| 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 | 39.7 | Very low | 235 Ų | 235 | 162 Ų | 162 | 100% | 1.158 | 81% | 0.813 | S | S | * | * | 0 | 99.1 | 0 | -69.6 | 151.7 | 167.8 | 0 | 0 | 105.9 | |||||
| 2 | S | 38.9 | Very low | 39.1 | Very low | 106 Ų | 106 | 154.7 Ų | 154.7 | 74% | 0.741 | 81% | 0.809 | S | S | * | * | 80.6 | 102.5 | 101.7 | -70.3 | 0 | 0 | 0 | 0 | 111.4 | |||||
| 3 | Q | 39.1 | Very low | 38.7 | Very low | 181 Ų | 181 | 157.3 Ų | 157.3 | 85% | 0.846 | 81% | 0.814 | S | S | * | * | 80.4 | 138.6 | 77.7 | -85.5 | -164.2 | 8.8 | 0 | 0 | 112.4 | |||||
| 4 | D | 42.1 | Very low | 38.5 | Very low | 107 Ų | 107 | 155 Ų | 155 | 57% | 0.572 | 82% | 0.819 | S | S | * | * | cis | -163.5 | 167.7 | -10.3 | -165.7 | 9.6 | 0 | 0 | 0 | 110.5 | ||||
| 5 | K | 40.5 | Very low | 38.8 | Very low | 167 Ų | 167 | 154.6 Ų | 154.6 | 73% | 0.726 | 82% | 0.817 | S | S | * | * | trans | 42.3 | 122.3 | 156.8 | -84.9 | 162.9 | -160.3 | 72.8 | 0 | 122.9 | ||||
| 6 | S | 46.1 | Very low | 39.2 | Very low | 112 Ų | 112 | 151.9 Ų | 151.9 | 78% | 0.783 | 81% | 0.811 | S | S | * | * | trans | -61.5 | 154.6 | 154.6 | 46.4 | 0 | 0 | 0 | 0 | 115.5 | ||||
| 7 | R | 35.5 | Very low | 39.2 | Very low | 242 Ų | 242 | 152 Ų | 152 | 91% | 0.913 | 81% | 0.811 | S | S | * | * | trans | -165.5 | 134.3 | 144.2 | -114 | 173.8 | -178.2 | -177.9 | -0.5 | 113.7 | ||||
| 8 | F | 38.3 | Very low | 39.3 | Very low | 198 Ų | 198 | 153.2 Ų | 153.2 | 87% | 0.868 | 81% | 0.81 | S | S | * | * | trans | -107.5 | 178.4 | 154.9 | -76.8 | -76 | 0 | 0 | 0 | 106.9 | ||||
| 9 | P | 45.9 | Very low | 39.2 | Very low | 106 Ų | 106 | 151.5 Ų | 151.5 | 69% | 0.688 | 80% | 0.802 | S | S | * | * | cis | -151.6 | 176 | 20.9 | 47.5 | -27.2 | 0 | 0 | 0 | 119.8 | ||||
| 10 | I | 36.3 | Very low | 39.2 | Very low | 141 Ų | 141 | 151.4 Ų | 151.4 | 72% | 0.723 | 80% | 0.802 | S | S | * | * | trans | 61.4 | 129 | 133.6 | -75.1 | 170.5 | 0 | 0 | 0 | 124.2 | ||||
| 11 | M | 35.6 | Very low | 39 | Very low | 187 Ų | 187 | 151 Ų | 151 | 92% | 0.921 | 81% | 0.805 | S | S | * | * | trans | 57.7 | 147.6 | 150.8 | -73.3 | 166.8 | -176.2 | 0 | 0 | 122.9 | ||||
| 12 | G | 33.1 | Very low | 39.1 | Very low | 74 Ų | 74 | 150.4 Ų | 150.4 | 76% | 0.763 | 79% | 0.791 | S | S | * | * | trans | 155.2 | 84.7 | 159.7 | 0 | 0 | 0 | 0 | 0 | 117.6 | ||||
| 13 | E | 33.8 | Very low | 39 | Very low | 189 Ų | 189 | 148.4 Ų | 148.4 | 88% | 0.883 | 79% | 0.787 | S | S | * | * | trans | 14.6 | 163.5 | 153 | -69.8 | 178.1 | 89.4 | 0 | 0 | 126.1 | ||||
| 14 | S | 36.5 | Very low | 39.4 | Very low | 125 Ų | 125 | 145.7 Ų | 145.7 | 87% | 0.874 | 79% | 0.785 | S | S | * | * | trans | 97 | 138 | 152.1 | 80.2 | 0 | 0 | 0 | 0 | 120.7 | ||||
| 15 | N | 42.3 | Very low | 39.1 | Very low | 149 Ų | 149 | 146.6 Ų | 146.6 | 80% | 0.797 | 80% | 0.795 | S | S | * | * | trans | -146.5 | 125.5 | 172.1 | 166.9 | 15.8 | 0 | 0 | 0 | 107.1 | ||||
| 16 | P | 45.1 | Very low | 39 | Very low | 111 Ų | 111 | 147.1 Ų | 147.1 | 72% | 0.721 | 80% | 0.8 | S | S | * | * | trans | -146.1 | 137.2 | 135.5 | 33.8 | -16.8 | 0 | 0 | 0 | 116.4 | ||||
| 17 | L | 39.6 | Very low | 38.9 | Very low | 154 Ų | 154 | 147.7 Ų | 147.7 | 81% | 0.806 | 80% | 0.801 | S | S | * | * | trans | 0.6 | 128.5 | 146.1 | -63.2 | 162.7 | 0 | 0 | 0 | 119.9 | ||||
| 18 | H | 40.8 | Very low | 38.7 | Very low | 173 Ų | 173 | 139.2 Ų | 139.2 | 80% | 0.801 | 79% | 0.788 | S | S | * | * | trans | -161.4 | 130.5 | 133.1 | -116.6 | 71.8 | 0 | 0 | 0 | 117.3 | ||||
| 19 | N | 36.8 | Very low | 38.6 | Very low | 121 Ų | 121 | 140.2 Ų | 140.2 | 65% | 0.647 | 79% | 0.793 | S | S | * | * | trans | 27.6 | 117.9 | 152.7 | -62.7 | -9.5 | 0 | 0 | 0 | 125.6 | ||||
| 20 | N | 39.3 | Very low | 38.1 | Very low | 150 Ų | 150 | 138.8 Ų | 138.8 | 80% | 0.802 | 80% | 0.797 | S | S | * | * | 25.7 | 130.8 | 110.1 | -58.7 | -18 | 0 | 0 | 0 | 122.1 | |||||
| 21 | V | 36.1 | Very low | 38.5 | Very low | 143 Ų | 143 | 141 Ų | 141 | 87% | 0.867 | 81% | 0.807 | S | S | * | * | trans | -146.7 | 145.8 | 135 | 168.9 | 0 | 0 | 0 | 0 | 111.2 | ||||
| 22 | Y | 39.3 | Very low | 39.5 | Very low | 223 Ų | 223 | 137.7 Ų | 137.7 | 88% | 0.875 | 80% | 0.799 | S | S | * | * | trans | -50.8 | 167.2 | 179.6 | -66.8 | -91.4 | 0 | 0 | 0 | 118.1 | ||||
| 23 | G | 36.7 | Very low | 40.2 | Very low | 63 Ų | 63 | 139.9 Ų | 139.9 | 65% | 0.649 | 80% | 0.8 | S | S | * | * | cis | 166 | -158.8 | 3.3 | 0 | 0 | 0 | 0 | 0 | 109.9 | ||||
| 24 | P | 47.2 | Very low | 40.8 | Very low | 124 Ų | 124 | 135.9 Ų | 135.9 | 81% | 0.805 | 79% | 0.791 | S | S | * | * | cis | -110.1 | -143.7 | -11.6 | 23 | 2.7 | 0 | 0 | 0 | 109.7 | ||||
| 25 | T | 36.2 | Very low | 41 | Very low | 127 Ų | 127 | 136.5 Ų | 136.5 | 78% | 0.779 | 78% | 0.784 | S | S | * | * | cis | -152.6 | -152.8 | 5.6 | -28.8 | 0 | 0 | 0 | 0 | 110.9 | ||||
| 26 | Q | 38 | Very low | 40.7 | Very low | 177 Ų | 177 | 139.9 Ų | 139.9 | 83% | 0.827 | 79% | 0.787 | S | S | * | * | trans | -154.1 | -179.2 | -172.7 | -77.5 | -164.5 | -1.9 | 0 | 0 | 110.1 | ||||
| 27 | P | 43.6 | Very low | 40.3 | Very low | 125 Ų | 125 | 138.3 Ų | 138.3 | 81% | 0.812 | 78% | 0.779 | S | S | * | * | cis | -138.9 | 177 | 7.2 | 43.5 | -26.2 | 0 | 0 | 0 | 117.8 | ||||
| 28 | G | 32.9 | Very low | 40.1 | Very low | 63 Ų | 63 | 140.8 Ų | 140.8 | 65% | 0.649 | 79% | 0.786 | S | S | * | * | trans | 138.5 | 115.5 | 142.5 | 0 | 0 | 0 | 0 | 0 | 119 | ||||
| 29 | F | 35.4 | Very low | 40 | Very low | 220 Ų | 220 | 135.8 Ų | 135.8 | 97% | 0.965 | 78% | 0.781 | S | S | * | * | trans | 51.2 | 125.9 | 157.3 | -72.9 | -89.5 | 0 | 0 | 0 | 121.3 | ||||
| 30 | G | 35.2 | Very low | 40.1 | Very low | 75 Ų | 75 | 136.6 Ų | 136.6 | 77% | 0.773 | 79% | 0.793 | S | S | * | * | trans | -114 | 167.5 | 167.1 | 0 | 0 | 0 | 0 | 0 | 112.9 | ||||
| 31 | M | 45.5 | Very low | 39.8 | Very low | 189 Ų | 189 | 133.6 Ų | 133.6 | 93% | 0.931 | 80% | 0.797 | S | S | * | * | trans | -127.1 | 144.3 | 176.7 | -74.2 | -177.8 | 165.2 | 0 | 0 | 111.5 | ||||
| 32 | P | 56.5 | Low | 39.7 | Very low | 116 Ų | 116 | 129.5 Ų | 129.5 | 75% | 0.753 | 79% | 0.785 | S | S | * | * | P | Polyproline II helix | trans | -79.7 | 161.4 | 173.9 | 33.9 | -35.2 | 0 | 0 | 0 | 112.5 | ||
| 33 | P | 48.1 | Very low | 39.6 | Very low | 120 Ų | 120 | 125.4 Ų | 125.4 | 78% | 0.779 | 79% | 0.785 | S | S | * | * | P | Polyproline II helix | trans | -72.1 | 151.5 | -178.4 | 29.5 | -35.7 | 0 | 0 | 0 | 113.4 | ||
| 34 | P | 45.2 | Very low | 39.6 | Very low | 106 Ų | 106 | 132.7 Ų | 132.7 | 69% | 0.688 | 80% | 0.795 | S | S | * | * | P | Polyproline II helix | trans | -69.5 | 138.7 | -178.3 | -19.8 | 33.3 | 0 | 0 | 0 | 114.3 | ||
| 35 | N | 40.6 | Very low | 39.6 | Very low | 138 Ų | 138 | 132.3 Ų | 132.3 | 74% | 0.738 | 79% | 0.792 | S | S | * | * | P | Polyproline II helix | trans | -93.6 | 116.9 | 169.5 | 179.5 | 8.1 | 0 | 0 | 0 | 110 | S37 | N35-S37 PolarHBondContact O-N 3.02Å; N35-S37 VanDerWaalsContact O-N 3.09Å |
| 36 | Y | 37.6 | Very low | 40 | Very low | 220 Ų | 220 | 132.5 Ų | 132.5 | 86% | 0.863 | 80% | 0.795 | S | S | * | * | trans | -82.8 | 81.3 | 177.4 | -76.9 | -81.4 | 0 | 0 | 0 | 111.6 | ||||
| 37 | S | 35.9 | Very low | 39.8 | Very low | 77 Ų | 77 | 133.3 Ų | 133.3 | 54% | 0.538 | 80% | 0.799 | S | S | . | * | trans | -131.1 | 130.6 | 169 | 60.9 | 0 | 0 | 0 | 0 | 111.6 | N35 | N35-S37 PolarHBondContact O-N 3.02Å; N35-S37 VanDerWaalsContact O-N 3.09Å | ||
| 38 | Q | 34.7 | Very low | 39.4 | Very low | 206 Ų | 206 | 132 Ų | 132 | 96% | 0.963 | 80% | 0.799 | S | S | * | * | trans | 72.7 | 123.8 | 179.6 | -50.4 | -166.9 | 40.5 | 0 | 0 | 117 | ||||
| 39 | G | 38.7 | Very low | 39.3 | Very low | 68 Ų | 68 | 132.5 Ų | 132.5 | 70% | 0.701 | 80% | 0.804 | S | S | * | * | trans | -136.9 | 142.9 | 162.9 | 0 | 0 | 0 | 0 | 0 | 109.1 | ||||
