakPolarHBondContact O-CG1 3.17Å; L353-I357 PolarHBondContact O-N 3.23Å; E354-I357 PolarHBondContact O-N 3.23Å; E355-I357 PolarHBondContact O-N 3.34Å; I357-K361 HydrophobicContact CG2-CD 4.22Å; I357-K361 VanDerWaalsContact CG2-CE 3.44Å; I357-K361 VanDerWaalsContact O-CG 3.25Å; I357-K361 WeakPolarHBondContact O-CG 3.09Å; I357-K361 PolarHBondContact O-N 2.87Å |
| 358 | Q | 98.1 | Very high | 97.9 | Very high | 85 Ų | 85 | 93.9 Ų | 93.9 | 40% | 0.397 | 48% | 0.479 | S | S | . | . | H | α-helix | trans | -70.3 | -47.4 | 179.9 | -178.6 | 56.5 | 22.9 | 0 | 0 | 112.3 | E354 E355 E356 L360 K361 E362 | E354-Q358 VanDerWaalsContact O-CB 3.31Å; E354-Q358 WeakPolarHBondContact O-CB 3.48Å; E354-Q358 PolarHBondContact O-N 3.44Å; E355-Q358 PolarHBondContact O-N 2.93Å; E356-Q358 VanDerWaalsContact C-N 3.3Å; E356-Q358 PolarHBondContact O-N 2.77Å; Q358-L360 VanDerWaalsContact C-N 3.29Å; Q358-L360 PolarHBondContact O-N 3.27Å; Q358-K361 WeakPolarHBondContact O-CB 3.39Å; Q358-K361 PolarHBondContact O-N 3.05Å; Q358-K361 VanDerWaalsContact O-N 3.15Å; Q358-E362 PolarHBondContact NE2-OE1 2.91Å; Q358-E362 WeakPolarHBondContact O-CG 3.23Å; Q358-E362 PolarHBondContact O-N 2.87Å |
| 359 | T | 98.3 | Very high | 97.9 | Very high | 84 Ų | 84 | 94 Ų | 94 | 52% | 0.515 | 48% | 0.476 | S | S | . | . | H | α-helix | trans | -63.7 | -33.4 | 176.8 | 53.6 | 0 | 0 | 0 | 0 | 112.4 | E355 E356 E362 G363 | E355-T359 WeakPolarHBondContact O-CG2 3.31Å; E355-T359 PolarHBondContact O-N 3.16Å; E355-T359 PolarHBondContact O-OG1 3.26Å; E356-T359 PolarHBondContact O-OG1 2.9Å; E356-T359 VanDerWaalsContact O-OG1 3.08Å; T359-E362 PolarHBondContact O-N 2.92Å; T359-G363 PolarHBondContact O-N 3Å |
| 360 | L | 97.8 | Very high | 97.9 | Very high | 125 Ų | 125 | 93.9 Ų | 93.9 | 65% | 0.654 | 47% | 0.474 | S | S | * | . | H | α-helix | trans | -68.7 | -39.6 | 171.6 | -73.1 | 170 | 0 | 0 | 0 | 112.9 | E356 Q358 G363 M364 | E356-L360 VanDerWaalsContact O-CB 3.31Å; E356-L360 WeakPolarHBondContact O-CB 3.49Å; E356-L360 WeakPolarHBondContact O-CD1 3.26Å; E356-L360 WeakPolarHBondContact O-CG 3.48Å; E356-L360 PolarHBondContact O-N 2.83Å; Q358-L360 VanDerWaalsContact C-N 3.29Å; Q358-L360 PolarHBondContact O-N 3.27Å; L360-G363 PolarHBondContact O-N 3.49Å; L360-M364 PolarHBondContact O-N 3.25Å |
| 361 | K | 98.1 | Very high | 97.9 | Very high | 120 Ų | 120 | 98.3 Ų | 98.3 | 52% | 0.522 | 48% | 0.484 | S | S | . | . | H | α-helix | trans | -61.1 | -43.5 | 172.1 | -73.7 | 163.1 | -175.6 | 164.4 | 0 | 111.4 | I357 Q358 M364 A365 | I357-K361 HydrophobicContact CG2-CD 4.22Å; I357-K361 VanDerWaalsContact CG2-CE 3.44Å; I357-K361 VanDerWaalsContact O-CG 3.25Å; I357-K361 WeakPolarHBondContact O-CG 3.09Å; I357-K361 PolarHBondContact O-N 2.87Å; Q358-K361 WeakPolarHBondContact O-CB 3.39Å; Q358-K361 PolarHBondContact O-N 3.05Å; Q358-K361 VanDerWaalsContact O-N 3.15Å; K361-M364 WeakPolarHBondContact O-CB 3.4Å; K361-M364 PolarHBondContact O-N 2.9Å; K361-A365 WeakPolarHBondContact O-CB 3.23Å; K361-A365 PolarHBondContact O-N 3.25Å |
| 362 | E | 97.9 | Very high | 97.8 | Very high | 90 Ų | 90 | 101.6 Ų | 101.6 | 42% | 0.421 | 49% | 0.492 | S | S | . | . | H | α-helix | trans | -67.2 | -35.1 | 177.1 | -71.1 | 171.8 | -163.4 | 0 | 0 | 112.4 | Q358 T359 A365 R366 | Q358-E362 PolarHBondContact NE2-OE1 2.91Å; Q358-E362 WeakPolarHBondContact O-CG 3.23Å; Q358-E362 PolarHBondContact O-N 2.87Å; T359-E362 PolarHBondContact O-N 2.92Å; E362-A365 PolarHBondContact O-N 3.2Å; E362-R366 PolarHBondContact O-N 2.93Å |
| 363 | G | 98.1 | Very high | 97.8 | Very high | 13 Ų | 13 | 100.8 Ų | 100.8 | 13% | 0.134 | 49% | 0.491 | C | S | . | . | H | α-helix | trans | -60.9 | -48 | 169.3 | 0 | 0 | 0 | 0 | 0 | 112.3 | T359 L360 A365 R366 H367 | T359-G363 PolarHBondContact O-N 3Å; L360-G363 PolarHBondContact O-N 3.49Å; G363-A365 VanDerWaalsContact C-N 3.35Å; G363-A365 PolarHBondContact O-N 2.63Å; G363-R366 PolarHBondContact O-N 2.98Å; G363-H367 PolarHBondContact O-CD2 2.73Å; G363-H367 VanDerWaalsContact O-CD2 3.27Å; G363-H367 PolarHBondContact O-N 3.13Å |
| 364 | M | 97.4 | Very high | 97.8 | Very high | 121 Ų | 121 | 102.2 Ų | 102.2 | 60% | 0.596 | 50% | 0.499 | S | S | * | . | H | α-helix | trans | -60.4 | -43 | 175.6 | -171.3 | 66.5 | 68.8 | 0 | 0 | 111.9 | L360 K361 H367 L368 | L360-M364 PolarHBondContact O-N 3.25Å; K361-M364 WeakPolarHBondContact O-CB 3.4Å; K361-M364 PolarHBondContact O-N 2.9Å; M364-H367 PolarHBondContact O-N 2.93Å; M364-L368 HydrophobicContact CG-CD1 4.25Å; M364-L368 WeakPolarHBondContact O-CG 3.46Å; M364-L368 PolarHBondContact O-N 2.77Å |
| 365 | A | 97.1 | Very high | 97.8 | Very high | 57 Ų | 57 | 100.1 Ų | 100.1 | 47% | 0.471 | 49% | 0.491 | S | S | . | . | H | α-helix | trans | -63 | -43.4 | 177.8 | 0 | 0 | 0 | 0 | 0 | 112.3 | K361 E362 G363 L368 Q369 | K361-A365 WeakPolarHBondContact O-CB 3.23Å; K361-A365 PolarHBondContact O-N 3.25Å; E362-A365 PolarHBondContact O-N 3.2Å; G363-A365 VanDerWaalsContact C-N 3.35Å; G363-A365 PolarHBondContact O-N 2.63Å; A365-L368 PolarHBondContact O-N 2.84Å; A365-Q369 PolarHBondContact O-N 2.85Å; A365-Q369 VanDerWaalsContact O-N 3.07Å |
| 366 | R | 98.1 | Very high | 97.7 | Very high | 129 Ų | 129 | 97.6 Ų | 97.6 | 49% | 0.487 | 48% | 0.482 | S | S | . | . | H | α-helix | trans | -60.5 | -47.3 | 173.2 | -91.3 | 178.7 | -80.5 | 103.5 | -1.1 | 112.2 | E362 G363 L368 Q369 E370 | E362-R366 PolarHBondContact O-N 2.93Å; G363-R366 PolarHBondContact O-N 2.98Å; R366-L368 VanDerWaalsContact C-N 3.33Å; R366-L368 PolarHBondContact O-N 2.82Å; R366-Q369 WeakPolarHBondContact O-CB 3.43Å; R366-Q369 PolarHBondContact O-N 3.09Å; R366-Q369 VanDerWaalsContact O-N 3.14Å; R366-E370 WeakPolarHBondContact O-CG 3.32Å; R366-E370 PolarHBondContact O-N 2.77Å |