| 40 | P | 39.9 | Very low | 39.3 | Very low | 139 Ų | 139 | 133.6 Ų | 133.6 | 90% | 0.903 | 80% | 0.803 | S | S | * | * | trans | -72.2 | 160.1 | -174.7 | -18.8 | 33.6 | 0 | 0 | 0 | 114.1 | ||||
| 41 | G | 32.3 | Very low | 39.1 | Very low | 86 Ų | 86 | 133.5 Ų | 133.5 | 89% | 0.887 | 80% | 0.803 | S | S | * | * | trans | -80.1 | 154.5 | -170 | 0 | 0 | 0 | 0 | 0 | 116.7 | ||||
| 42 | G | 33.7 | Very low | 38.8 | Very low | 58 Ų | 58 | 133.9 Ų | 133.9 | 60% | 0.598 | 80% | 0.802 | S | S | * | * | trans | -152.1 | 148 | 165.4 | 0 | 0 | 0 | 0 | 0 | 109.2 | ||||
| 43 | P | 38.6 | Very low | 37.9 | Very low | 137 Ų | 137 | 134.6 Ų | 134.6 | 89% | 0.89 | 81% | 0.807 | S | S | * | * | P | Polyproline II helix | trans | -83.5 | 145.2 | -161.9 | 31.4 | -35.7 | 0 | 0 | 0 | 115.2 | ||
| 44 | Y | 36.4 | Very low | 37.1 | Very low | 216 Ų | 216 | 131.8 Ų | 131.8 | 85% | 0.847 | 80% | 0.8 | S | S | * | * | P | Polyproline II helix | trans | -92.2 | 150.7 | 173.3 | -76.7 | -102.3 | 0 | 0 | 0 | 112.4 | ||
| 45 | P | 46.7 | Very low | 36.3 | Very low | 115 Ų | 115 | 137.2 Ų | 137.2 | 75% | 0.747 | 81% | 0.813 | S | S | * | * | P | Polyproline II helix | trans | -76.8 | 140.2 | 157 | 33.1 | -31.9 | 0 | 0 | 0 | 110.7 | ||
| 46 | P | 44.5 | Very low | 35.9 | Very low | 131 Ų | 131 | 135.3 Ų | 135.3 | 85% | 0.851 | 82% | 0.816 | S | S | * | * | P | Polyproline II helix | trans | -79.9 | 142.1 | -176.3 | 31.2 | -34.8 | 0 | 0 | 0 | 113.4 | ||
| 47 | Q | 34.2 | Very low | 35.8 | Very low | 195 Ų | 195 | 133.8 Ų | 133.8 | 91% | 0.911 | 82% | 0.817 | S | S | * | * | P | Polyproline II helix | trans | -93.9 | 132.7 | 174.6 | -168.5 | 174.6 | 9.8 | 0 | 0 | 110.1 | G49 | Q47-G49 PolarHBondContact O-N 3.31Š|
| 48 | A | 34.2 | Very low | 36.1 | Very low | 98 Ų | 98 | 136.2 Ų | 136.2 | 81% | 0.81 | 83% | 0.831 | S | S | * | * | trans | -79.3 | 115.2 | -174.3 | 0 | 0 | 0 | 0 | 0 | 112.6 | ||||
| 49 | G | 31.8 | Very low | 36 | Very low | 73 Ų | 73 | 129.7 Ų | 129.7 | 75% | 0.753 | 82% | 0.819 | S | S | * | * | trans | -109.9 | 129.3 | 167.9 | 0 | 0 | 0 | 0 | 0 | 111.2 | Q47 | Q47-G49 PolarHBondContact O-N 3.31Š| ||
| 50 | Y | 34.3 | Very low | 36.2 | Very low | 242 Ų | 242 | 132.8 Ų | 132.8 | 95% | 0.949 | 83% | 0.827 | S | S | * | * | P | Polyproline II helix | trans | -79 | 130 | 173.5 | -81.4 | -95.7 | 0 | 0 | 0 | 110.3 | ||
| 51 | G | 32.6 | Very low | 35.9 | Very low | 74 Ų | 74 | 129.4 Ų | 129.4 | 76% | 0.763 | 82% | 0.817 | S | S | * | * | P | Polyproline II helix | trans | -93.2 | 160.3 | -170.7 | 0 | 0 | 0 | 0 | 0 | 115.2 | ||
| 52 | Q | 37.7 | Very low | 35.9 | Very low | 196 Ų | 196 | 135.9 Ų | 135.9 | 92% | 0.916 | 82% | 0.821 | S | S | * | * | P | Polyproline II helix | trans | -86.1 | 142.2 | 158.8 | -72.5 | -174.8 | -32.3 | 0 | 0 | 110.4 | ||
| 53 | P | 37.4 | Very low | 36.2 | Very low | 131 Ų | 131 | 137.2 Ų | 137.2 | 85% | 0.851 | 83% | 0.827 | S | S | * | * | P | Polyproline II helix | trans | -87.7 | 142.8 | 159.2 | 32.5 | -26.6 | 0 | 0 | 0 | 110.7 | ||
| 54 | G | 31.4 | Very low | 36.1 | Very low | 61 Ų | 61 | 137.1 Ų | 137.1 | 63% | 0.629 | 83% | 0.826 | S | S | * | * | trans | -151.6 | 145 | 173.8 | 0 | 0 | 0 | 0 | 0 | 112.5 | ||||
| 55 | F | 29.8 | Very low | 36.2 | Very low | 221 Ų | 221 | 129.9 Ų | 129.9 | 97% | 0.969 | 82% | 0.817 | S | S | * | * | trans | -167.8 | 150.5 | 171.8 | -76.1 | -61.6 | 0 | 0 | 0 | 106.6 | ||||
| 56 | A | 31.6 | Very low | 35.9 | Very low | 97 Ų | 97 | 130.3 Ų | 130.3 | 80% | 0.802 | 82% | 0.82 | S | S | * | * | cis | -156.8 | 169.7 | -15.6 | 0 | 0 | 0 | 0 | 0 | 108.5 | ||||
| 57 | Q | 36.6 | Very low | 35.5 | Very low | 188 Ų | 188 | 134.3 Ų | 134.3 | 88% | 0.879 | 82% | 0.82 | S | S | * | * | trans | -99.5 | 151.6 | 171.2 | -114.7 | -173.6 | 11.6 | 0 | 0 | 110.3 | ||||
| 58 | P | 40.7 | Very low | 35.7 | Very low | 128 Ų | 128 | 131 Ų | 131 | 83% | 0.831 | 82% | 0.815 | S | S | * | * | -153.3 | 178.8 | 77.9 | 41.6 | -23 | 0 | 0 | 0 | 116.6 | |||||
| 59 | G | 33.3 | Very low | 35.9 | Very low | 69 Ų | 69 | 134.7 Ų | 134.7 | 71% | 0.711 | 82% | 0.816 | S | S | * | * | trans | 123.9 | 134.9 | 158.8 | 0 | 0 | 0 | 0 | 0 | 115.9 | ||||
| 60 | P | 42.6 | Very low | 36.1 | Very low | 134 Ų | 134 | 139.2 Ų | 139.2 | 87% | 0.87 | 82% | 0.819 | S | S | * | * | trans | -106.7 | 134.2 | -173.4 | 37.2 | -30.9 | 0 | 0 | 0 | 115.8 | ||||
| 61 | G | 33.1 | Very low | 36.3 | Very low | 68 Ų | 68 | 133.6 Ų | 133.6 | 70% | 0.701 | 81% | 0.812 | S | S | * | * | trans | 82.4 | 122.4 | 144.3 | 0 | 0 | 0 | 0 | 0 | 119.3 | ||||
| 62 | F | 32.3 | Very low | 36.6 | Very low | 221 Ų | 221 | 139.8 Ų | 139.8 | 97% | 0.969 | 81% | 0.814 | S | S | * | * | trans | -158.4 | 168.6 | 137.2 | -110.2 | -73 | 0 | 0 | 0 | 109.9 | ||||
| 63 | A | 41.3 | Very low | 36.9 | Very low | 86 Ų | 86 | 136.6 Ų | 136.6 | 71% | 0.711 | 81% | 0.811 | S | S | * | * | P | Polyproline II helix | trans | -76.6 | 155.9 | -167 | 0 | 0 | 0 | 0 | 0 | 114.6 | G65 | A63-G65 PolarHBondContact O-N 2.88Š|
| 64 | P | 35.2 | Very low | 36.9 | Very low | 135 Ų | 135 | 139.3 Ų | 139.3 | 88% | 0.877 | 81% | 0.812 | S | S | * | * | P | Polyproline II helix | trans | -71.8 | 120.9 | 179.7 | 28.6 | -34.7 | 0 | 0 | 0 | 112.7 | ||
| 65 | G | 39.2 | Very low | 37.1 | Very low | 64 Ų | 64 | 144.7 Ų | 144.7 | 66% | 0.66 | 82% | 0.823 | S | S | * | * | P | Polyproline II helix | trans | -90.5 | 157.3 | 166.8 | 0 | 0 | 0 | 0 | 0 | 112.5 | A63 | A63-G65 PolarHBondContact O-N 2.88Š|
| 66 | P | 40.4 | Very low | 37.5 | Very low | 125 Ų | 125 | 140 Ų | 140 | 81% | 0.812 | 82% | 0.815 | S | S | * | * | P | Polyproline II helix | trans | -74.3 | 145.9 | -176.4 | 30.3 | -35.3 | 0 | 0 | 0 | 113.3 | ||
| 67 | Y | 35.8 | Very low | 37.7 | Very low | 214 Ų | 214 | 146 Ų | 146 | 84% | 0.839 | 82% | 0.818 | S | S | * | * | P | Polyproline II helix | trans | -71.8 | 131.3 | 176.6 | 11.7 | -100.4 | 0 | 0 | 0 | 111.9 | ||
| 68 | P | 39 | Very low | 38.1 | Very low | 126 Ų | 126 | 143 Ų | 143 | 82% | 0.818 | 82% | 0.815 | S | S | * | * | P | Polyproline II helix | trans | -74.5 | 126.4 | 171.6 | 29.9 | -32.6 | 0 | 0 | 0 | 110.8 | ||
| 69 | Q | 38 | Very low | 37.9 | Very low | 176 Ų | 176 | 146.1 Ų | 146.1 | 82% | 0.822 | 82% | 0.818 | S | S | * | * | P | Polyproline II helix | trans | -77 | 143.7 | 168.6 | -73.5 | -157.1 | 12.8 | 0 | 0 | 111.4 | ||
| 70 | M | 37 | Very low | 38 | Very low | 168 Ų | 168 | 145.7 Ų | 145.7 | 83% | 0.828 | 81% | 0.814 | S | S | * | * | P | Polyproline II helix | trans | -80.6 | 136.8 | 163.6 | -68 | -175.9 | 176 | 0 | 0 | 110 | ||
| 71 | P | 37.8 | Very low | 37.9 | Very low | 123 Ų | 123 | 145.4 Ų | 145.4 | 80% | 0.799 | 81% | 0.812 | S | S | * | * | P | Polyproline II helix | trans | -75.4 | 131.5 | 177.6 | -12.2 | 28 | 0 | 0 | 0 | 112 | ||
| 72 | Y | 39.7 | Very low | 37.9 | Very low | 204 Ų | 204 | 153.3 Ų | 153.3 | 80% | 0.8 | 82% | 0.822 | S | S | * | * | P | Polyproline II helix | trans | -79.3 | 129.4 | 165 | -62.9 | -91.3 | 0 | 0 | 0 | 109.8 | Q74 | Y72-Q74 PolarHBondContact O-N 3.1Š|
| 73 | P | 42.3 | Very low | 38.1 | Very low | 130 Ų | 130 | 150.5 Ų | 150.5 | 84% | 0.844 | 82% | 0.817 | S | S | * | * | P | Polyproline II helix | trans | -68.7 | 118.5 | 171.1 | -17.4 | 31.4 | 0 | 0 | 0 | 110.7 | ||
| 74 | Q | 37.1 | Very low | 37.8 | Very low | 188 Ų | 188 | 154.9 Ų | 154.9 | 88% | 0.879 | 82% | 0.823 | S | S | * | * | P | Polyproline II helix | trans | -83.3 | 133.1 | 166.4 | -70.6 | -162.6 | 11.5 | 0 | 0 | 110.4 | Y72 | Y72-Q74 PolarHBondContact O-N 3.1Š|
| 75 | M | 36.4 | Very low | 37.8 | Very low | 174 Ų | 174 | 151.8 Ų | 151.8 | 86% | 0.857 | 82% | 0.816 | S | S | * | * | P | Polyproline II helix | trans | -82.3 | 130.2 | 166.3 | -80.2 | -179.1 | 161.9 | 0 | 0 | 110.2 | ||
| 76 | P | 37.3 | Very low | 37.7 | Very low | 123 Ų | 123 | 154.8 Ų | 154.8 | 80% | 0.799 | 82% | 0.823 | S | S | * | * | P | Polyproline II helix | trans | -70.7 | 135.9 | 172.7 | -16.7 | 31 | 0 | 0 | 0 | 111.9 | P78 | P76-P78 WeakPolarHBondContact O-CD 3.29Š|