| 367 | H | 97.4 | Very high | 97.7 | Very high | 90 Ų | 90 | 97 Ų | 97 | 42% | 0.417 | 48% | 0.484 | S | S | . | . | H | α-helix | trans | -62.7 | -38.2 | 177.5 | -68.1 | -38.1 | 0 | 0 | 0 | 112.8 | G363 M364 Q369 E370 Y371 | G363-H367 PolarHBondContact O-CD2 2.73Å; G363-H367 VanDerWaalsContact O-CD2 3.27Å; G363-H367 PolarHBondContact O-N 3.13Å; M364-H367 PolarHBondContact O-N 2.93Å; H367-Q369 VanDerWaalsContact C-N 3.32Å; H367-Q369 PolarHBondContact O-N 3.21Å; H367-E370 IonicContact CE1-OE2 2.75Å; H367-E370 IonicContact CG-OE2 2.66Å; H367-E370 IonicContact ND1-OE2 3.12Å; H367-E370 PolarHBondContact ND1-OE2 2.82Å; H367-E370 PolarHBondContact O-N 2.86Å; H367-Y371 HydrophobicContact CB-CE2 4.35Å; H367-Y371 WeakPolarHBondContact O-CD2 3.45Å; H367-Y371 PolarHBondContact O-N 3.24Å |
| 368 | L | 97.7 | Very high | 97.6 | Very high | 111 Ų | 111 | 97.9 Ų | 97.9 | 58% | 0.581 | 49% | 0.485 | S | S | * | . | H | α-helix | trans | -62.2 | -38.3 | 173.9 | -74.4 | 168.4 | 0 | 0 | 0 | 112.3 | M364 A365 R366 Q372 | M364-L368 HydrophobicContact CG-CD1 4.25Å; M364-L368 WeakPolarHBondContact O-CG 3.46Å; M364-L368 PolarHBondContact O-N 2.77Å; A365-L368 PolarHBondContact O-N 2.84Å; R366-L368 VanDerWaalsContact C-N 3.33Å; R366-L368 PolarHBondContact O-N 2.82Å; L368-Q372 PolarHBondContact O-N 3.05Å |
| 369 | Q | 97.5 | Very high | 97.6 | Very high | 123 Ų | 123 | 97.9 Ų | 97.9 | 58% | 0.575 | 49% | 0.487 | S | S | * | . | H | α-helix | trans | -66.2 | -47.6 | 172.7 | -174.4 | -179.3 | -20.8 | 0 | 0 | 111.6 | A365 R366 H367 Y371 Q372 D373 | A365-Q369 PolarHBondContact O-N 2.85Å; A365-Q369 VanDerWaalsContact O-N 3.07Å; R366-Q369 WeakPolarHBondContact O-CB 3.43Å; R366-Q369 PolarHBondContact O-N 3.09Å; R366-Q369 VanDerWaalsContact O-N 3.14Å; H367-Q369 VanDerWaalsContact C-N 3.32Å; H367-Q369 PolarHBondContact O-N 3.21Å; Q369-Y371 VanDerWaalsContact C-N 3.29Å; Q369-Y371 PolarHBondContact O-N 3.35Å; Q369-Q372 PolarHBondContact O-N 3.31Å; Q369-D373 PolarHBondContact O-N 3.22Å |
| 370 | E | 97.4 | Very high | 97.6 | Very high | 106 Ų | 106 | 96.1 Ų | 96.1 | 50% | 0.495 | 48% | 0.481 | S | S | . | . | H | α-helix | trans | -56.6 | -40.7 | 176.8 | -69.5 | 162.3 | -177.2 | 0 | 0 | 112 | R366 H367 L374 | R366-E370 WeakPolarHBondContact O-CG 3.32Å; R366-E370 PolarHBondContact O-N 2.77Å; H367-E370 IonicContact CE1-OE2 2.75Å; H367-E370 IonicContact CG-OE2 2.66Å; H367-E370 IonicContact ND1-OE2 3.12Å; H367-E370 PolarHBondContact ND1-OE2 2.82Å; H367-E370 PolarHBondContact O-N 2.86Å; E370-L374 WeakPolarHBondContact O-CB 3.49Å; E370-L374 PolarHBondContact O-N 3.37Å |
| 371 | Y | 97.7 | Very high | 97.5 | Very high | 164 Ų | 164 | 94.2 Ų | 94.2 | 64% | 0.643 | 47% | 0.471 | S | S | * | . | H | α-helix | trans | -68 | -37.9 | 173.9 | -76 | -58.4 | 0 | 0 | 0 | 113 | H367 Q369 L375 | H367-Y371 HydrophobicContact CB-CE2 4.35Å; H367-Y371 WeakPolarHBondContact O-CD2 3.45Å; H367-Y371 PolarHBondContact O-N 3.24Å; Q369-Y371 VanDerWaalsContact C-N 3.29Å; Q369-Y371 PolarHBondContact O-N 3.35Å; Y371-L375 WeakPolarHBondContact O-CB 3.45Å; Y371-L375 PolarHBondContact O-N 2.8Å |
| 372 | Q | 97.5 | Very high | 97.4 | Very high | 97 Ų | 97 | 91.4 Ų | 91.4 | 45% | 0.453 | 46% | 0.462 | S | S | . | . | H | α-helix | trans | -67.2 | -41.8 | 176 | -176.4 | 60.1 | 62.6 | 0 | 0 | 111.4 | L368 Q369 L375 N376 | L368-Q372 PolarHBondContact O-N 3.05Å; Q369-Q372 PolarHBondContact O-N 3.31Å; Q372-L375 WeakPolarHBondContact O-CB 3.25Å; Q372-L375 PolarHBondContact O-N 3.43Å; Q372-N376 PolarHBondContact NE2-OD1 2.78Å; Q372-N376 PolarHBondContact O-N 2.92Å; Q372-N376 PolarHBondContact O-ND2 2.92Å; Q372-N376 PolarHBondContact O-OD1 3.33Å |
| 373 | D | 97.4 | Very high | 97.3 | Very high | 81 Ų | 81 | 92.4 Ų | 92.4 | 43% | 0.433 | 47% | 0.469 | S | S | . | . | H | α-helix | trans | -66.7 | -39.6 | 177 | -72.5 | -29.7 | 0 | 0 | 0 | 111.6 | Q369 L375 N376 V377 | Q369-D373 PolarHBondContact O-N 3.22Å; D373-L375 PolarHBondContact O-N 2.84Å; D373-N376 WeakPolarHBondContact O-CB 3.31Å; D373-N376 PolarHBondContact O-N 2.85Å; D373-V377 WeakPolarHBondContact O-CG2 3.41Å; D373-V377 PolarHBondContact O-N 3.23Å |
| 374 | L | 97.7 | Very high | 97.3 | Very high | 113 Ų | 113 | 96.1 Ų | 96.1 | 59% | 0.592 | 48% | 0.483 | S | S | * | . | H | α-helix | trans | -64.2 | -37.8 | 171.9 | -177.3 | 60.7 | 0 | 0 | 0 | 112.5 | E370 V377 K378 | E370-L374 WeakPolarHBondContact O-CB 3.49Å; E370-L374 PolarHBondContact O-N 3.37Å; L374-V377 PolarHBondContact O-N 3Å; L374-K378 WeakPolarHBondContact O-CB 3.21Å; L374-K378 PolarHBondContact O-N 3.24Å |
| 375 | L | 97.2 | Very high | 97.1 | Very high | 83 Ų | 83 | 94.1 Ų | 94.1 | 44% | 0.435 | 47% | 0.474 | S | S | . | . | H | α-helix | trans | -65.2 | -40.3 | 173.6 | 177.5 | 60.6 | 0 | 0 | 0 | 111.6 | Y371 Q372 D373 K378 L379 | Y371-L375 WeakPolarHBondContact O-CB 3.45Å; Y371-L375 PolarHBondContact O-N 2.8Å; Q372-L375 WeakPolarHBondContact O-CB 3.25Å; Q372-L375 PolarHBondContact O-N 3.43Å; D373-L375 PolarHBondContact O-N 2.84Å; L375-K378 PolarHBondContact O-N 2.96Å; L375-L379 HydrophobicContact CD1-CD1 4.41Å; L375-L379 HydrophobicContact CD1-CG 4.42Å; L375-L379 HydrophobicContact CG-CD1 4.22Å; L375-L379 WeakPolarHBondContact O-CG 3.31Å; L375-L379 PolarHBondContact O-N 2.92Å |