| 77 | Y | 37.8 | Very low | 37.3 | Very low | 222 Ų | 222 | 159.3 Ų | 159.3 | 87% | 0.871 | 83% | 0.826 | S | S | * | * | P | Polyproline II helix | trans | -78 | 125.7 | 166.5 | -74.6 | -96.6 | 0 | 0 | 0 | 110.3 | Q79 | Y77-Q79 PolarHBondContact O-N 3.34Š|
| 78 | P | 44 | Very low | 37.2 | Very low | 126 Ų | 126 | 157 Ų | 157 | 82% | 0.818 | 82% | 0.823 | S | S | * | * | P | Polyproline II helix | trans | -71.5 | 125.7 | 166.5 | -14.9 | 30.6 | 0 | 0 | 0 | 110.3 | P76 | P76-P78 WeakPolarHBondContact O-CD 3.29Š|
| 79 | Q | 36 | Very low | 37 | Very low | 193 Ų | 193 | 160.1 Ų | 160.1 | 90% | 0.902 | 83% | 0.826 | S | S | * | * | P | Polyproline II helix | trans | -76.7 | 122 | 166.7 | -70.3 | -170.8 | 2.2 | 0 | 0 | 109.6 | Y77 | Y77-Q79 PolarHBondContact O-N 3.34Š|
| 80 | G | 36.3 | Very low | 36.6 | Very low | 60 Ų | 60 | 154.9 Ų | 154.9 | 62% | 0.619 | 82% | 0.819 | S | S | * | * | P | Polyproline II helix | trans | -81.8 | 126.1 | 170.2 | 0 | 0 | 0 | 0 | 0 | 111.1 | Y82 | G80-Y82 PolarHBondContact O-N 2.99Š|
| 81 | P | 38.9 | Very low | 37 | Very low | 127 Ų | 127 | 153.5 Ų | 153.5 | 83% | 0.825 | 82% | 0.823 | S | S | * | * | P | Polyproline II helix | trans | -74.6 | 123.1 | 173.3 | 29.5 | -32.6 | 0 | 0 | 0 | 110.6 | ||
| 82 | Y | 34.6 | Very low | 36.7 | Very low | 235 Ų | 235 | 151.3 Ų | 151.3 | 92% | 0.922 | 82% | 0.823 | S | S | * | * | P | Polyproline II helix | trans | -66.2 | 133.8 | 168.8 | -60.6 | -89.3 | 0 | 0 | 0 | 109.9 | G80 | G80-Y82 PolarHBondContact O-N 2.99Š|
| 83 | N | 35.8 | Very low | 36.6 | Very low | 161 Ų | 161 | 150.6 Ų | 150.6 | 86% | 0.861 | 83% | 0.826 | S | S | * | * | trans | -128.7 | 143 | 167.6 | -160.1 | 1.9 | 0 | 0 | 0 | 110.1 | ||||
| 84 | Q | 35 | Very low | 36.7 | Very low | 178 Ų | 178 | 150.2 Ų | 150.2 | 83% | 0.832 | 82% | 0.824 | S | S | * | * | P | Polyproline II helix | trans | -94.7 | 146.3 | -171 | -62.8 | -178.8 | 1.9 | 0 | 0 | 111.3 | ||
| 85 | G | 34.4 | Very low | 36.5 | Very low | 70 Ų | 70 | 145.3 Ų | 145.3 | 72% | 0.722 | 82% | 0.816 | S | S | * | * | P | Polyproline II helix | trans | -74 | 131.2 | 176 | 0 | 0 | 0 | 0 | 0 | 112 | ||
| 86 | P | 37.3 | Very low | 36.3 | Very low | 127 Ų | 127 | 145.8 Ų | 145.8 | 83% | 0.825 | 81% | 0.813 | S | S | * | * | P | Polyproline II helix | trans | -86.8 | 149.8 | -179.6 | 34 | -34.8 | 0 | 0 | 0 | 113.1 | ||
| 87 | Y | 32.3 | Very low | 36.2 | Very low | 221 Ų | 221 | 148.4 Ų | 148.4 | 87% | 0.867 | 82% | 0.815 | S | S | * | * | trans | -109.1 | 142.5 | 167.8 | -81.8 | -84.3 | 0 | 0 | 0 | 111.4 | ||||
| 88 | Q | 34.9 | Very low | 36.1 | Very low | 166 Ų | 166 | 140 Ų | 140 | 78% | 0.776 | 80% | 0.795 | S | S | * | * | trans | 40.4 | 115.5 | 157.2 | -69.9 | -177.2 | -25.9 | 0 | 0 | 120.3 | ||||
| 89 | H | 33.8 | Very low | 35.6 | Very low | 191 Ų | 191 | 141.8 Ų | 141.8 | 88% | 0.884 | 80% | 0.798 | S | S | * | * | -163.6 | 160.5 | 98.1 | -96 | 104.9 | 0 | 0 | 0 | 111 | |||||
| 90 | G | 30.3 | Very low | 36.3 | Very low | 66 Ų | 66 | 138 Ų | 138 | 68% | 0.68 | 79% | 0.79 | S | S | * | * | trans | -120.9 | -158.9 | 164.3 | 0 | 0 | 0 | 0 | 0 | 109.9 | ||||
| 91 | P | 44.6 | Very low | 36.3 | Very low | 139 Ų | 139 | 144.2 Ų | 144.2 | 90% | 0.903 | 81% | 0.805 | S | S | * | * | cis | -124 | 172.8 | -1.5 | 40.9 | -27.6 | 0 | 0 | 0 | 113.8 | ||||
| 92 | G | 32.5 | Very low | 36.5 | Very low | 77 Ų | 77 | 142.9 Ų | 142.9 | 79% | 0.794 | 81% | 0.805 | S | S | * | * | trans | 170.8 | 118 | 167.7 | 0 | 0 | 0 | 0 | 0 | 116.3 | ||||
| 93 | Q | 36.9 | Very low | 37.1 | Very low | 188 Ų | 188 | 137.3 Ų | 137.3 | 88% | 0.879 | 80% | 0.798 | S | S | * | * | trans | -132.6 | 144.5 | 159.4 | -82.8 | -168.4 | -10.4 | 0 | 0 | 106.3 | ||||
| 94 | P | 44.5 | Very low | 37.6 | Very low | 123 Ų | 123 | 135 Ų | 135 | 80% | 0.799 | 80% | 0.801 | S | S | * | * | -150.6 | 138.1 | 79.3 | 36.7 | -16.6 | 0 | 0 | 0 | 118.5 | |||||
| 95 | A | 32.6 | Very low | 37.8 | Very low | 85 Ų | 85 | 130.4 Ų | 130.4 | 70% | 0.702 | 80% | 0.801 | S | S | * | * | 59.7 | 147.9 | 127.1 | 0 | 0 | 0 | 0 | 0 | 124.9 | |||||
| 96 | F | 31.7 | Very low | 37.7 | Very low | 184 Ų | 184 | 132.7 Ų | 132.7 | 81% | 0.807 | 81% | 0.806 | S | S | * | * | trans | 59.2 | 126.5 | 163.1 | -78.3 | -82.7 | 0 | 0 | 0 | 118.7 | ||||
| 97 | H | 35.7 | Very low | 38.2 | Very low | 178 Ų | 178 | 132.8 Ų | 132.8 | 82% | 0.824 | 81% | 0.807 | S | S | * | * | -164 | 157.4 | 72.5 | -115.7 | -86.5 | 0 | 0 | 0 | 114.3 | |||||
| 98 | G | 35.3 | Very low | 38.6 | Very low | 44 Ų | 44 | 125.5 Ų | 125.5 | 45% | 0.454 | 80% | 0.799 | S | S | . | * | trans | -93.2 | -179.8 | 151.9 | 0 | 0 | 0 | 0 | 0 | 111.3 | ||||
| 99 | D | 35 | Very low | 38.6 | Very low | 164 Ų | 164 | 128.7 Ų | 128.7 | 88% | 0.877 | 81% | 0.805 | S | S | * | * | cis | -135.4 | -108.6 | 12.6 | -74.7 | -71.9 | 0 | 0 | 0 | 113.8 | ||||
| 100 | P | 50.1 | Low | 39.2 | Very low | 115 Ų | 115 | 128.8 Ų | 128.8 | 75% | 0.747 | 81% | 0.806 | S | S | * | * | trans | -128.9 | 144.6 | -135.8 | 37.3 | -17 | 0 | 0 | 0 | 116.3 | ||||
| 101 | M | 35.3 | Very low | 39.7 | Very low | 189 Ų | 189 | 128.4 Ų | 128.4 | 93% | 0.931 | 80% | 0.802 | S | S | * | * | trans | -167.9 | 134.2 | 145.4 | -113.8 | 170.4 | -164.9 | 0 | 0 | 112.9 | ||||
| 102 | A | 44.8 | Very low | 40 | Very low | 99 Ų | 99 | 129.6 Ų | 129.6 | 82% | 0.818 | 80% | 0.801 | S | S | * | * | trans | -108.9 | 125.2 | 157.4 | 0 | 0 | 0 | 0 | 0 | 108.7 | ||||
| 103 | P | 47.3 | Very low | 41.1 | Very low | 119 Ų | 119 | 132 Ų | 132 | 77% | 0.773 | 80% | 0.799 | S | S | * | * | trans | -98.7 | 134.9 | 156.1 | -2.2 | 22.5 | 0 | 0 | 0 | 109.5 | ||||
| 104 | A | 44.7 | Very low | 42 | Very low | 113 Ų | 113 | 128 Ų | 128 | 93% | 0.934 | 79% | 0.79 | S | S | * | * | trans | -83.6 | 148.1 | 173.1 | 0 | 0 | 0 | 0 | 0 | 111.4 | ||||
| 105 | G | 39.4 | Very low | 42.5 | Very low | 81 Ų | 81 | 127.8 Ų | 127.8 | 84% | 0.835 | 79% | 0.789 | S | S | * | * | trans | 118.9 | 86.8 | 161.2 | 0 | 0 | 0 | 0 | 0 | 116.1 | ||||
| 106 | S | 33.4 | Very low | 43.4 | Very low | 118 Ų | 118 | 127 Ų | 127 | 83% | 0.825 | 78% | 0.778 | S | S | * | * | trans | -155 | 129.7 | 148.4 | -159 | 0 | 0 | 0 | 0 | 109.8 | ||||
| 107 | P | 46.3 | Very low | 44.4 | Very low | 129 Ų | 129 | 127.6 Ų | 127.6 | 84% | 0.838 | 78% | 0.776 | S | S | * | * | trans | -86.5 | 134.7 | -177.7 | 32.9 | -32.7 | 0 | 0 | 0 | 112.2 | ||||
| 108 | G | 40.8 | Very low | 44.9 | Very low | 67 Ų | 67 | 128.5 Ų | 128.5 | 69% | 0.691 | 77% | 0.774 | S | S | * | * | trans | 90.6 | 87.3 | 162.3 | 0 | 0 | 0 | 0 | 0 | 116.2 | ||||
| 109 | Y | 36 | Very low | 45.5 | Very low | 233 Ų | 233 | 132.1 Ų | 132.1 | 91% | 0.914 | 78% | 0.783 | S | S | * | * | trans | -148.8 | 109.3 | 138.5 | -106.9 | -78.2 | 0 | 0 | 0 | 107.8 | G111 | Y109-G111 VanDerWaalsContact C-N 3.33Å; Y109-G111 PolarHBondContact O-N 2.95Å; Y109-G111 VanDerWaalsContact O-N 3.09Å | ||
| 110 | H | 45.5 | Very low | 46.2 | Very low | 193 Ų | 193 | 128.1 Ų | 128.1 | 89% | 0.894 | 76% | 0.761 | S | S | * | * | trans | -73.5 | 95.3 | 162.3 | -87.2 | -91.9 | 0 | 0 | 0 | 106.9 | ||||
| 111 | G | 41 | Very low | 46.2 | Very low | 59 Ų | 59 | 130 Ų | 130 | 61% | 0.608 | 76% | 0.76 | S | S | * | * | trans | -75.9 | 126.3 | 164 | 0 | 0 | 0 | 0 | 0 | 108.8 | Y109 V113 | Y109-G111 VanDerWaalsContact C-N 3.33Å; Y109-G111 PolarHBondContact O-N 2.95Å; Y109-G111 VanDerWaalsContact O-N 3.09Å; G111-V113 VanDerWaalsContact C-N 3.35Å; G111-V113 PolarHBondContact O-N 2.76Å | ||
| 112 | D | 51.9 | Low | 46.9 | Very low | 163 Ų | 163 | 129.1 Ų | 129.1 | 87% | 0.872 | 75% | 0.754 | S | S | * | * | trans | -64.8 | 94.1 | 173.7 | -64.8 | -65.8 | 0 | 0 | 0 | 109.8 | P114 | D112-P114 WeakPolarHBondContact O-CD 3.26Š| ||