| 376 | N | 97.3 | Very high | 97 | Very high | 74 Ų | 74 | 94.1 Ų | 94.1 | 40% | 0.396 | 47% | 0.473 | S | S | . | . | H | α-helix | trans | -60.9 | -45.1 | 175.3 | -63.6 | -23.3 | 0 | 0 | 0 | 111 | Q372 D373 L379 A380 | Q372-N376 PolarHBondContact NE2-OD1 2.78Å; Q372-N376 PolarHBondContact O-N 2.92Å; Q372-N376 PolarHBondContact O-ND2 2.92Å; Q372-N376 PolarHBondContact O-OD1 3.33Å; D373-N376 WeakPolarHBondContact O-CB 3.31Å; D373-N376 PolarHBondContact O-N 2.85Å; N376-L379 PolarHBondContact O-N 3.37Å; N376-A380 PolarHBondContact O-N 3.17Å |
| 377 | V | 97.6 | Very high | 96.7 | Very high | 83 Ų | 83 | 91.3 Ų | 91.3 | 50% | 0.503 | 47% | 0.471 | S | S | . | . | H | α-helix | trans | -62.5 | -42.5 | 173.9 | 172.2 | 0 | 0 | 0 | 0 | 111.4 | D373 L374 L379 A380 L381 | D373-V377 WeakPolarHBondContact O-CG2 3.41Å; D373-V377 PolarHBondContact O-N 3.23Å; L374-V377 PolarHBondContact O-N 3Å; V377-L379 VanDerWaalsContact C-N 3.33Å; V377-L379 PolarHBondContact O-N 3.45Å; V377-A380 PolarHBondContact O-N 3.48Å; V377-L381 HydrophobicContact CG1-CD1 4.13Å; V377-L381 WeakPolarHBondContact O-CG 3.48Å; V377-L381 PolarHBondContact O-N 3.38Å |
| 378 | K | 97.2 | Very high | 96.6 | Very high | 106 Ų | 106 | 94 Ų | 94 | 46% | 0.461 | 48% | 0.479 | S | S | . | . | H | α-helix | trans | -61.7 | -40.4 | 177.3 | -171 | -91.1 | 167.8 | -173.2 | 0 | 112 | L374 L375 L381 D382 | L374-K378 WeakPolarHBondContact O-CB 3.21Å; L374-K378 PolarHBondContact O-N 3.24Å; L375-K378 PolarHBondContact O-N 2.96Å; K378-L381 PolarHBondContact O-N 3.35Å; K378-D382 WeakPolarHBondContact CD-OD2 3.48Å; K378-D382 VanDerWaalsContact CE-OD1 3.25Å; K378-D382 WeakPolarHBondContact CE-OD1 3.22Å; K378-D382 WeakPolarHBondContact CE-OD2 3.07Å; K378-D382 IonicContact NZ-OD1 2.77Å; K378-D382 PolarHBondContact NZ-OD1 2.75Å; K378-D382 IonicContact NZ-OD2 3.98Å; K378-D382 PolarHBondContact NZ-OD2 3.45Å; K378-D382 PolarHBondContact O-N 3.36Å |
| 379 | L | 97.4 | Very high | 96.4 | Very high | 85 Ų | 85 | 96.3 Ų | 96.3 | 45% | 0.445 | 48% | 0.479 | S | S | . | . | H | α-helix | trans | -66.4 | -38.5 | 175.9 | -74.2 | 165.9 | 0 | 0 | 0 | 112.1 | L375 N376 V377 D382 I383 | L375-L379 HydrophobicContact CD1-CD1 4.41Å; L375-L379 HydrophobicContact CD1-CG 4.42Å; L375-L379 HydrophobicContact CG-CD1 4.22Å; L375-L379 WeakPolarHBondContact O-CG 3.31Å; L375-L379 PolarHBondContact O-N 2.92Å; N376-L379 PolarHBondContact O-N 3.37Å; V377-L379 VanDerWaalsContact C-N 3.33Å; V377-L379 PolarHBondContact O-N 3.45Å; L379-D382 PolarHBondContact O-N 3.39Å; L379-I383 WeakPolarHBondContact O-CD1 3.44Å; L379-I383 WeakPolarHBondContact O-CG1 3.31Å; L379-I383 PolarHBondContact O-N 3.05Å; L379-I383 VanDerWaalsContact O-N 3.17Å |
| 380 | A | 97.4 | Very high | 96.1 | Very high | 47 Ų | 47 | 97.8 Ų | 97.8 | 39% | 0.388 | 48% | 0.484 | S | S | . | . | H | α-helix | trans | -61.3 | -45.6 | 172.5 | 0 | 0 | 0 | 0 | 0 | 111.5 | N376 V377 D382 I383 E384 | N376-A380 PolarHBondContact O-N 3.17Å; V377-A380 PolarHBondContact O-N 3.48Å; A380-D382 PolarHBondContact O-N 3.47Å; A380-I383 WeakPolarHBondContact O-CB 3.5Å; A380-I383 PolarHBondContact O-N 3.29Å; A380-I383 VanDerWaalsContact O-N 3.13Å; A380-E384 PolarHBondContact O-N 3.07Å |
| 381 | L | 96.8 | Very high | 95.7 | Very high | 85 Ų | 85 | 98.5 Ų | 98.5 | 45% | 0.445 | 49% | 0.49 | S | S | . | . | H | α-helix | trans | -64.2 | -35.7 | 176.8 | -68 | 170.9 | 0 | 0 | 0 | 113 | V377 K378 I383 E384 I385 | V377-L381 HydrophobicContact CG1-CD1 4.13Å; V377-L381 WeakPolarHBondContact O-CG 3.48Å; V377-L381 PolarHBondContact O-N 3.38Å; K378-L381 PolarHBondContact O-N 3.35Å; L381-I383 VanDerWaalsContact C-N 3.32Å; L381-I383 PolarHBondContact O-N 3.48Å; L381-E384 PolarHBondContact O-N 3.15Å; L381-I385 WeakPolarHBondContact O-CB 3.33Å; L381-I385 WeakPolarHBondContact O-CD1 3.42Å; L381-I385 VanDerWaalsContact O-CG1 3.23Å; L381-I385 WeakPolarHBondContact O-CG1 3.44Å; L381-I385 PolarHBondContact O-N 3.01Å |
| 382 | D | 96.4 | Very high | 95 | Very high | 62 Ų | 62 | 95.9 Ų | 95.9 | 33% | 0.332 | 49% | 0.487 | S | S | . | . | H | α-helix | trans | -60.8 | -41.8 | 172 | -70.1 | -37.6 | 0 | 0 | 0 | 111.4 | K378 L379 A380 I385 A386 | K378-D382 WeakPolarHBondContact CD-OD2 3.48Å; K378-D382 VanDerWaalsContact CE-OD1 3.25Å; K378-D382 WeakPolarHBondContact CE-OD1 3.22Å; K378-D382 WeakPolarHBondContact CE-OD2 3.07Å; K378-D382 IonicContact NZ-OD1 2.77Å; K378-D382 PolarHBondContact NZ-OD1 2.75Å; K378-D382 IonicContact NZ-OD2 3.98Å; K378-D382 PolarHBondContact NZ-OD2 3.45Å; K378-D382 PolarHBondContact O-N 3.36Å; L379-D382 PolarHBondContact O-N 3.39Å; A380-D382 PolarHBondContact O-N 3.47Å; D382-I385 PolarHBondContact O-N 3.49Å; D382-A386 WeakPolarHBondContact O-CB 3.47Å; D382-A386 PolarHBondContact O-N 3.02Å |
| 383 | I | 95.6 | Very high | 94.2 | Very high | 110 Ų | 110 | 96.7 Ų | 96.7 | 56% | 0.564 | 49% | 0.491 | S | S | * | . | H | α-helix | trans | -68.5 | -42 | 179.3 | -66.5 | 163.9 | 0 | 0 | 0 | 110.5 | L379 A380 L381 A386 T387 | L379-I383 WeakPolarHBondContact O-CD1 3.44Å; L379-I383 WeakPolarHBondContact O-CG1 3.31Å; L379-I383 PolarHBondContact O-N 3.05Å; L379-I383 VanDerWaalsContact O-N 3.17Å; A380-I383 WeakPolarHBondContact O-CB 3.5Å; A380-I383 PolarHBondContact O-N 3.29Å; A380-I383 VanDerWaalsContact O-N 3.13Å; L381-I383 VanDerWaalsContact C-N 3.32Å; L381-I383 PolarHBondContact O-N 3.48Å; I383-A386 PolarHBondContact O-N 3.32Å; I383-T387 WeakPolarHBondContact O-CG2 3.34Å; I383-T387 PolarHBondContact O-N 2.77Å; I383-T387 PolarHBondContact O-OG1 3.03Å; I383-T387 VanDerWaalsContact O-OG1 3.1Å |
| 384 | E | 96.6 | Very high | 92.9 | Very high | 91 Ų | 91 | 94 Ų | 94 | 43% | 0.425 | 48% | 0.482 | S | S | . | . | H | α-helix | trans | -57.9 | -51.6 | 171.6 | -73 | 177.5 | -167.8 | 0 | 0 | 110.8 | A380 L381 A386 T387 Y388 | A380-E384 PolarHBondContact O-N 3.07Å; L381-E384 PolarHBondContact O-N 3.15Å; E384-A386 VanDerWaalsContact C-N 3.3Å; E384-A386 PolarHBondContact O-N 2.8Å; E384-T387 PolarHBondContact O-N 2.85Å; E384-T387 VanDerWaalsContact O-N 3.16Å; E384-T387 PolarHBondContact O-OG1 2.83Å; E384-Y388 HydrophobicContact CB-CD2 4.34Å; E384-Y388 HydrophobicContact CB-CE2 4.06Å; E384-Y388 WeakPolarHBondContact O-CD2 3.36Å; E384-Y388 PolarHBondContact O-N 3.43Å |
| 385 | I | 94.1 | Very high | 91.3 | Very high | 80 Ų | 80 | 92.8 Ų | 92.8 | 41% | 0.41 | 47% | 0.473 | S | S | . | . | H | α-helix | trans | -58.5 | -40.3 | 176.9 | -69.4 | 164.8 | 0 | 0 | 0 | 111.8 | L381 D382 R389 | L381-I385 WeakPolarHBondContact O-CB 3.33Å; L381-I385 WeakPolarHBondContact O-CD1 3.42Å; L381-I385 VanDerWaalsContact O-CG1 3.23Å; L381-I385 WeakPolarHBondContact O-CG1 3.44Å; L381-I385 PolarHBondContact O-N 3.01Å; D382-I385 PolarHBondContact O-N 3.49Å; I385-R389 VanDerWaalsContact O-CG 3.31Å; I385-R389 WeakPolarHBondContact O-CG 3.41Å; I385-R389 PolarHBondContact O-N 2.85Å |
| 386 | A | 94.8 | Very high | 89.4 | Confident | 56 Ų | 56 | 95.1 Ų | 95.1 | 46% | 0.463 | 48% | 0.482 | S | S | . | . | H | α-helix | trans | -66.8 | -40.3 | 177.5 | 0 | 0 | 0 | 0 | 0 | 112.4 | D382 I383 E384 K390 | D382-A386 WeakPolarHBondContact O-CB 3.47Å; D382-A386 PolarHBondContact O-N 3.02Å; I383-A386 PolarHBondContact O-N 3.32Å; E384-A386 VanDerWaalsContact C-N 3.3Å; E384-A386 PolarHBondContact O-N 2.8Å; A386-K390 WeakPolarHBondContact O-CB 3.48Å; A386-K390 PolarHBondContact O-N 3.3Å |
| 387 | T | 92.6 | Very high | 87.4 | Confident | 71 Ų | 71 | 95.5 Ų | 95.5 | 44% | 0.436 | 49% | 0.49 | S | S | . | . | H | α-helix | trans | -70.1 | -41 | 175.6 | 54.4 | 0 | 0 | 0 | 0 | 112.1 | I383 E384 R389 K390 L391 | I383-T387 WeakPolarHBondContact O-CG2 3.34Å; I383-T387 PolarHBondContact O-N 2.77Å; I383-T387 PolarHBondContact O-OG1 3.03Å; I383-T387 VanDerWaalsContact O-OG1 3.1Å; E384-T387 PolarHBondContact O-N 2.85Å; E384-T387 VanDerWaalsContact O-N 3.16Å; E384-T387 PolarHBondContact O-OG1 2.83Å; T387-R389 PolarHBondContact O-N 3Å; T387-K390 PolarHBondContact O-N 3.11Å; T387-L391 VanDerWaalsContact O-CD1 3.31Å; T387-L391 WeakPolarHBondContact O-CD1 3.16Å; T387-L391 PolarHBondContact O-N 3.3Å |
| 388 | Y | 95.2 | Very high | 85.6 | Confident | 147 Ų | 147 | 100.2 Ų | 100.2 | 58% | 0.576 | 50% | 0.499 | S | S | * | . | H | α-helix | trans | -59.3 | -43.9 | 173 | -71.8 | -53 | 0 | 0 | 0 | 112.3 | E384 L391 L392 | E384-Y388 HydrophobicContact CB-CD2 4.34Å; E384-Y388 HydrophobicContact CB-CE2 4.06Å; E384-Y388 WeakPolarHBondContact O-CD2 3.36Å; E384-Y388 PolarHBondContact O-N 3.43Å; Y388-L391 PolarHBondContact O-N 2.87Å; Y388-L392 WeakPolarHBondContact O-CG 3.47Å; Y388-L392 PolarHBondContact O-N 2.9Å |
| 389 | R | 93.1 | Very high | 83.4 | Confident | 158 Ų | 158 | 100.9 Ų | 100.9 | 60% | 0.596 | 51% | 0.506 | S | S | * | . | H | α-helix | trans | -58.2 | -48.9 | 173.1 | -75.9 | 173 | -177.3 | 168.5 | 3.7 | 111.9 | I385 T387 L391 L392 E393 | I385-R389 VanDerWaalsContact O-CG 3.31Å; I385-R389 WeakPolarHBondContact O-CG 3.41Å; I385-R389 PolarHBondContact O-N 2.85Å; T387-R389 PolarHBondContact O-N 3Å; R389-L391 VanDerWaalsContact C-N 3.27Å; R389-L391 PolarHBondContact O-N 3.44Å; R389-L392 WeakPolarHBondContact O-CB 3.47Å; R389-L392 PolarHBondContact O-N 3.16Å; R389-E393 WeakPolarHBondContact O-CG 3.3Å; R389-E393 PolarHBondContact O-N 3.13Å |
| 390 | K | 91.7 | Very high | 80.9 | Confident | 154 Ų | 154 | 102.2 Ų | 102.2 | 67% | 0.67 | 52% | 0.518 | S | S | * | . | H | α-helix | trans | -63 | -30.8 | 179.2 | -172.1 | 171.5 | -179 | 176 | 0 | 113.3 | A386 T387 G394 | A386-K390 WeakPolarHBondContact O-CB 3.48Å; A386-K390 PolarHBondContact O-N 3.3Å; T387-K390 PolarHBondContact O-N 3.11Å; K390-G394 PolarHBondContact O-N 3.38Å |
| 391 | L | 89.5 | Confident | 78.4 | Confident | 121 Ų | 121 | 106.3 Ų | 106.3 | 63% | 0.634 | 54% | 0.538 | S | S | * | . | H | α-helix | trans | -70.9 | -40.6 | 171.8 | -96.9 | 69.1 | 0 | 0 | 0 | 111.9 | T387 Y388 R389 G394 E395 | T387-L391 VanDerWaalsContact O-CD1 3.31Å; T387-L391 WeakPolarHBondContact O-CD1 3.16Å; T387-L391 PolarHBondContact O-N 3.3Å; Y388-L391 PolarHBondContact O-N 2.87Å; R389-L391 VanDerWaalsContact C-N 3.27Å; R389-L391 PolarHBondContact O-N 3.44Å; L391-G394 CarbonylContact O-C 3.59Å; L391-G394 WeakPolarHBondContact O-CA 3.49Å; L391-G394 PolarHBondContact O-N 2.85Å; L391-E395 PolarHBondContact O-N 2.78Å; L391-E395 VanDerWaalsContact O-N 3.12Å |
| 392 | L | 82.8 | Confident | 76 | Confident | 109 Ų | 109 | 107.9 Ų | 107.9 | 57% | 0.571 | 55% | 0.553 | S | S | * | * | H | α-helix | trans | -65.9 | -44.8 | 176.5 | -71 | 163.5 | 0 | 0 | 0 | 111.8 | Y388 R389 G394 E395 E396 | Y388-L392 WeakPolarHBondContact O-CG 3.47Å; Y388-L392 PolarHBondContact O-N 2.9Å; R389-L392 WeakPolarHBondContact O-CB 3.47Å; R389-L392 PolarHBondContact O-N 3.16Å; L392-G394 PolarHBondContact O-N 3.1Å; L392-E395 WeakPolarHBondContact O-CA 3.31Å; L392-E395 WeakPolarHBondContact O-CB 3.35Å; L392-E395 PolarHBondContact O-N 2.88Å; L392-E396 PolarHBondContact O-N 2.92Å |
| 393 | E | 79.3 | Confident | 73.2 | Confident | 115 Ų | 115 | 112.7 Ų | 112.7 | 54% | 0.537 | 58% | 0.576 | S | S | . | * | H | α-helix | trans | -57.5 | -32.6 | 171.5 | -68.8 | 161.3 | -162.3 | 0 | 0 | 111.7 | R389 S397 | R389-E393 WeakPolarHBondContact O-CG 3.3Å; R389-E393 PolarHBondContact O-N 3.13Å; E393-S397 WeakPolarHBondContact O-CB 3.37Å; E393-S397 PolarHBondContact O-N 3.15Å; E393-S397 VanDerWaalsContact O-N 3.11Å; E393-S397 PolarHBondContact O-OG 3.34Å |