| 113 | V | 54.1 | Low | 47.1 | Very low | 127 Ų | 127 | 132.7 Ų | 132.7 | 77% | 0.77 | 75% | 0.751 | S | S | * | * | P | Polyproline II helix | trans | -66.8 | 119.3 | 168.5 | -176.3 | 0 | 0 | 0 | 0 | 106.6 | G111 | G111-V113 VanDerWaalsContact C-N 3.35Å; G111-V113 PolarHBondContact O-N 2.76Å |
| 114 | P | 57.5 | Low | 47.4 | Very low | 105 Ų | 105 | 129.3 Ų | 129.3 | 68% | 0.682 | 73% | 0.733 | S | S | * | * | P | Polyproline II helix | trans | -59.2 | 133.9 | 175.4 | 25.1 | -33.1 | 0 | 0 | 0 | 108.6 | D112 S116 | D112-P114 WeakPolarHBondContact O-CD 3.26Å; P114-S116 PolarHBondContact O-N 3.45Å |
| 115 | P | 54.8 | Low | 47.9 | Very low | 118 Ų | 118 | 125.3 Ų | 125.3 | 77% | 0.766 | 70% | 0.703 | S | S | * | * | P | Polyproline II helix | trans | -56.4 | 138.7 | -171.4 | 21.5 | -33 | 0 | 0 | 0 | 110.9 | ||
| 116 | S | 51.4 | Low | 48.9 | Very low | 69 Ų | 69 | 124.4 Ų | 124.4 | 48% | 0.483 | 68% | 0.684 | S | S | . | * | P | Polyproline II helix | trans | -66.5 | 145.5 | -170.2 | 82.2 | 0 | 0 | 0 | 0 | 110.9 | P114 Y118 D119 | P114-S116 PolarHBondContact O-N 3.45Å; S116-Y118 PolarHBondContact O-N 3.34Å; S116-D119 PolarHBondContact O-N 3.18Å |
| 117 | Y | 51.3 | Low | 50.2 | Low | 196 Ų | 196 | 120 Ų | 120 | 77% | 0.769 | 66% | 0.657 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -64.1 | 6.5 | -180 | -173.2 | -105 | 0 | 0 | 0 | 114.3 | N120 | Y117-N120 PolarHBondContact O-ND2 2.97Š|
| 118 | Y | 47.1 | Very low | 51 | Low | 198 Ų | 198 | 118.3 Ų | 118.3 | 78% | 0.776 | 64% | 0.641 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -98.3 | -11.7 | 176.6 | -73.5 | -79.9 | 0 | 0 | 0 | 114.3 | S116 N120 | S116-Y118 PolarHBondContact O-N 3.34Å; Y118-N120 PolarHBondContact O-N 2.69Å |
| 119 | D | 47.3 | Very low | 52.2 | Low | 119 Ų | 119 | 120.9 Ų | 120.9 | 64% | 0.636 | 64% | 0.635 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -75.4 | 27.5 | 173.5 | -68.1 | -51.8 | 0 | 0 | 0 | 113.5 | S116 E121 | S116-D119 PolarHBondContact O-N 3.18Å; D119-E121 VanDerWaalsContact C-N 3.32Å |
| 120 | N | 49.3 | Very low | 54 | Low | 80 Ų | 80 | 112.9 Ų | 112.9 | 43% | 0.428 | 61% | 0.608 | S | S | . | * | T | Hydrogen-bonded Turn | trans | -82.4 | -8.3 | 173.9 | -76 | -63.9 | 0 | 0 | 0 | 113 | Y117 Y118 E122 F123 A124 | Y117-N120 PolarHBondContact O-ND2 2.97Å; Y118-N120 PolarHBondContact O-N 2.69Å; N120-E122 VanDerWaalsContact C-N 3.27Å; N120-E122 PolarHBondContact O-N 3.43Å; N120-F123 PolarHBondContact O-N 3.05Å; N120-A124 WeakPolarHBondContact O-CB 3.47Å; N120-A124 PolarHBondContact O-N 2.92Å |
| 121 | E | 50.6 | Low | 55.4 | Low | 155 Ų | 155 | 108.2 Ų | 108.2 | 72% | 0.724 | 59% | 0.585 | S | S | * | * | H | α-helix | trans | -58.6 | -33.7 | 177.7 | -73.6 | -67.3 | 125.9 | 0 | 0 | 112.8 | D119 G125 | D119-E121 VanDerWaalsContact C-N 3.32Å; E121-G125 VanDerWaalsContact O-CA 3.31Å; E121-G125 WeakPolarHBondContact O-CA 3.27Å; E121-G125 PolarHBondContact O-N 2.93Å |
| 122 | E | 50.1 | Low | 57.3 | Low | 171 Ų | 171 | 110.2 Ų | 110.2 | 80% | 0.799 | 58% | 0.582 | S | S | * | * | H | α-helix | trans | -74.1 | -34.7 | 179.6 | -164.9 | 169.6 | -159.1 | 0 | 0 | 112.2 | N120 S126 | N120-E122 VanDerWaalsContact C-N 3.27Å; N120-E122 PolarHBondContact O-N 3.43Å; E122-S126 WeakPolarHBondContact O-CB 3.45Å; E122-S126 PolarHBondContact O-N 3.06Å; E122-S126 PolarHBondContact O-OG 3.31Å |
| 123 | F | 49.6 | Very low | 58.6 | Low | 174 Ų | 174 | 105.7 Ų | 105.7 | 76% | 0.763 | 56% | 0.557 | S | S | * | * | H | α-helix | trans | -78.8 | -33.2 | 176.4 | -152.8 | -92.4 | 0 | 0 | 0 | 112.4 | N120 S126 G127 | N120-F123 PolarHBondContact O-N 3.05Å; F123-S126 PolarHBondContact O-OG 3.29Å; F123-G127 PolarHBondContact O-N 3.08Å |
| 124 | A | 54.1 | Low | 59.9 | Low | 48 Ų | 48 | 102.6 Ų | 102.6 | 40% | 0.397 | 53% | 0.531 | S | S | . | . | H | α-helix | trans | -70.9 | -44.2 | 169.9 | 0 | 0 | 0 | 0 | 0 | 111.5 | N120 G127 L128 | N120-A124 WeakPolarHBondContact O-CB 3.47Å; N120-A124 PolarHBondContact O-N 2.92Å; A124-G127 CarbonylContact O-C 3.49Å; A124-G127 PolarHBondContact O-N 3.44Å; A124-L128 WeakPolarHBondContact O-CB 3.21Å; A124-L128 VanDerWaalsContact O-CG 3.26Å; A124-L128 WeakPolarHBondContact O-CG 3.24Å; A124-L128 PolarHBondContact O-N 3.44Å |
| 125 | G | 53.9 | Low | 61 | Low | 29 Ų | 29 | 103.1 Ų | 103.1 | 30% | 0.299 | 52% | 0.524 | S | S | . | . | H | α-helix | trans | -59.8 | -57.3 | -179.8 | 0 | 0 | 0 | 0 | 0 | 111.8 | E121 G127 L128 E129 | E121-G125 VanDerWaalsContact O-CA 3.31Å; E121-G125 WeakPolarHBondContact O-CA 3.27Å; E121-G125 PolarHBondContact O-N 2.93Å; G125-G127 VanDerWaalsContact C-N 3.29Å; G125-G127 PolarHBondContact O-N 3.3Å; G125-L128 CarbonylContact O-C 3.59Å; G125-L128 PolarHBondContact O-N 2.83Å; G125-E129 WeakPolarHBondContact O-CB 3.5Å; G125-E129 PolarHBondContact O-N 3.44Å |
| 126 | S | 60.9 | Low | 62.4 | Low | 61 Ų | 61 | 100.3 Ų | 100.3 | 43% | 0.427 | 51% | 0.511 | S | S | . | . | H | α-helix | trans | -54.1 | -44.3 | 173.9 | 52.6 | 0 | 0 | 0 | 0 | 112.1 | E122 F123 L128 E129 D130 | E122-S126 WeakPolarHBondContact O-CB 3.45Å; E122-S126 PolarHBondContact O-N 3.06Å; E122-S126 PolarHBondContact O-OG 3.31Å; F123-S126 PolarHBondContact O-OG 3.29Å; S126-L128 VanDerWaalsContact C-N 3.25Å; S126-L128 PolarHBondContact O-N 3.49Å; S126-E129 PolarHBondContact O-N 3.3Å; S126-D130 WeakPolarHBondContact O-CB 3.29Å; S126-D130 PolarHBondContact O-N 3.39Å |
| 127 | G | 61.6 | Low | 64 | Low | 26 Ų | 26 | 98 Ų | 98 | 27% | 0.268 | 49% | 0.492 | S | S | . | . | H | α-helix | trans | -69.1 | -10.4 | 176.2 | 0 | 0 | 0 | 0 | 0 | 116.2 | F123 A124 G125 K131 | F123-G127 PolarHBondContact O-N 3.08Å; A124-G127 CarbonylContact O-C 3.49Å; A124-G127 PolarHBondContact O-N 3.44Å; G125-G127 VanDerWaalsContact C-N 3.29Å; G125-G127 PolarHBondContact O-N 3.3Å; G127-K131 VanDerWaalsContact O-CD 3.26Å; G127-K131 WeakPolarHBondContact O-CD 3.44Å; G127-K131 WeakPolarHBondContact O-CE 3.28Å; G127-K131 WeakPolarHBondContact O-CG 3.31Å; G127-K131 PolarHBondContact O-NZ 3.18Å |
| 128 | L | 62.5 | Low | 65.6 | Low | 94 Ų | 94 | 90.1 Ų | 90.1 | 49% | 0.492 | 46% | 0.464 | S | S | . | . | H | α-helix | trans | -102.6 | -38.7 | 173 | -72.9 | 168.7 | 0 | 0 | 0 | 111.3 | A124 G125 S126 K131 N132 | A124-L128 WeakPolarHBondContact O-CB 3.21Å; A124-L128 VanDerWaalsContact O-CG 3.26Å; A124-L128 WeakPolarHBondContact O-CG 3.24Å; A124-L128 PolarHBondContact O-N 3.44Å; G125-L128 CarbonylContact O-C 3.59Å; G125-L128 PolarHBondContact O-N 2.83Å; S126-L128 VanDerWaalsContact C-N 3.25Å; S126-L128 PolarHBondContact O-N 3.49Å; L128-K131 HydrophobicContact CD2-CD 4.36Å; L128-K131 WeakPolarHBondContact O-CB 3.49Å; L128-K131 PolarHBondContact O-N 2.94Å; L128-N132 PolarHBondContact O-N 2.99Å; L128-N132 PolarHBondContact O-ND2 2.79Å |
| 129 | E | 66.7 | Low | 67.6 | Low | 120 Ų | 120 | 89.6 Ų | 89.6 | 56% | 0.561 | 46% | 0.46 | S | S | * | . | H | α-helix | trans | -58.3 | -46.4 | 171.2 | -176.1 | 166.1 | -162.2 | 0 | 0 | 111 | G125 S126 K131 N132 I133 | G125-E129 WeakPolarHBondContact O-CB 3.5Å; G125-E129 PolarHBondContact O-N 3.44Å; S126-E129 PolarHBondContact O-N 3.3Å; E129-K131 PolarHBondContact O-N 3.03Å; E129-K131 VanDerWaalsContact O-N 3.09Å; E129-N132 PolarHBondContact O-N 3.5Å; E129-N132 VanDerWaalsContact O-N 3.08Å; E129-I133 HydrophobicContact CG-CD1 3.63Å; E129-I133 HydrophobicContact CG-CG1 4.17Å; E129-I133 WeakPolarHBondContact O-CB 3.43Å; E129-I133 WeakPolarHBondContact O-CG1 3.5Å; E129-I133 PolarHBondContact O-N 3.45Å |
| 130 | D | 72.4 | Confident | 69.5 | Low | 66 Ų | 66 | 88.6 Ų | 88.6 | 35% | 0.353 | 45% | 0.45 | S | S | . | . | H | α-helix | trans | -48 | -38.6 | 170.4 | -121 | 19.9 | 0 | 0 | 0 | 112.8 | S126 R134 K311 | S126-D130 WeakPolarHBondContact O-CB 3.29Å; S126-D130 PolarHBondContact O-N 3.39Å; D130-R134 VanDerWaalsContact O-CB 3.23Å; D130-R134 WeakPolarHBondContact O-CB 3.49Å; D130-R134 PolarHBondContact O-N 3.13Å; D130-R134 PolarHBondContact O-NH1 3.06Å; D130-K311 WeakPolarHBondContact OD2-CE 3.3Å; D130-K311 IonicContact OD2-NZ 3.05Å; D130-K311 PolarHBondContact OD2-NZ 3.06Å |