| 394 | G | 71 | Confident | 70.5 | Confident | 23 Ų | 23 | 114.6 Ų | 114.6 | 24% | 0.237 | 58% | 0.582 | C | S | . | * | H | α-helix | trans | -74.8 | -17.3 | 173.4 | 0 | 0 | 0 | 0 | 0 | 115.7 | K390 L391 L392 S397 | K390-G394 PolarHBondContact O-N 3.38Å; L391-G394 CarbonylContact O-C 3.59Å; L391-G394 WeakPolarHBondContact O-CA 3.49Å; L391-G394 PolarHBondContact O-N 2.85Å; L392-G394 PolarHBondContact O-N 3.1Å; G394-S397 WeakPolarHBondContact CA-OG 3.42Å |
| 395 | E | 64.1 | Low | 67.9 | Low | 88 Ų | 88 | 116.2 Ų | 116.2 | 41% | 0.411 | 60% | 0.603 | S | S | . | * | H | α-helix | trans | -90.2 | -43.3 | 169 | -83.7 | -70.9 | 105.3 | 0 | 0 | 111 | L391 L392 S397 R398 I399 | L391-E395 PolarHBondContact O-N 2.78Å; L391-E395 VanDerWaalsContact O-N 3.12Å; L392-E395 WeakPolarHBondContact O-CA 3.31Å; L392-E395 WeakPolarHBondContact O-CB 3.35Å; L392-E395 PolarHBondContact O-N 2.88Å; E395-S397 PolarHBondContact O-N 2.81Å; E395-R398 WeakPolarHBondContact O-CA 3.34Å; E395-R398 WeakPolarHBondContact O-CB 3.37Å; E395-R398 PolarHBondContact O-N 3.48Å; E395-R398 IonicContact OE1-CZ 3.15Å; E395-R398 IonicContact OE1-NE 2.92Å; E395-R398 PolarHBondContact OE1-NE 3.41Å; E395-R398 IonicContact OE1-NH2 2.7Å; E395-R398 PolarHBondContact OE1-NH2 2.91Å; E395-I399 WeakPolarHBondContact O-CG1 3.45Å; E395-I399 PolarHBondContact O-N 3.21Å |
| 396 | E | 57.7 | Low | 65.2 | Low | 133 Ų | 133 | 121.2 Ų | 121.2 | 62% | 0.621 | 62% | 0.623 | S | S | * | * | H | α-helix | trans | -57.9 | -39.7 | 176.5 | -71.1 | -177.2 | 169.9 | 0 | 0 | 111.4 | L392 R398 I399 T400 | L392-E396 PolarHBondContact O-N 2.92Å; E396-R398 PolarHBondContact O-N 3.12Å; E396-I399 CarbonylContact O-C 3.58Å; E396-I399 PolarHBondContact O-N 3.33Å; E396-T400 PolarHBondContact O-N 3.38Å; E396-T400 VanDerWaalsContact O-N 3.16Å |
| 397 | S | 55.3 | Low | 62.5 | Low | 81 Ų | 81 | 123.8 Ų | 123.8 | 57% | 0.566 | 64% | 0.637 | S | S | * | * | H | α-helix | trans | -70.6 | -7.7 | 173.7 | 51.4 | 0 | 0 | 0 | 0 | 115.2 | E393 G394 E395 | E393-S397 WeakPolarHBondContact O-CB 3.37Å; E393-S397 PolarHBondContact O-N 3.15Å; E393-S397 VanDerWaalsContact O-N 3.11Å; E393-S397 PolarHBondContact O-OG 3.34Å; G394-S397 WeakPolarHBondContact CA-OG 3.42Å; E395-S397 PolarHBondContact O-N 2.81Å |
| 398 | R | 58.5 | Low | 59.9 | Low | 182 Ų | 182 | 127.7 Ų | 127.7 | 69% | 0.687 | 66% | 0.655 | S | S | * | * | H | α-helix | trans | -91 | -15 | 163.2 | -72.7 | -168.7 | -91.4 | -91.1 | 5 | 113.3 | E395 E396 | E395-R398 WeakPolarHBondContact O-CA 3.34Å; E395-R398 WeakPolarHBondContact O-CB 3.37Å; E395-R398 PolarHBondContact O-N 3.48Å; E395-R398 IonicContact OE1-CZ 3.15Å; E395-R398 IonicContact OE1-NE 2.92Å; E395-R398 PolarHBondContact OE1-NE 3.41Å; E395-R398 IonicContact OE1-NH2 2.7Å; E395-R398 PolarHBondContact OE1-NH2 2.91Å; E396-R398 PolarHBondContact O-N 3.12Å |
| 399 | I | 52.3 | Low | 57.2 | Low | 120 Ų | 120 | 129.1 Ų | 129.1 | 62% | 0.615 | 67% | 0.672 | S | S | * | * | H | α-helix | trans | -113 | -0.7 | -166.7 | -66.2 | 170.9 | 0 | 0 | 0 | 112.4 | E395 E396 V401 | E395-I399 WeakPolarHBondContact O-CG1 3.45Å; E395-I399 PolarHBondContact O-N 3.21Å; E396-I399 CarbonylContact O-C 3.58Å; E396-I399 PolarHBondContact O-N 3.33Å; I399-V401 PolarHBondContact O-N 2.9Å |
| 400 | T | 44.1 | Very low | 54.5 | Low | 113 Ų | 113 | 130.4 Ų | 130.4 | 69% | 0.693 | 69% | 0.685 | S | S | * | * | trans | -65.3 | 86.2 | -178.3 | 39.4 | 0 | 0 | 0 | 0 | 115.5 | E396 | E396-T400 PolarHBondContact O-N 3.38Å; E396-T400 VanDerWaalsContact O-N 3.16Å | ||
| 401 | V | 44.5 | Very low | 51.7 | Low | 134 Ų | 134 | 132 Ų | 132 | 81% | 0.812 | 69% | 0.692 | S | S | * | * | trans | -78.7 | 135.4 | 140.6 | 178.2 | 0 | 0 | 0 | 0 | 107.3 | I399 | I399-V401 PolarHBondContact O-N 2.9Š| ||
| 402 | P | 46.2 | Very low | 49.2 | Very low | 118 Ų | 118 | 136.9 Ų | 136.9 | 77% | 0.766 | 70% | 0.702 | S | S | * | * | trans | -84.8 | 125.5 | -156.7 | 30.4 | -36.1 | 0 | 0 | 0 | 115.4 | ||||
| 403 | M | 37.7 | Very low | 46.7 | Very low | 162 Ų | 162 | 139.4 Ų | 139.4 | 80% | 0.798 | 71% | 0.711 | S | S | * | * | trans | -141.6 | 117.9 | 155 | -83.7 | -159.2 | 72.3 | 0 | 0 | 113.3 | ||||
| 404 | Q | 38.8 | Very low | 44.6 | Very low | 151 Ų | 151 | 139.5 Ų | 139.5 | 71% | 0.706 | 72% | 0.72 | S | S | * | * | trans | 44.6 | 110.6 | 148.2 | -62.7 | -174.8 | -22.3 | 0 | 0 | 120.3 | ||||
| 405 | S | 42.6 | Very low | 42.8 | Very low | 124 Ų | 124 | 142.7 Ų | 142.7 | 87% | 0.867 | 74% | 0.739 | S | S | * | * | trans | -62.3 | 140.1 | 169.4 | -38 | 0 | 0 | 0 | 0 | 113.6 | ||||
| 406 | F | 38.2 | Very low | 41.3 | Very low | 186 Ų | 186 | 146 Ų | 146 | 82% | 0.816 | 76% | 0.756 | S | S | * | * | trans | -121.5 | 151.5 | 159.1 | -81.7 | -81.3 | 0 | 0 | 0 | 110.9 | ||||
| 407 | S | 38.2 | Very low | 40.1 | Very low | 110 Ų | 110 | 145.9 Ų | 145.9 | 77% | 0.769 | 76% | 0.759 | S | S | * | * | trans | -84.9 | 133.9 | -155.2 | -49 | 0 | 0 | 0 | 0 | 115.6 | L409 | S407-L409 PolarHBondContact O-N 3.08Š| ||
| 408 | N | 38.3 | Very low | 39.2 | Very low | 152 Ų | 152 | 147.1 Ų | 147.1 | 81% | 0.813 | 76% | 0.764 | S | S | * | * | trans | 18.7 | 96.8 | 146.3 | -59.5 | -0.2 | 0 | 0 | 0 | 117.5 | ||||
| 409 | L | 37.8 | Very low | 37.8 | Very low | 178 Ų | 178 | 147 Ų | 147 | 93% | 0.932 | 77% | 0.768 | S | S | * | * | trans | -82.4 | 117.6 | 150.3 | -77 | 169.9 | 0 | 0 | 0 | 108.6 | S407 F411 | S407-L409 PolarHBondContact O-N 3.08Å; L409-F411 PolarHBondContact O-N 3.38Å; L409-F411 VanDerWaalsContact O-N 3.15Å | ||
| 410 | Q | 36.9 | Very low | 36.8 | Very low | 185 Ų | 185 | 150.3 Ų | 150.3 | 86% | 0.864 | 78% | 0.778 | S | S | * | * | trans | -73.1 | 105.5 | 178.5 | -71 | 178.5 | -33.4 | 0 | 0 | 110.2 | R412 | Q410-R412 VanDerWaalsContact C-N 3.32Å; Q410-R412 PolarHBondContact O-N 3.18Å | ||
| 411 | F | 31.7 | Very low | 36 | Very low | 188 Ų | 188 | 149.5 Ų | 149.5 | 83% | 0.825 | 78% | 0.777 | S | S | * | * | trans | -67.1 | 92.7 | 165.9 | -175.4 | -96.2 | 0 | 0 | 0 | 108.7 | L409 E413 | L409-F411 PolarHBondContact O-N 3.38Å; L409-F411 VanDerWaalsContact O-N 3.15Å; F411-E413 VanDerWaalsContact C-N 3.34Å; F411-E413 HydrophobicContact CD1-CB 4.37Å; F411-E413 HydrophobicContact CE1-CB 4.26Å; F411-E413 PolarHBondContact O-N 2.95Å | ||
| 412 | R | 37.8 | Very low | 35.6 | Very low | 222 Ų | 222 | 148.3 Ų | 148.3 | 84% | 0.838 | 77% | 0.772 | S | S | * | * | trans | -78.2 | 88.9 | 176.3 | -173.5 | 174 | -179 | 156 | 0.5 | 109.2 | Q410 T414 | Q410-R412 VanDerWaalsContact C-N 3.32Å; Q410-R412 PolarHBondContact O-N 3.18Å; R412-T414 PolarHBondContact O-N 3.43Å | ||
| 413 | E | 29.7 | Very low | 35 | Very low | 162 Ų | 162 | 150.3 Ų | 150.3 | 76% | 0.757 | 77% | 0.772 | S | S | * | * | trans | -50.7 | 103.1 | 169.8 | -174.1 | 170 | -124 | 0 | 0 | 110.4 | F411 S415 | F411-E413 VanDerWaalsContact C-N 3.34Å; F411-E413 HydrophobicContact CD1-CB 4.37Å; F411-E413 HydrophobicContact CE1-CB 4.26Å; F411-E413 PolarHBondContact O-N 2.95Å; E413-S415 PolarHBondContact O-N 2.87Å; E413-S415 VanDerWaalsContact O-N 3.13Å | ||
| 414 | T | 34.6 | Very low | 34.9 | Very low | 117 Ų | 117 | 146.7 Ų | 146.7 | 72% | 0.718 | 77% | 0.768 | S | S | * | * | trans | -81 | 88.7 | 172.3 | 49.8 | 0 | 0 | 0 | 0 | 108.3 | R412 M416 | R412-T414 PolarHBondContact O-N 3.43Å; T414-M416 PolarHBondContact O-N 3.23Å | ||
| 415 | S | 33.2 | Very low | 34.9 | Very low | 91 Ų | 91 | 146.6 Ų | 146.6 | 64% | 0.636 | 77% | 0.767 | S | S | * | * | trans | -54 | 107.2 | 165.6 | -174.7 | 0 | 0 | 0 | 0 | 108.9 | E413 D417 | E413-S415 PolarHBondContact O-N 2.87Å; E413-S415 VanDerWaalsContact O-N 3.13Å; S415-D417 PolarHBondContact O-N 3.02Å | ||
| 416 | M | 34.1 | Very low | 34.8 | Very low | 156 Ų | 156 | 146.5 Ų | 146.5 | 77% | 0.768 | 76% | 0.761 | S | S | * | * | trans | -76.9 | 98.9 | 162.7 | -71.7 | -102.3 | 63 | 0 | 0 | 105.7 | T414 T418 | T414-M416 PolarHBondContact O-N 3.23Å; M416-T418 PolarHBondContact O-N 3.06Å | ||
| 417 | D | 31.2 | Very low | 35.4 | Very low | 131 Ų | 131 | 147 Ų | 147 | 70% | 0.701 | 76% | 0.763 | S | S | * | * | trans | -64.4 | 73.3 | 167.8 | -89.1 | -43.4 | 0 | 0 | 0 | 109.4 | S415 K419 | S415-D417 PolarHBondContact O-N 3.02Å; D417-K419 PolarHBondContact O-N 3.3Å | ||
| 418 | T | 36 | Very low | 36.2 | Very low | 107 Ų | 107 | 152.5 Ų | 152.5 | 66% | 0.656 | 77% | 0.767 | S | S | * | * | trans | -68.9 | 77.7 | 164.6 | -56.8 | 0 | 0 | 0 | 0 | 106.9 | M416 F420 | M416-T418 PolarHBondContact O-N 3.06Å; T418-F420 HydrophobicContact CG2-CD2 4.34Å; T418-F420 HydrophobicContact CG2-CE2 4.31Å; T418-F420 PolarHBondContact O-N 2.93Å | ||
| 419 | K | 30.2 | Very low | 36.8 | Very low | 180 Ų | 180 | 148.5 Ų | 148.5 | 78% | 0.783 | 75% | 0.75 | S | S | * | * | trans | -61 | 94.2 | 167.1 | -72.2 | -179.8 | 179.1 | 176.5 | 0 | 107.2 | D417 S421 | D417-K419 PolarHBondContact O-N 3.3Å; K419-S421 PolarHBondContact O-N 3.3Å | ||
| 420 | F | 31.6 | Very low | 37.9 | Very low | 189 Ų | 189 | 145 Ų | 145 | 83% | 0.829 | 73% | 0.731 | S | S | * | * | trans | -53.1 | 98.1 | 152.4 | -85.2 | -95.5 | 0 | 0 | 0 | 106.7 | T418 P422 | T418-F420 HydrophobicContact CG2-CD2 4.34Å; T418-F420 HydrophobicContact CG2-CE2 4.31Å; T418-F420 PolarHBondContact O-N 2.93Å; F420-P422 WeakPolarHBondContact O-CD 3.45Å | ||
| 421 | S | 26.8 | Very low | 39.3 | Very low | 96 Ų | 96 | 140.6 Ų | 140.6 | 67% | 0.671 | 71% | 0.713 | S | S | * | * | P | Polyproline II helix | trans | -58.5 | 123.7 | 153.9 | -177.8 | 0 | 0 | 0 | 0 | 105.2 | K419 | K419-S421 PolarHBondContact O-N 3.3Š|
| 422 | P | 35.9 | Very low | 40.9 | Very low | 109 Ų | 109 | 135.1 Ų | 135.1 | 71% | 0.708 | 70% | 0.695 | S | S | * | * | P | Polyproline II helix | trans | -56.9 | 153.1 | 163.1 | 28.4 | -33.9 | 0 | 0 | 0 | 108 | F420 A424 | F420-P422 WeakPolarHBondContact O-CD 3.45Å; P422-A424 PolarHBondContact O-N 3.46Å; P422-A424 VanDerWaalsContact O-N 3.09Å |
| 423 | E | 34.6 | Very low | 42.6 | Very low | 160 Ų | 160 | 132.4 Ų | 132.4 | 75% | 0.748 | 69% | 0.685 | S | S | * | * | P | Polyproline II helix | trans | -54 | 120.3 | -178.5 | -64.5 | 163.9 | 106.8 | 0 | 0 | 109.6 | H425 | E423-H425 PolarHBondContact O-N 3.24Å; E423-H425 PolarHBondContact O-ND1 2.87Å |
| 424 | A | 34.6 | Very low | 44.7 | Very low | 87 Ų | 87 | 128.5 Ų | 128.5 | 72% | 0.719 | 67% | 0.672 | S | S | * | * | trans | -68.1 | 86.9 | 171.5 | 0 | 0 | 0 | 0 | 0 | 108 | P422 V426 | P422-A424 PolarHBondContact O-N 3.46Å; P422-A424 VanDerWaalsContact O-N 3.09Å; A424-V426 WeakPolarHBondContact O-CG2 3.41Å; A424-V426 PolarHBondContact O-N 3.07Å | ||
| 425 | H | 39 | Very low | 46.6 | Very low | 148 Ų | 148 | 126.2 Ų | 126.2 | 69% | 0.685 | 66% | 0.657 | S | S | * | * | trans | -53.8 | 103.7 | -179.5 | -71.4 | -6.1 | 0 | 0 | 0 | 109.4 | E423 K427 | E423-H425 PolarHBondContact O-N 3.24Å; E423-H425 PolarHBondContact O-ND1 2.87Å; H425-K427 PolarHBondContact O-N 3.16Å | ||
| 426 | V | 40.8 | Very low | 48.3 | Very low | 123 Ų | 123 | 127.7 Ų | 127.7 | 75% | 0.745 | 65% | 0.654 | S | S | * | * | trans | -68.7 | 95 | -177.5 | -179.4 | 0 | 0 | 0 | 0 | 108.1 | A424 R428 | A424-V426 WeakPolarHBondContact O-CG2 3.41Å; A424-V426 PolarHBondContact O-N 3.07Å; V426-R428 VanDerWaalsContact C-N 3.32Å; V426-R428 HydrophobicContact CG1-CG 4.49Å; V426-R428 PolarHBondContact O-N 3.19Å | ||