| 131 | K | 76.1 | Confident | 71.5 | Confident | 95 Ų | 95 | 84.8 Ų | 84.8 | 41% | 0.413 | 43% | 0.43 | S | S | . | . | H | α-helix | trans | -80.5 | -42.7 | -178.6 | -63.4 | 167.8 | -172.5 | 136.1 | 0 | 110.8 | G127 L128 E129 R134 Q135 | G127-K131 VanDerWaalsContact O-CD 3.26Å; G127-K131 WeakPolarHBondContact O-CD 3.44Å; G127-K131 WeakPolarHBondContact O-CE 3.28Å; G127-K131 WeakPolarHBondContact O-CG 3.31Å; G127-K131 PolarHBondContact O-NZ 3.18Å; L128-K131 HydrophobicContact CD2-CD 4.36Å; L128-K131 WeakPolarHBondContact O-CB 3.49Å; L128-K131 PolarHBondContact O-N 2.94Å; E129-K131 PolarHBondContact O-N 3.03Å; E129-K131 VanDerWaalsContact O-N 3.09Å; K131-R134 PolarHBondContact O-N 2.71Å; K131-Q135 WeakPolarHBondContact O-CB 3.35Å; K131-Q135 WeakPolarHBondContact O-CG 3.2Å; K131-Q135 PolarHBondContact O-N 2.86Å |
| 132 | N | 81.2 | Confident | 73.4 | Confident | 101 Ų | 101 | 80 Ų | 80 | 54% | 0.54 | 41% | 0.407 | S | S | . | . | H | α-helix | trans | -67 | -45.2 | -179.8 | -69.1 | -23.1 | 0 | 0 | 0 | 111.7 | L128 E129 Q135 A136 | L128-N132 PolarHBondContact O-N 2.99Å; L128-N132 PolarHBondContact O-ND2 2.79Å; E129-N132 PolarHBondContact O-N 3.5Å; E129-N132 VanDerWaalsContact O-N 3.08Å; N132-Q135 PolarHBondContact O-N 2.65Å; N132-A136 WeakPolarHBondContact O-CB 3.22Å; N132-A136 PolarHBondContact O-N 3Å |
| 133 | I | 79.3 | Confident | 75.5 | Confident | 67 Ų | 67 | 75.2 Ų | 75.2 | 34% | 0.344 | 39% | 0.392 | S | S | . | . | H | α-helix | trans | -58.9 | -49.4 | 173.7 | -67.8 | 174.2 | 0 | 0 | 0 | 110.1 | E129 Q135 A136 F137 L315 | E129-I133 HydrophobicContact CG-CD1 3.63Å; E129-I133 HydrophobicContact CG-CG1 4.17Å; E129-I133 WeakPolarHBondContact O-CB 3.43Å; E129-I133 WeakPolarHBondContact O-CG1 3.5Å; E129-I133 PolarHBondContact O-N 3.45Å; I133-Q135 PolarHBondContact O-N 3.08Å; I133-A136 PolarHBondContact O-N 3.02Å; I133-F137 WeakPolarHBondContact O-CB 3.49Å; I133-F137 PolarHBondContact O-N 3.47Å; I133-L315 HydrophobicContact CG2-CD2 4.18Å |
| 134 | R | 79.9 | Confident | 77.5 | Confident | 62 Ų | 62 | 68.3 Ų | 68.3 | 23% | 0.234 | 36% | 0.364 | C | S | . | . | H | α-helix | trans | -63.2 | -39.9 | 178.9 | -171.1 | 168.9 | 69.9 | -92 | 2.9 | 112.6 | D130 K131 F137 I138 | D130-R134 VanDerWaalsContact O-CB 3.23Å; D130-R134 WeakPolarHBondContact O-CB 3.49Å; D130-R134 PolarHBondContact O-N 3.13Å; D130-R134 PolarHBondContact O-NH1 3.06Å; K131-R134 PolarHBondContact O-N 2.71Å; R134-F137 PolarHBondContact O-N 3.42Å; R134-I138 HydrophobicContact CG-CD1 3.81Å; R134-I138 HydrophobicContact CG-CG1 4.44Å; R134-I138 WeakPolarHBondContact O-CB 3.49Å; R134-I138 WeakPolarHBondContact O-CD1 3.26Å; R134-I138 WeakPolarHBondContact O-CG1 3.46Å; R134-I138 PolarHBondContact O-N 2.99Å |
| 135 | Q | 81.6 | Confident | 79.4 | Confident | 116 Ų | 116 | 66.4 Ų | 66.4 | 54% | 0.542 | 35% | 0.347 | S | S | . | . | H | α-helix | trans | -65.5 | -38.4 | 174.2 | -76.4 | -175.8 | 17.3 | 0 | 0 | 112.5 | K131 N132 I133 R139 | K131-Q135 WeakPolarHBondContact O-CB 3.35Å; K131-Q135 WeakPolarHBondContact O-CG 3.2Å; K131-Q135 PolarHBondContact O-N 2.86Å; N132-Q135 PolarHBondContact O-N 2.65Å; I133-Q135 PolarHBondContact O-N 3.08Å; Q135-R139 WeakPolarHBondContact O-CB 3.46Å; Q135-R139 PolarHBondContact O-N 3.24Å |
| 136 | A | 83.3 | Confident | 81.4 | Confident | 59 Ų | 59 | 68.6 Ų | 68.6 | 49% | 0.488 | 36% | 0.355 | S | S | . | . | H | α-helix | trans | -65.4 | -42.3 | 174.5 | 0 | 0 | 0 | 0 | 0 | 111.7 | N132 I133 R139 K140 | N132-A136 WeakPolarHBondContact O-CB 3.22Å; N132-A136 PolarHBondContact O-N 3Å; I133-A136 PolarHBondContact O-N 3.02Å; A136-R139 PolarHBondContact O-N 2.9Å; A136-K140 WeakPolarHBondContact O-CB 3.12Å; A136-K140 PolarHBondContact O-N 3.22Å |
| 137 | F | 84.7 | Confident | 83.1 | Confident | 20 Ų | 20 | 69.7 Ų | 69.7 | 9% | 0.088 | 36% | 0.359 | C | S | . | . | H | α-helix | trans | -60.9 | -52 | 174.2 | 176.7 | -100.2 | 0 | 0 | 0 | 112.1 | I133 R134 R139 K140 V141 L307 L313 A314 E319 | I133-F137 WeakPolarHBondContact O-CB 3.49Å; I133-F137 PolarHBondContact O-N 3.47Å; R134-F137 PolarHBondContact O-N 3.42Å; F137-R139 PolarHBondContact O-N 2.92Å; F137-K140 WeakPolarHBondContact O-CB 3.28Å; F137-K140 PolarHBondContact O-N 3.5Å; F137-K140 VanDerWaalsContact O-N 3.1Å; F137-V141 HydrophobicContact CE1-CG2 4.36Å; F137-V141 HydrophobicContact CZ-CG2 4.29Å; F137-V141 PolarHBondContact O-N 2.96Å; F137-L307 HydrophobicContact CD1-CD1 4.09Å; F137-L307 HydrophobicContact CE1-CD1 3.55Å; F137-L307 HydrophobicContact CZ-CD1 4.36Å; F137-L313 VanDerWaalsContact CE2-O 3.24Å; F137-L313 WeakPolarHBondContact CE2-O 2.98Å; F137-L313 WeakPolarHBondContact CZ-O 3.4Å; F137-A314 HydrophobicContact CB-CB 4.33Å; F137-A314 HydrophobicContact CD1-CB 4.17Å; F137-A314 HydrophobicContact CG-CB 4.14Å; F137-E319 HydrophobicContact CE2-CB 4.29Å; F137-E319 HydrophobicContact CZ-CB 4.22Å |
| 138 | I | 86.3 | Confident | 84.7 | Confident | 32 Ų | 32 | 68.7 Ų | 68.7 | 16% | 0.164 | 35% | 0.347 | C | S | . | . | H | α-helix | trans | -57.3 | -48 | 176.1 | -68.7 | 161 | 0 | 0 | 0 | 110.5 | R134 K140 V141 F142 L307 L308 | R134-I138 HydrophobicContact CG-CD1 3.81Å; R134-I138 HydrophobicContact CG-CG1 4.44Å; R134-I138 WeakPolarHBondContact O-CB 3.49Å; R134-I138 WeakPolarHBondContact O-CD1 3.26Å; R134-I138 WeakPolarHBondContact O-CG1 3.46Å; R134-I138 PolarHBondContact O-N 2.99Å; I138-K140 VanDerWaalsContact C-N 3.27Å; I138-K140 PolarHBondContact O-N 3.23Å; I138-V141 PolarHBondContact O-N 3.47Å; I138-F142 HydrophobicContact CG2-CD2 3.71Å; I138-F142 HydrophobicContact CG2-CE2 3.91Å; I138-F142 WeakPolarHBondContact O-CD2 3.46Å; I138-F142 PolarHBondContact O-N 3.02Å; I138-L307 HydrophobicContact CG1-CG 4.41Å; I138-L308 HydrophobicContact CD1-CD2 3.87Å; I138-L308 HydrophobicContact CG1-CD2 4.4Å; I138-L308 HydrophobicContact CG2-CD2 4.38Å |
| 139 | R | 87.4 | Confident | 86.3 | Confident | 187 Ų | 187 | 66.6 Ų | 66.6 | 71% | 0.706 | 34% | 0.336 | S | S | * | . | H | α-helix | trans | -59.4 | -38 | 177.4 | -172.7 | -176 | -62.2 | -175.7 | 2.1 | 111.7 | Q135 A136 F137 S143 | Q135-R139 WeakPolarHBondContact O-CB 3.46Å; Q135-R139 PolarHBondContact O-N 3.24Å; A136-R139 PolarHBondContact O-N 2.9Å; F137-R139 PolarHBondContact O-N 2.92Å; R139-S143 WeakPolarHBondContact O-CB 3.36Å; R139-S143 PolarHBondContact O-N 2.96Å |
| 140 | K | 88.4 | Confident | 87.8 | Confident | 97 Ų | 97 | 66.3 Ų | 66.3 | 42% | 0.422 | 34% | 0.338 | S | S | . | . | H | α-helix | trans | -66.8 | -45.9 | 176.6 | -169.7 | -177.5 | -175.6 | -171.6 | 0 | 111.7 | A136 F137 I138 S143 V144 Y320 | A136-K140 WeakPolarHBondContact O-CB 3.12Å; A136-K140 PolarHBondContact O-N 3.22Å; F137-K140 WeakPolarHBondContact O-CB 3.28Å; F137-K140 PolarHBondContact O-N 3.5Å; F137-K140 VanDerWaalsContact O-N 3.1Å; I138-K140 VanDerWaalsContact C-N 3.27Å; I138-K140 PolarHBondContact O-N 3.23Å; K140-S143 PolarHBondContact O-N 3.49Å; K140-V144 VanDerWaalsContact O-CG2 3.31Å; K140-V144 WeakPolarHBondContact O-CG2 3.25Å; K140-V144 PolarHBondContact O-N 2.97Å; K140-Y320 HydrophobicContact CD-CD1 4.27Å; K140-Y320 HydrophobicContact CD-CD2 4Å; K140-Y320 HydrophobicContact CD-CE1 4.48Å; K140-Y320 HydrophobicContact CD-CE2 4.21Å; K140-Y320 HydrophobicContact CD-CG 4.04Å; K140-Y320 VanDerWaalsContact CE-CZ 3.48Å; K140-Y320 HydrophobicContact CG-CD2 4.1Å; K140-Y320 HydrophobicContact CG-CE2 4.4Å |