| 427 | K | 49.6 | Very low | 50.4 | Low | 196 Ų | 196 | 124.8 Ų | 124.8 | 85% | 0.852 | 65% | 0.645 | S | S | * | * | trans | -65.9 | 91.9 | 173.9 | -68 | -175.8 | 179.5 | -178.2 | 0 | 108.7 | H425 S429 | H425-K427 PolarHBondContact O-N 3.16Å; K427-S429 PolarHBondContact O-N 3.48Å; K427-S429 VanDerWaalsContact O-N 3.07Å | ||
| 428 | R | 55.8 | Low | 51.7 | Low | 226 Ų | 226 | 126.5 Ų | 126.5 | 85% | 0.853 | 64% | 0.642 | S | S | * | * | trans | -69.1 | 99.4 | 174.3 | -51.6 | -173.9 | -157.3 | 116.6 | 1.1 | 108.5 | V426 I430 | V426-R428 VanDerWaalsContact C-N 3.32Å; V426-R428 HydrophobicContact CG1-CG 4.49Å; V426-R428 PolarHBondContact O-N 3.19Å; R428-I430 PolarHBondContact O-N 2.91Å | ||
| 429 | S | 50.7 | Low | 53.1 | Low | 67 Ų | 67 | 128.2 Ų | 128.2 | 47% | 0.469 | 65% | 0.647 | S | S | . | * | trans | -73.2 | 123 | 165.1 | 42.5 | 0 | 0 | 0 | 0 | 109 | K427 I431 | K427-S429 PolarHBondContact O-N 3.48Å; K427-S429 VanDerWaalsContact O-N 3.07Å; S429-I431 PolarHBondContact O-N 3.34Å | ||
| 430 | I | 62.1 | Low | 55.1 | Low | 104 Ų | 104 | 123.2 Ų | 123.2 | 53% | 0.533 | 65% | 0.647 | S | S | . | * | E | Extended strand (participates in β ladder) | trans | -89 | 105 | 175.2 | -60.4 | 177.9 | 0 | 0 | 0 | 107.5 | R428 V432 | R428-I430 PolarHBondContact O-N 2.91Å; I430-V432 HydrophobicContact CG2-CG2 4.23Å; I430-V432 PolarHBondContact O-N 3.06Å |
| 431 | I | 65.6 | Low | 56.6 | Low | 94 Ų | 94 | 121.6 Ų | 121.6 | 48% | 0.482 | 64% | 0.642 | S | S | . | * | E | Extended strand (participates in β ladder) | trans | -85.8 | 106.3 | 177.2 | -59.2 | 178.1 | 0 | 0 | 0 | 108.1 | S429 T447 | S429-I431 PolarHBondContact O-N 3.34Å; I431-T447 HydrophobicContact CG2-CG2 3.43Å; I431-T447 VanDerWaalsContact CG2-CG2 3.43Å |
| 432 | V | 65.9 | Low | 59.1 | Low | 73 Ų | 73 | 122.2 Ų | 122.2 | 44% | 0.442 | 64% | 0.637 | S | S | . | * | E | Extended strand (participates in β ladder) | trans | -88 | 118.5 | 173.7 | -176.9 | 0 | 0 | 0 | 0 | 108.6 | I430 A448 | I430-V432 HydrophobicContact CG2-CG2 4.23Å; I430-V432 PolarHBondContact O-N 3.06Å; V432-A448 PolarHBondContact N-O 2.81Å; V432-A448 PolarHBondContact O-N 2.91Å |
| 433 | R | 73.1 | Confident | 61 | Low | 165 Ų | 165 | 122.3 Ų | 122.3 | 62% | 0.623 | 63% | 0.63 | S | S | * | * | E | Extended strand (participates in β ladder) | trans | -97.4 | 126.9 | 167.9 | -74.8 | -176 | 165.9 | 100.7 | 0.7 | 109.6 | E445 | R433-E445 WeakPolarHBondContact CD-OE1 3.39Å; R433-E445 IonicContact NE-OE1 3.69Å; R433-E445 PolarHBondContact NE-OE1 3.25Å |
| 434 | T | 72.9 | Confident | 62.8 | Low | 79 Ų | 79 | 121 Ų | 121 | 49% | 0.485 | 62% | 0.622 | S | S | . | * | E | Extended strand (participates in β ladder) | trans | -113.3 | 119.3 | 169.4 | 29.1 | 0 | 0 | 0 | 0 | 109.1 | S446 | T434-S446 PolarHBondContact N-O 2.88Å; T434-S446 PolarHBondContact O-N 3.27Å; T434-S446 PolarHBondContact O-OG 3.2Å; T434-S446 PolarHBondContact OG1-O 2.71Å; T434-S446 PolarHBondContact OG1-OG 2.94Å |
| 435 | V | 74.4 | Confident | 64.7 | Low | 69 Ų | 69 | 122.1 Ų | 122.1 | 42% | 0.418 | 61% | 0.612 | S | S | . | * | E | Extended strand (participates in β ladder) | trans | -118.1 | 116.3 | -172.8 | -171.7 | 0 | 0 | 0 | 0 | 108.3 | T437 I442 K444 E445 | V435-T437 HydrophobicContact CG1-CG2 4.2Å; V435-I442 HydrophobicContact CG1-CB 4.26Å; V435-I442 HydrophobicContact CG1-CD1 4.03Å; V435-I442 HydrophobicContact CG1-CG1 3.79Å; V435-I442 HydrophobicContact CG1-CG2 3.57Å; V435-K444 WeakPolarHBondContact CA-O 3.49Å; V435-E445 HydrophobicContact CG2-CG 4.41Å |
| 436 | E | 69.9 | Low | 66.2 | Low | 122 Ų | 122 | 117.9 Ų | 117.9 | 57% | 0.57 | 60% | 0.599 | S | S | * | * | E | Extended strand (participates in β ladder) | trans | -92.6 | 107.9 | 173.2 | -66.8 | -173.7 | 140 | 0 | 0 | 109.1 | I443 K444 | E436-I443 PolarHBondContact O-N 3.12Å; E436-K444 HydrophobicContact CB-CB 4.42Å; E436-K444 PolarHBondContact N-O 3.29Å; E436-K444 PolarHBondContact O-N 3.2Å |
| 437 | T | 78.7 | Confident | 67.5 | Low | 95 Ų | 95 | 115.8 Ų | 115.8 | 58% | 0.583 | 59% | 0.587 | S | S | * | * | E | Extended strand (participates in β ladder) | trans | -100.9 | 148 | 172.9 | 49.6 | 0 | 0 | 0 | 0 | 111.6 | V435 E441 I442 | V435-T437 HydrophobicContact CG1-CG2 4.2Å; T437-E441 VanDerWaalsContact CA-O 3.23Å; T437-E441 WeakPolarHBondContact CA-O 3.44Å; T437-I442 HydrophobicContact CG2-CB 4.5Å; T437-I442 HydrophobicContact CG2-CG1 3.74Å |
| 438 | R | 58.5 | Low | 68.1 | Low | 168 Ų | 168 | 109.1 Ų | 109.1 | 63% | 0.634 | 57% | 0.568 | S | S | * | * | E | Extended strand (participates in β ladder) | trans | -147 | 137.4 | 168.9 | -171.6 | -166.3 | 159.1 | 144.1 | 2.5 | 108.5 | G440 E441 I443 | R438-G440 PolarHBondContact O-N 2.82Å; R438-E441 PolarHBondContact N-O 3.11Å; R438-E441 PolarHBondContact O-N 3.16Å; R438-I443 HydrophobicContact CB-CD1 3.7Å; R438-I443 HydrophobicContact CB-CG1 4.49Å |
| 439 | D | 64.1 | Low | 68.3 | Low | 143 Ų | 143 | 104.5 Ų | 104.5 | 77% | 0.765 | 56% | 0.556 | S | S | * | * | T | Hydrogen-bonded Turn | trans | 54.4 | 23.8 | 175.7 | -52.6 | -35.9 | 0 | 0 | 0 | 114.2 | ||
| 440 | G | 72.6 | Confident | 68.7 | Low | 75 Ų | 75 | 111.1 Ų | 111.1 | 77% | 0.773 | 57% | 0.571 | S | S | * | * | T | Hydrogen-bonded Turn | trans | 102.3 | -22.8 | 178.9 | 0 | 0 | 0 | 0 | 0 | 115.2 | R438 | R438-G440 PolarHBondContact O-N 2.82Š|
| 441 | E | 63.3 | Low | 68.2 | Low | 154 Ų | 154 | 114.6 Ų | 114.6 | 72% | 0.72 | 58% | 0.582 | S | S | * | * | E | Extended strand (participates in β ladder) | trans | -97.2 | 151.4 | -176.3 | -64.4 | -169.9 | 156.5 | 0 | 0 | 112.8 | T437 R438 I443 | T437-E441 VanDerWaalsContact CA-O 3.23Å; T437-E441 WeakPolarHBondContact CA-O 3.44Å; R438-E441 PolarHBondContact N-O 3.11Å; R438-E441 PolarHBondContact O-N 3.16Å; E441-I443 PolarHBondContact O-N 2.91Å |