| 141 | V | 90.8 | Very high | 89 | Confident | 0 Ų | 0 | 65.2 Ų | 65.2 | 0% | 0 | 33% | 0.334 | C | S | . | . | H | α-helix | trans | -60.8 | -50.3 | 176.7 | 174.3 | 0 | 0 | 0 | 0 | 111.2 | F137 I138 S143 V144 L145 L307 A323 L327 | F137-V141 HydrophobicContact CE1-CG2 4.36Å; F137-V141 HydrophobicContact CZ-CG2 4.29Å; F137-V141 PolarHBondContact O-N 2.96Å; I138-V141 PolarHBondContact O-N 3.47Å; V141-S143 PolarHBondContact O-N 3.12Å; V141-V144 PolarHBondContact O-N 3.21Å; V141-L145 WeakPolarHBondContact O-CB 3.43Å; V141-L145 PolarHBondContact O-N 3.45Å; V141-L307 HydrophobicContact CB-CD1 3.92Å; V141-L307 HydrophobicContact CB-CD2 4.2Å; V141-L307 HydrophobicContact CG1-CD1 3.94Å; V141-L307 HydrophobicContact CG1-CD2 3.78Å; V141-L307 HydrophobicContact CG2-CD1 3.7Å; V141-A323 HydrophobicContact CG1-CB 4.2Å; V141-A323 HydrophobicContact CG2-CB 4.32Å; V141-L327 HydrophobicContact CG1-CD1 4.05Å |
| 142 | F | 91.7 | Very high | 90.1 | Very high | 55 Ų | 55 | 61 Ų | 61 | 24% | 0.241 | 32% | 0.316 | C | S | . | . | H | α-helix | trans | -66.8 | -33.8 | 179 | -82.7 | -74.8 | 0 | 0 | 0 | 113.2 | I138 L145 T146 V245 L307 | I138-F142 HydrophobicContact CG2-CD2 3.71Å; I138-F142 HydrophobicContact CG2-CE2 3.91Å; I138-F142 WeakPolarHBondContact O-CD2 3.46Å; I138-F142 PolarHBondContact O-N 3.02Å; F142-L145 HydrophobicContact CD1-CD2 4.11Å; F142-L145 HydrophobicContact CE1-CD2 4.25Å; F142-T146 WeakPolarHBondContact O-CB 3.42Å; F142-T146 PolarHBondContact O-N 2.66Å; F142-T146 PolarHBondContact O-OG1 3.05Å; F142-V245 HydrophobicContact CE1-CG1 4.07Å; F142-V245 HydrophobicContact CZ-CG1 3.98Å; F142-L307 HydrophobicContact CD2-CD2 4.1Å; F142-L307 HydrophobicContact CE2-CD2 3.54Å; F142-L307 HydrophobicContact CZ-CD2 4.12Å |
| 143 | S | 92.2 | Very high | 90.8 | Very high | 71 Ų | 71 | 59.1 Ų | 59.1 | 50% | 0.497 | 31% | 0.31 | S | S | . | . | H | α-helix | trans | -63.8 | -45.5 | 173.3 | -177.9 | 0 | 0 | 0 | 0 | 112 | R139 K140 V141 T146 V147 | R139-S143 WeakPolarHBondContact O-CB 3.36Å; R139-S143 PolarHBondContact O-N 2.96Å; K140-S143 PolarHBondContact O-N 3.49Å; V141-S143 PolarHBondContact O-N 3.12Å; S143-T146 PolarHBondContact O-N 2.67Å; S143-V147 WeakPolarHBondContact O-CG2 3.49Å; S143-V147 PolarHBondContact O-N 3.25Å; S143-V147 VanDerWaalsContact O-N 3.13Å |
| 144 | V | 92.5 | Very high | 91.7 | Very high | 28 Ų | 28 | 58.1 Ų | 58.1 | 17% | 0.17 | 31% | 0.312 | C | S | . | . | H | α-helix | trans | -61.1 | -50.9 | 174 | 169.9 | 0 | 0 | 0 | 0 | 110.6 | K140 V141 T146 V147 Q148 L207 Y320 S324 | K140-V144 VanDerWaalsContact O-CG2 3.31Å; K140-V144 WeakPolarHBondContact O-CG2 3.25Å; K140-V144 PolarHBondContact O-N 2.97Å; V141-V144 PolarHBondContact O-N 3.21Å; V144-T146 VanDerWaalsContact C-N 3.28Å; V144-T146 PolarHBondContact O-N 2.89Å; V144-V147 WeakPolarHBondContact O-CB 3.45Å; V144-V147 PolarHBondContact O-N 3.31Å; V144-Q148 HydrophobicContact CG1-CG 4.42Å; V144-Q148 WeakPolarHBondContact O-CG 3.35Å; V144-Q148 PolarHBondContact O-N 3.39Å; V144-L207 HydrophobicContact CG1-CD2 3.62Å; V144-Y320 HydrophobicContact CG2-CD2 4.4Å; V144-Y320 HydrophobicContact CG2-CE2 4.19Å; V144-S324 WeakPolarHBondContact CG1-OG 3.25Å |
| 145 | L | 94.8 | Very high | 92.5 | Very high | 8 Ų | 8 | 57.7 Ų | 57.7 | 4% | 0.042 | 31% | 0.311 | C | S | . | . | H | α-helix | trans | -55.5 | -41.9 | 177.9 | 178.9 | 60.9 | 0 | 0 | 0 | 112.2 | V141 F142 V147 Q148 L149 L327 I331 | V141-L145 WeakPolarHBondContact O-CB 3.43Å; V141-L145 PolarHBondContact O-N 3.45Å; F142-L145 HydrophobicContact CD1-CD2 4.11Å; F142-L145 HydrophobicContact CE1-CD2 4.25Å; L145-V147 PolarHBondContact O-N 2.95Å; L145-Q148 PolarHBondContact O-N 3.4Å; L145-L149 HydrophobicContact CD1-CD1 4.08Å; L145-L149 HydrophobicContact CD1-CG 4.19Å; L145-L149 HydrophobicContact CG-CD1 4.02Å; L145-L149 WeakPolarHBondContact O-CG 3.31Å; L145-L149 PolarHBondContact O-N 2.91Å; L145-L327 HydrophobicContact CD1-CB 4.19Å; L145-L327 HydrophobicContact CD2-CB 3.83Å; L145-L327 HydrophobicContact CD2-CD1 4.25Å; L145-I331 HydrophobicContact CD1-CD1 4.37Å; L145-I331 HydrophobicContact CD2-CD1 4.18Å |
| 146 | T | 94.9 | Very high | 93.3 | Very high | 75 Ų | 75 | 52.5 Ų | 52.5 | 46% | 0.46 | 29% | 0.288 | S | S | . | . | H | α-helix | trans | -62.1 | -43.4 | 176.9 | -59 | 0 | 0 | 0 | 0 | 111.2 | F142 S143 V144 Q148 L149 L150 | F142-T146 WeakPolarHBondContact O-CB 3.42Å; F142-T146 PolarHBondContact O-N 2.66Å; F142-T146 PolarHBondContact O-OG1 3.05Å; S143-T146 PolarHBondContact O-N 2.67Å; V144-T146 VanDerWaalsContact C-N 3.28Å; V144-T146 PolarHBondContact O-N 2.89Å; T146-Q148 PolarHBondContact O-N 3.23Å; T146-L149 PolarHBondContact O-N 3.49Å; T146-L150 HydrophobicContact CG2-CD1 4.02Å; T146-L150 HydrophobicContact CG2-CG 4.44Å; T146-L150 WeakPolarHBondContact O-CB 3.41Å; T146-L150 VanDerWaalsContact O-CG 3.25Å; T146-L150 WeakPolarHBondContact O-CG 3.47Å; T146-L150 PolarHBondContact O-N 3.39Å |
| 147 | V | 95.9 | Very high | 93.9 | Very high | 85 Ų | 85 | 51.8 Ų | 51.8 | 52% | 0.515 | 28% | 0.279 | S | S | . | . | H | α-helix | trans | -62.9 | -41.4 | 174.6 | 173.7 | 0 | 0 | 0 | 0 | 111.3 | S143 V144 L145 L150 V151 | S143-V147 WeakPolarHBondContact O-CG2 3.49Å; S143-V147 PolarHBondContact O-N 3.25Å; S143-V147 VanDerWaalsContact O-N 3.13Å; V144-V147 WeakPolarHBondContact O-CB 3.45Å; V144-V147 PolarHBondContact O-N 3.31Å; L145-V147 PolarHBondContact O-N 2.95Å; V147-L150 PolarHBondContact O-N 3.44Å; V147-V151 WeakPolarHBondContact O-CG2 3.43Å; V147-V151 PolarHBondContact O-N 3.5Å |
| 148 | Q | 96.6 | Very high | 94.5 | Very high | 5 Ų | 5 | 54.8 Ų | 54.8 | 2% | 0.023 | 30% | 0.295 | C | S | . | . | H | α-helix | trans | -63.5 | -43.9 | 178 | -62.7 | -179.8 | -83.6 | 0 | 0 | 112.7 | V144 L145 T146 V151 T152 T211 S324 Y328 | V144-Q148 HydrophobicContact CG1-CG 4.42Å; V144-Q148 WeakPolarHBondContact O-CG 3.35Å; V144-Q148 PolarHBondContact O-N 3.39Å; L145-Q148 PolarHBondContact O-N 3.4Å; T146-Q148 PolarHBondContact O-N 3.23Å; Q148-V151 PolarHBondContact O-N 2.95Å; Q148-T152 PolarHBondContact O-N 3.35Å; Q148-T152 PolarHBondContact O-OG1 3.41Å; Q148-T211 HydrophobicContact CB-CG2 3.78Å; Q148-T211 HydrophobicContact CG-CG2 3.83Å; Q148-T211 WeakPolarHBondContact CG-OG1 3.28Å; Q148-T211 PolarHBondContact NE2-OG1 2.91Å; Q148-S324 PolarHBondContact OE1-O 3.47Å; Q148-Y328 HydrophobicContact CB-CD2 3.6Å; Q148-Y328 HydrophobicContact CB-CE2 3.8Å; Q148-Y328 HydrophobicContact CB-CG 4.13Å |
| 149 | L | 96.7 | Very high | 94.9 | Very high | 50 Ų | 50 | 54.1 Ų | 54.1 | 26% | 0.262 | 29% | 0.291 | S | S | . | . | H | α-helix | trans | -68.9 | -36.1 | 177.4 | -66.4 | 173 | 0 | 0 | 0 | 112.1 | L145 T146 T152 C153 Y328 I331 I332 | L145-L149 HydrophobicContact CD1-CD1 4.08Å; L145-L149 HydrophobicContact CD1-CG 4.19Å; L145-L149 HydrophobicContact CG-CD1 4.02Å; L145-L149 WeakPolarHBondContact O-CG 3.31Å; L145-L149 PolarHBondContact O-N 2.91Å; T146-L149 PolarHBondContact O-N 3.49Å; L149-T152 PolarHBondContact O-N 3.41Å; L149-C153 VanDerWaalsContact O-CB 3.24Å; L149-C153 WeakPolarHBondContact O-CB 3.25Å; L149-C153 PolarHBondContact O-N 2.99Å; L149-Y328 HydrophobicContact CD2-CD2 3.96Å; L149-Y328 HydrophobicContact CD2-CE2 4.29Å; L149-Y328 HydrophobicContact CG-CD2 4.44Å; L149-I331 HydrophobicContact CD1-CD1 3.94Å; L149-I331 HydrophobicContact CD1-CG2 4.28Å; L149-I331 HydrophobicContact CD2-CB 4.21Å; L149-I331 HydrophobicContact CD2-CG2 3.61Å; L149-I332 HydrophobicContact CD2-CD1 4.41Å |
| 150 | L | 97.5 | Very high | 95.3 | Very high | 114 Ų | 114 | 45.3 Ų | 45.3 | 60% | 0.597 | 26% | 0.258 | S | S | * | . | H | α-helix | trans | -63.7 | -43.1 | 172.6 | -76.4 | 170.3 | 0 | 0 | 0 | 112 | T146 V147 C153 A154 | T146-L150 HydrophobicContact CG2-CD1 4.02Å; T146-L150 HydrophobicContact CG2-CG 4.44Å; T146-L150 WeakPolarHBondContact O-CB 3.41Å; T146-L150 VanDerWaalsContact O-CG 3.25Å; T146-L150 WeakPolarHBondContact O-CG 3.47Å; T146-L150 PolarHBondContact O-N 3.39Å; V147-L150 PolarHBondContact O-N 3.44Å; L150-C153 PolarHBondContact O-N 2.89Å; L150-A154 PolarHBondContact O-N 3.48Å |
| 151 | V | 97.8 | Very high | 95.6 | Very high | 43 Ų | 43 | 46.6 Ų | 46.6 | 26% | 0.261 | 26% | 0.264 | S | S | . | . | H | α-helix | trans | -61.7 | -44.4 | 174.1 | 172.7 | 0 | 0 | 0 | 0 | 110.5 | V147 Q148 C153 A154 F155 T211 L212 | V147-V151 WeakPolarHBondContact O-CG2 3.43Å; V147-V151 PolarHBondContact O-N 3.5Å; Q148-V151 PolarHBondContact O-N 2.95Å; V151-C153 PolarHBondContact O-N 3.38Å; V151-A154 WeakPolarHBondContact O-CB 3.24Å; V151-A154 PolarHBondContact O-N 3.39Å; V151-F155 HydrophobicContact CG1-CD2 3.99Å; V151-F155 HydrophobicContact CG1-CE2 4.03Å; V151-F155 WeakPolarHBondContact O-CD2 3.41Å; V151-F155 PolarHBondContact O-N 2.83Å; V151-T211 HydrophobicContact CB-CG2 4.23Å; V151-T211 HydrophobicContact CG1-CG2 4.23Å; V151-L212 HydrophobicContact CG1-CD2 3.88Å |
| 152 | T | 97.7 | Very high | 95.8 | Very high | 6 Ų | 6 | 49.8 Ų | 49.8 | 4% | 0.037 | 28% | 0.284 | C | S | . | . | H | α-helix | trans | -65.4 | -41.8 | 178.4 | -48.3 | 0 | 0 | 0 | 0 | 112 | Q148 L149 A154 F155 V156 S215 V218 Y328 I332 | Q148-T152 PolarHBondContact O-N 3.35Å; Q148-T152 PolarHBondContact O-OG1 3.41Å; L149-T152 PolarHBondContact O-N 3.41Å; T152-A154 VanDerWaalsContact C-N 3.29Å; T152-A154 PolarHBondContact O-N 3.29Å; T152-F155 PolarHBondContact O-N 3.4Å; T152-V156 HydrophobicContact CG2-CG2 4.25Å; T152-V156 WeakPolarHBondContact O-CB 3.33Å; T152-V156 WeakPolarHBondContact O-CG2 3.37Å; T152-V156 PolarHBondContact O-N 2.93Å; T152-S215 WeakPolarHBondContact CA-OG 3.36Å; T152-S215 PolarHBondContact N-OG 2.99Å; T152-S215 PolarHBondContact OG1-OG 3.01Å; T152-V218 HydrophobicContact CG2-CB 3.98Å; T152-V218 HydrophobicContact CG2-CG1 3.8Å; T152-V218 HydrophobicContact CG2-CG2 4.47Å; T152-Y328 VanDerWaalsContact OG1-CE2 3.28Å; T152-Y328 WeakPolarHBondContact OG1-CE2 3.37Å; T152-Y328 PolarHBondContact OG1-OH 2.86Å; T152-I332 HydrophobicContact CG2-CD1 3.58Å |
| 153 | C | 97.1 | Very high | 95.9 | Very high | 62 Ų | 62 | 52.4 Ų | 52.4 | 42% | 0.419 | 30% | 0.3 | S | S | . | . | H | α-helix | trans | -59.2 | -39.4 | 174.8 | -172.7 | 0 | 0 | 0 | 0 | 111.7 | L149 L150 V151 S157 | L149-C153 VanDerWaalsContact O-CB 3.24Å; L149-C153 WeakPolarHBondContact O-CB 3.25Å; L149-C153 PolarHBondContact O-N 2.99Å; L150-C153 PolarHBondContact O-N 2.89Å; V151-C153 PolarHBondContact O-N 3.38Å; C153-S157 WeakPolarHBondContact O-CB 3.38Å; C153-S157 PolarHBondContact O-N 3.32Å; C153-S157 PolarHBondContact O-OG 2.85Å |
| 154 | A | 97.7 | Very high | 96.1 | Very high | 46 Ų | 46 | 55.4 Ų | 55.4 | 38% | 0.38 | 31% | 0.31 | S | S | . | . | H | α-helix | trans | -64.7 | -47.4 | 174.8 | 0 | 0 | 0 | 0 | 0 | 112.2 | L150 V151 T152 S157 I158 | L150-A154 PolarHBondContact O-N 3.48Å; V151-A154 WeakPolarHBondContact O-CB 3.24Å; V151-A154 PolarHBondContact O-N 3.39Å; T152-A154 VanDerWaalsContact C-N 3.29Å; T152-A154 PolarHBondContact O-N 3.29Å; A154-S157 PolarHBondContact O-N 2.88Å; A154-I158 WeakPolarHBondContact O-CD1 3.42Å; A154-I158 VanDerWaalsContact O-CG1 3.24Å; A154-I158 WeakPolarHBondContact O-CG1 3.5Å; A154-I158 PolarHBondContact O-N 3.12Å |
| 155 | F | 97.6 | Very high | 96.1 | Very high | 52 Ų | 52 | 55 Ų | 55 | 23% | 0.228 | 31% | 0.311 | C | S | . | . | H | α-helix | trans | -61.5 | -46.2 | 176.5 | -89.2 | -87.4 | 0 | 0 | 0 | 112.5 | V151 T152 S157 I158 F159 L212 S215 Y216 | V151-F155 HydrophobicContact CG1-CD2 3.99Å; V151-F155 HydrophobicContact CG1-CE2 4.03Å; V151-F155 WeakPolarHBondContact O-CD2 3.41Å; V151-F155 PolarHBondContact O-N 2.83Å; T152-F155 PolarHBondContact O-N 3.4Å; F155-S157 PolarHBondContact O-N 3.26Å; F155-I158 PolarHBondContact O-N 3.44Å; F155-F159 HydrophobicContact CD1-CE2 4.11Å; F155-F159 AromaticContact CD1-CZ 3.86Å; F155-F159 HydrophobicContact CD1-CZ 3.86Å; F155-F159 HydrophobicContact CE1-CZ 4.29Å; F155-F159 PolarHBondContact O-N 2.66Å; F155-F159 VanDerWaalsContact O-N 3.08Å; F155-L212 HydrophobicContact CE2-CD2 3.7Å; F155-L212 HydrophobicContact CZ-CD2 4.13Å; F155-S215 WeakPolarHBondContact CB-O 3.35Å; F155-Y216 HydrophobicContact CD1-CD2 4.29Å; F155-Y216 AromaticContact CE1-CD2 3.99Å; F155-Y216 HydrophobicContact CE1-CD2 3.99Å |
| 156 | V | 97.5 | Very high | 96 | Very high | 8 Ų | 8 | 56.1 Ų | 56.1 | 5% | 0.048 | 32% | 0.315 | C | S | . | . | H | α-helix | trans | -59.3 | -46.6 | 174.9 | 170.5 | 0 | 0 | 0 | 0 | 110.6 | T152 F159 T160 V218 A222 V230 F335 | T152-V156 HydrophobicContact CG2-CG2 4.25Å; T152-V156 WeakPolarHBondContact O-CB 3.33Å; T152-V156 WeakPolarHBondContact O-CG2 3.37Å; T152-V156 PolarHBondContact O-N 2.93Å; V156-F159 PolarHBondContact O-N 3.33Å; V156-T160 WeakPolarHBondContact O-CB 3.45Å; V156-T160 PolarHBondContact O-N 2.64Å; V156-T160 PolarHBondContact O-OG1 3.32Å; V156-V218 HydrophobicContact CG2-CG1 3.82Å; V156-A222 HydrophobicContact CG1-CB 4.01Å; V156-A222 HydrophobicContact CG2-CB 4.39Å; V156-V230 HydrophobicContact CG1-CG1 3.68Å; V156-F335 HydrophobicContact CG1-CZ 4.43Å; V156-F335 HydrophobicContact CG2-CE1 4.38Å |
| 157 | S | 96.3 | Very high | 96 | Very high | 43 Ų | 43 | 57.7 Ų | 57.7 | 30% | 0.301 | 32% | 0.32 | S | S | . | . | H | α-helix | trans | -60.5 | -48.5 | 178.9 | -62.2 | 0 | 0 | 0 | 0 | 111.8 | C153 A154 F155 F159 T160 F161 | C153-S157 WeakPolarHBondContact O-CB 3.38Å; C153-S157 PolarHBondContact O-N 3.32Å; C153-S157 PolarHBondContact O-OG 2.85Å; A154-S157 PolarHBondContact O-N 2.88Å; F155-S157 PolarHBondContact O-N 3.26Å; S157-F159 PolarHBondContact O-N 3.38Å; S157-T160 PolarHBondContact O-N 2.89Å; S157-F161 WeakPolarHBondContact O-CB 3.38Å; S157-F161 VanDerWaalsContact O-CD2 3.26Å; S157-F161 WeakPolarHBondContact O-CD2 3.31Å; S157-F161 PolarHBondContact O-N 2.98Å |
| 158 | I | 96.9 | Very high | 95.9 | Very high | 83 Ų | 83 | 58.9 Ų | 58.9 | 43% | 0.426 | 32% | 0.318 | S | S | . | . | H | α-helix | trans | -60.6 | -47.2 | -179.6 | -64.7 | 162.5 | 0 | 0 | 0 | 110.5 | A154 F155 T160 V162 A165 | A154-I158 WeakPolarHBondContact O-CD1 3.42Å; A154-I158 VanDerWaalsContact O-CG1 3.24Å; A154-I158 WeakPolarHBondContact O-CG1 3.5Å; A154-I158 PolarHBondContact O-N 3.12Å; F155-I158 PolarHBondContact O-N 3.44Å; I158-T160 PolarHBondContact O-N 3.36Å; I158-V162 HydrophobicContact CG2-CG2 4.32Å; I158-V162 VanDerWaalsContact O-CB 3.29Å; I158-V162 WeakPolarHBondContact O-CB 3.18Å; I158-V162 PolarHBondContact O-N 3.04Å; I158-A165 HydrophobicContact CG2-CB 4.1Å |
| 159 | F | 95.8 | Very high | 95.8 | Very high | 18 Ų | 18 | 58.7 Ų | 58.7 | 8% | 0.079 | 32% | 0.318 | C | S | . | . | H | α-helix | trans | -78.5 | -4 | -178.6 | -58 | -9.7 | 0 | 0 | 0 | 113.9 | F155 V156 S157 A165 K166 V169 Y216 | F155-F159 HydrophobicContact CD1-CE2 4.11Å; F155-F159 AromaticContact CD1-CZ 3.86Å; F155-F159 HydrophobicContact CD1-CZ 3.86Å; F155-F159 HydrophobicContact CE1-CZ 4.29Å; F155-F159 PolarHBondContact O-N 2.66Å; F155-F159 VanDerWaalsContact O-N 3.08Å; V156-F159 PolarHBondContact O-N 3.33Å; S157-F159 PolarHBondContact O-N 3.38Å; F159-A165 HydrophobicContact CD1-CB 3.95Å; F159-A165 HydrophobicContact CE1-CB 4.44Å; F159-K166 WeakPolarHBondContact O-CB 3.33Å; F159-V169 HydrophobicContact CD1-CG1 4.36Å; F159-V169 HydrophobicContact CD2-CG1 4.09Å; F159-V169 HydrophobicContact CD2-CG2 4.22Å; F159-V169 HydrophobicContact CE1-CG1 4.15Å; F159-V169 HydrophobicContact CE2-CG1 3.87Å; F159-V169 HydrophobicContact CG-CG1 4.37Å; F159-V169 HydrophobicContact CG-CG2 4.35Å; F159-V169 HydrophobicContact CZ-CG1 3.92Å; F159-Y216 AromaticContact CE2-CD2 3.77Å; F159-Y216 HydrophobicContact CE2-CD2 3.77Å; F159-Y216 AromaticContact CE2-CE2 3.72Å; F159-Y216 HydrophobicContact CE2-CE2 3.72Å; F159-Y216 HydrophobicContact CE2-CG 4.34Å; F159-Y216 AromaticContact CZ-CD2 3.76Å; F159-Y216 HydrophobicContact CZ-CD2 3.76Å; F159-Y216 AromaticContact CZ-CE2 3.55Å; F159-Y216 HydrophobicContact CZ-CE2 3.55Å |