| 442 | I | 78.2 | Confident | 67.4 | Low | 110 Ų | 110 | 118.1 Ų | 118.1 | 56% | 0.564 | 60% | 0.597 | S | S | * | * | E | Extended strand (participates in β ladder) | trans | -85.9 | 108.4 | 175.8 | -63.6 | 169.5 | 0 | 0 | 0 | 108.4 | V435 T437 | V435-I442 HydrophobicContact CG1-CB 4.26Å; V435-I442 HydrophobicContact CG1-CD1 4.03Å; V435-I442 HydrophobicContact CG1-CG1 3.79Å; V435-I442 HydrophobicContact CG1-CG2 3.57Å; T437-I442 HydrophobicContact CG2-CB 4.5Å; T437-I442 HydrophobicContact CG2-CG1 3.74Å |
| 443 | I | 76.9 | Confident | 66.8 | Low | 110 Ų | 110 | 121.9 Ų | 121.9 | 56% | 0.564 | 61% | 0.613 | S | S | * | * | E | Extended strand (participates in β ladder) | trans | -89 | -31.3 | -177.6 | -59.7 | -171.5 | 0 | 0 | 0 | 111.1 | E436 R438 E441 | E436-I443 PolarHBondContact O-N 3.12Å; R438-I443 HydrophobicContact CB-CD1 3.7Å; R438-I443 HydrophobicContact CB-CG1 4.49Å; E441-I443 PolarHBondContact O-N 2.91Å |
| 444 | K | 71.8 | Confident | 65.5 | Low | 134 Ų | 134 | 119 Ų | 119 | 58% | 0.583 | 62% | 0.616 | S | S | * | * | E | Extended strand (participates in β ladder) | trans | -144.7 | 131 | 169.8 | -68.4 | -178.3 | -174.8 | 161.8 | 0 | 111.9 | V435 E436 | V435-K444 WeakPolarHBondContact CA-O 3.49Å; E436-K444 HydrophobicContact CB-CB 4.42Å; E436-K444 PolarHBondContact N-O 3.29Å; E436-K444 PolarHBondContact O-N 3.2Å |
| 445 | E | 74.9 | Confident | 64.2 | Low | 110 Ų | 110 | 123.2 Ų | 123.2 | 51% | 0.514 | 64% | 0.635 | S | S | . | * | E | Extended strand (participates in β ladder) | trans | -103.5 | 135.2 | 158.2 | -177.3 | 177.5 | -179.9 | 0 | 0 | 108.8 | R433 V435 | R433-E445 WeakPolarHBondContact CD-OE1 3.39Å; R433-E445 IonicContact NE-OE1 3.69Å; R433-E445 PolarHBondContact NE-OE1 3.25Å; V435-E445 HydrophobicContact CG2-CG 4.41Å |
| 446 | S | 69.9 | Low | 62.7 | Low | 59 Ų | 59 | 125.1 Ų | 125.1 | 41% | 0.413 | 65% | 0.651 | S | S | . | * | E | Extended strand (participates in β ladder) | trans | -129.9 | 127.2 | 171.8 | 52 | 0 | 0 | 0 | 0 | 109.1 | T434 | T434-S446 PolarHBondContact N-O 2.88Å; T434-S446 PolarHBondContact O-N 3.27Å; T434-S446 PolarHBondContact O-OG 3.2Å; T434-S446 PolarHBondContact OG1-O 2.71Å; T434-S446 PolarHBondContact OG1-OG 2.94Å |
| 447 | T | 68.9 | Low | 62 | Low | 79 Ų | 79 | 129 Ų | 129 | 49% | 0.485 | 69% | 0.688 | S | S | . | * | E | Extended strand (participates in β ladder) | trans | -114.6 | 120.5 | 179.5 | -64.4 | 0 | 0 | 0 | 0 | 108.9 | I431 | I431-T447 HydrophobicContact CG2-CG2 3.43Å; I431-T447 VanDerWaalsContact CG2-CG2 3.43Å |
| 448 | A | 61.8 | Low | 61.2 | Low | 56 Ų | 56 | 130.8 Ų | 130.8 | 46% | 0.463 | 69% | 0.693 | S | S | . | * | E | Extended strand (participates in β ladder) | trans | -117.8 | 114.4 | 179.5 | 0 | 0 | 0 | 0 | 0 | 110.6 | V432 R450 | V432-A448 PolarHBondContact N-O 2.81Å; V432-A448 PolarHBondContact O-N 2.91Å; A448-R450 PolarHBondContact O-N 3.24Å |
| 449 | E | 60.9 | Low | 61.3 | Low | 128 Ų | 128 | 128.8 Ų | 128.8 | 60% | 0.598 | 70% | 0.696 | S | S | * | * | E | Extended strand (participates in β ladder) | trans | -81.4 | 101.5 | 173 | -170.9 | -176.3 | -171.8 | 0 | 0 | 109.7 | K451 | E449-K451 PolarHBondContact O-N 3.3Å |
| 450 | R | 58.8 | Low | 61.1 | Low | 206 Ų | 206 | 128 Ų | 128 | 78% | 0.777 | 69% | 0.692 | S | S | * | * | E | Extended strand (participates in β ladder) | trans | -84.8 | 112.2 | 167.2 | -89.2 | -166.9 | 171.3 | -150.7 | -0.8 | 109.8 | A448 E452 | A448-R450 PolarHBondContact O-N 3.24Å; R450-E452 PolarHBondContact O-N 3.49Å |
| 451 | K | 51.9 | Low | 60.5 | Low | 177 Ų | 177 | 131.1 Ų | 131.1 | 77% | 0.77 | 69% | 0.687 | S | S | * | * | trans | -92.5 | 96.1 | 176.9 | -164 | 172.3 | -163 | 160.7 | 0 | 109 | E449 I453 | E449-K451 PolarHBondContact O-N 3.3Å; K451-I453 PolarHBondContact O-N 2.75Å | ||
| 452 | E | 48.9 | Very low | 60.3 | Low | 168 Ų | 168 | 129.7 Ų | 129.7 | 79% | 0.785 | 69% | 0.685 | S | S | * | * | P | Polyproline II helix | trans | -62.6 | 129.7 | 176.1 | -67.9 | -170.8 | 156.4 | 0 | 0 | 110.4 | R450 | R450-E452 PolarHBondContact O-N 3.49Š|
| 453 | I | 52.9 | Low | 59.1 | Low | 152 Ų | 152 | 131 Ų | 131 | 78% | 0.779 | 69% | 0.693 | S | S | * | * | P | Polyproline II helix | trans | -89.1 | 127.3 | 167.7 | -58.9 | 173.2 | 0 | 0 | 0 | 105.3 | K451 D455 | K451-I453 PolarHBondContact O-N 2.75Å; I453-D455 PolarHBondContact O-N 2.66Å |
| 454 | P | 45.3 | Very low | 57.8 | Low | 106 Ų | 106 | 132.5 Ų | 132.5 | 69% | 0.688 | 70% | 0.703 | S | S | * | * | P | Polyproline II helix | trans | -68.4 | 126.1 | 174.2 | 28.5 | -32.9 | 0 | 0 | 0 | 109.4 | S456 | P454-S456 PolarHBondContact O-N 2.77Š|
| 455 | D | 46.4 | Very low | 56.7 | Low | 166 Ų | 166 | 132.4 Ų | 132.4 | 89% | 0.888 | 71% | 0.712 | S | S | * | * | P | Polyproline II helix | trans | -56.8 | 132.8 | 165.5 | -78.2 | -40.1 | 0 | 0 | 0 | 109 | I453 | I453-D455 PolarHBondContact O-N 2.66Š|
| 456 | S | 41.8 | Very low | 55.2 | Low | 109 Ų | 109 | 134.3 Ų | 134.3 | 76% | 0.762 | 73% | 0.728 | S | S | * | * | P | Polyproline II helix | trans | -92 | 144.8 | 174.6 | -58.4 | 0 | 0 | 0 | 0 | 109.5 | P454 | P454-S456 PolarHBondContact O-N 2.77Š|
| 457 | P | 55.1 | Low | 53.9 | Low | 205 Ų | 205 | 141.1 Ų | 141.1 | 100% | 1.331 | 76% | 0.757 | S | S | * | * | trans | -71.2 | 0 | -176.6 | 31.7 | -37.3 | 0 | 0 | 0 | 113.6 |
Retrieved 457 of 457 residues in 70.9 ms
(Link to these results)