| 160 | T | 94.4 | Very high | 95.7 | Very high | 3 Ų | 3 | 59.2 Ų | 59.2 | 2% | 0.018 | 32% | 0.318 | C | S | . | . | H | α-helix | trans | -104.6 | -31.8 | 177.1 | -58.4 | 0 | 0 | 0 | 0 | 113 | V156 S157 I158 T227 V230 | V156-T160 WeakPolarHBondContact O-CB 3.45Å; V156-T160 PolarHBondContact O-N 2.64Å; V156-T160 PolarHBondContact O-OG1 3.32Å; S157-T160 PolarHBondContact O-N 2.89Å; I158-T160 PolarHBondContact O-N 3.36Å; T160-T227 HydrophobicContact CG2-CG2 3.67Å; T160-T227 PolarHBondContact O-OG1 2.82Å; T160-T227 VanDerWaalsContact O-OG1 3.1Å; T160-V230 HydrophobicContact CG2-CB 4.02Å; T160-V230 HydrophobicContact CG2-CG1 4.09Å; T160-V230 HydrophobicContact CG2-CG2 4.15Å |
| 161 | F | 94.7 | Very high | 95.6 | Very high | 123 Ų | 123 | 64.2 Ų | 64.2 | 54% | 0.539 | 33% | 0.329 | S | S | . | . | H | α-helix | trans | -109.4 | -15.1 | -176.4 | -63.8 | -66.2 | 0 | 0 | 0 | 114.8 | S157 T227 I231 | S157-F161 WeakPolarHBondContact O-CB 3.38Å; S157-F161 VanDerWaalsContact O-CD2 3.26Å; S157-F161 WeakPolarHBondContact O-CD2 3.31Å; S157-F161 PolarHBondContact O-N 2.98Å; F161-T227 HydrophobicContact CD1-CG2 3.87Å; F161-T227 HydrophobicContact CE1-CG2 3.46Å; F161-T227 VanDerWaalsContact CE1-CG2 3.46Å; F161-T227 HydrophobicContact CZ-CG2 4.2Å; F161-I231 HydrophobicContact CE1-CD1 4.15Å; F161-I231 HydrophobicContact CZ-CD1 3.97Å; F161-I231 HydrophobicContact CZ-CG1 4.24Å |
| 162 | V | 96.3 | Very high | 95.4 | Very high | 68 Ų | 68 | 64 Ų | 64 | 41% | 0.412 | 33% | 0.327 | S | S | . | . | trans | -107 | 104 | 176.7 | -173.7 | 0 | 0 | 0 | 0 | 109.3 | I158 D164 A165 K166 | I158-V162 HydrophobicContact CG2-CG2 4.32Å; I158-V162 VanDerWaalsContact O-CB 3.29Å; I158-V162 WeakPolarHBondContact O-CB 3.18Å; I158-V162 PolarHBondContact O-N 3.04Å; V162-D164 VanDerWaalsContact C-N 3.32Å; V162-D164 HydrophobicContact CG1-CB 4.5Å; V162-D164 PolarHBondContact O-N 3.26Å; V162-A165 HydrophobicContact CB-CB 4.03Å; V162-A165 HydrophobicContact CG1-CB 4.11Å; V162-A165 WeakPolarHBondContact O-CB 3.34Å; V162-A165 PolarHBondContact O-N 2.89Å; V162-K166 PolarHBondContact O-N 2.97Å | ||
| 163 | D | 93.7 | Very high | 95.1 | Very high | 110 Ų | 110 | 71 Ų | 71 | 59% | 0.588 | 35% | 0.353 | S | S | * | . | H | α-helix | trans | -59.5 | -38.5 | -174.7 | -70 | -51.9 | 0 | 0 | 0 | 113.2 | A165 K166 L167 | D163-A165 VanDerWaalsContact C-N 3.32Å; D163-A165 PolarHBondContact O-N 3.47Å; D163-K166 WeakPolarHBondContact O-CB 3.35Å; D163-K166 PolarHBondContact O-N 2.95Å; D163-L167 WeakPolarHBondContact O-CB 3.39Å; D163-L167 VanDerWaalsContact O-CG 3.26Å; D163-L167 WeakPolarHBondContact O-CG 3.17Å; D163-L167 PolarHBondContact O-N 2.87Å |
| 164 | D | 94.8 | Very high | 95 | Very high | 133 Ų | 133 | 75.7 Ų | 75.7 | 71% | 0.711 | 36% | 0.362 | S | S | * | . | H | α-helix | trans | -60.2 | -40.9 | 175 | -69.6 | -46.8 | 0 | 0 | 0 | 112.4 | V162 F168 | V162-D164 VanDerWaalsContact C-N 3.32Å; V162-D164 HydrophobicContact CG1-CB 4.5Å; V162-D164 PolarHBondContact O-N 3.26Å; D164-F168 WeakPolarHBondContact O-CB 3.25Å; D164-F168 PolarHBondContact O-N 3.43Å |
| 165 | A | 93.3 | Very high | 94.8 | Very high | 21 Ų | 21 | 74.1 Ų | 74.1 | 17% | 0.174 | 35% | 0.348 | C | S | . | . | H | α-helix | trans | -70.5 | -42.6 | 177.8 | 0 | 0 | 0 | 0 | 0 | 111 | I158 F159 V162 D163 F168 V169 | I158-A165 HydrophobicContact CG2-CB 4.1Å; F159-A165 HydrophobicContact CD1-CB 3.95Å; F159-A165 HydrophobicContact CE1-CB 4.44Å; V162-A165 HydrophobicContact CB-CB 4.03Å; V162-A165 HydrophobicContact CG1-CB 4.11Å; V162-A165 WeakPolarHBondContact O-CB 3.34Å; V162-A165 PolarHBondContact O-N 2.89Å; D163-A165 VanDerWaalsContact C-N 3.32Å; D163-A165 PolarHBondContact O-N 3.47Å; A165-F168 PolarHBondContact O-N 2.74Å; A165-V169 WeakPolarHBondContact O-CG1 3.27Å; A165-V169 WeakPolarHBondContact O-CG2 3.32Å; A165-V169 PolarHBondContact O-N 3.28Å |
| 166 | K | 93.5 | Very high | 94.6 | Very high | 30 Ų | 30 | 74.2 Ų | 74.2 | 13% | 0.13 | 35% | 0.347 | C | S | . | . | H | α-helix | trans | -56.6 | -52.2 | 174.9 | -170.1 | 173.4 | -168 | 171.6 | 0 | 111.3 | F159 V162 D163 F168 V169 Q170 S223 Y225 | F159-K166 WeakPolarHBondContact O-CB 3.33Å; V162-K166 PolarHBondContact O-N 2.97Å; D163-K166 WeakPolarHBondContact O-CB 3.35Å; D163-K166 PolarHBondContact O-N 2.95Å; K166-F168 PolarHBondContact O-N 3.46Å; K166-V169 WeakPolarHBondContact O-CG2 3.27Å; K166-V169 PolarHBondContact O-N 3.47Å; K166-Q170 WeakPolarHBondContact O-CB 3.31Å; K166-Q170 VanDerWaalsContact O-CG 3.28Å; K166-Q170 WeakPolarHBondContact O-CG 3.21Å; K166-Q170 PolarHBondContact O-N 2.99Å; K166-S223 WeakPolarHBondContact CE-O 3.4Å; K166-Y225 PolarHBondContact NZ-O 3.42Å |
| 167 | L | 94 | Very high | 94.5 | Very high | 108 Ų | 108 | 81 Ų | 81 | 57% | 0.565 | 37% | 0.373 | S | S | * | . | H | α-helix | trans | -63.9 | -39.6 | 177.1 | -69.6 | 170.2 | 0 | 0 | 0 | 112 | D163 R171 | D163-L167 WeakPolarHBondContact O-CB 3.39Å; D163-L167 VanDerWaalsContact O-CG 3.26Å; D163-L167 WeakPolarHBondContact O-CG 3.17Å; D163-L167 PolarHBondContact O-N 2.87Å; L167-R171 WeakPolarHBondContact O-CB 3.44Å; L167-R171 PolarHBondContact O-N 3.37Å |
| 168 | F | 94.4 | Very high | 94.4 | Very high | 111 Ų | 111 | 82.5 Ų | 82.5 | 49% | 0.487 | 38% | 0.379 | S | S | . | . | H | α-helix | trans | -60.4 | -49.2 | 176.7 | 175.8 | -92.3 | 0 | 0 | 0 | 112 | D164 A165 K166 R171 N172 | D164-F168 WeakPolarHBondContact O-CB 3.25Å; D164-F168 PolarHBondContact O-N 3.43Å; A165-F168 PolarHBondContact O-N 2.74Å; K166-F168 PolarHBondContact O-N 3.46Å; F168-R171 PolarHBondContact O-N 2.9Å; F168-N172 WeakPolarHBondContact CD2-ND2 3.3Å; F168-N172 WeakPolarHBondContact CE2-ND2 3.48Å; F168-N172 VanDerWaalsContact O-CB 3.3Å; F168-N172 WeakPolarHBondContact O-CB 3.35Å; F168-N172 PolarHBondContact O-N 3.44Å; F168-N172 PolarHBondContact O-ND2 2.65Å |
| 169 | V | 94.2 | Very high | 94.3 | Very high | 1 Ų | 1 | 79.4 Ų | 79.4 | 1% | 0.006 | 37% | 0.365 | C | S | . | . | H | α-helix | trans | -73.1 | -39.1 | -176.7 | -57.4 | 0 | 0 | 0 | 0 | 112.5 | F159 A165 K166 R171 N172 Y216 M220 | F159-V169 HydrophobicContact CD1-CG1 4.36Å; F159-V169 HydrophobicContact CD2-CG1 4.09Å; F159-V169 HydrophobicContact CD2-CG2 4.22Å; F159-V169 HydrophobicContact CE1-CG1 4.15Å; F159-V169 HydrophobicContact CE2-CG1 3.87Å; F159-V169 HydrophobicContact CG-CG1 4.37Å; F159-V169 HydrophobicContact CG-CG2 4.35Å; F159-V169 HydrophobicContact CZ-CG1 3.92Å; A165-V169 WeakPolarHBondContact O-CG1 3.27Å; A165-V169 WeakPolarHBondContact O-CG2 3.32Å; A165-V169 PolarHBondContact O-N 3.28Å; K166-V169 WeakPolarHBondContact O-CG2 3.27Å; K166-V169 PolarHBondContact O-N 3.47Å; V169-R171 VanDerWaalsContact C-N 3.31Å; V169-R171 PolarHBondContact O-N 2.69Å; V169-N172 CarbonylContact O-C 3.54Å; V169-N172 PolarHBondContact O-N 3.26Å; V169-Y216 HydrophobicContact CG1-CE2 4.44Å; V169-Y216 WeakPolarHBondContact CG1-OH 3.48Å; V169-M220 HydrophobicContact CB-CG 4.17Å; V169-M220 HydrophobicContact CG2-CG 4.37Å |
| 170 | Q | 93.6 | Very high | 94.2 | Very high | 60 Ų | 60 | 83.5 Ų | 83.5 | 28% | 0.28 | 38% | 0.381 | S | S | . | . | H | α-helix | trans | -61.6 | -37.6 | 173.9 | -72.2 | -176.3 | 3.6 | 0 | 0 | 112.4 | K166 R173 S223 F224 | K166-Q170 WeakPolarHBondContact O-CB 3.31Å; K166-Q170 VanDerWaalsContact O-CG 3.28Å; K166-Q170 WeakPolarHBondContact O-CG 3.21Å; K166-Q170 PolarHBondContact O-N 2.99Å; Q170-R173 WeakPolarHBondContact O-CG 3.14Å; Q170-S223 PolarHBondContact NE2-O 3.08Å; Q170-F224 HydrophobicContact CB-CE1 4.15Å; Q170-F224 HydrophobicContact CB-CZ 4.34Å; Q170-F224 HydrophobicContact CG-CD1 4.06Å; Q170-F224 HydrophobicContact CG-CE1 3.72Å; Q170-F224 HydrophobicContact CG-CZ 4.09Å |
| 171 | R | 95.4 | Very high | 94.2 | Very high | 219 Ų | 219 | 85.9 Ų | 85.9 | 83% | 0.826 | 40% | 0.401 | S | S | * | . | H | α-helix | trans | -71.9 | -42.5 | 175.8 | -175.3 | 174.2 | 179.7 | 171.3 | -0.2 | 111.8 | L167 F168 V169 R173 | L167-R171 WeakPolarHBondContact O-CB 3.44Å; L167-R171 PolarHBondContact O-N 3.37Å; F168-R171 PolarHBondContact O-N 2.9Å; V169-R171 VanDerWaalsContact C-N 3.31Å; V169-R171 PolarHBondContact O-N 2.69Å; R171-R173 PolarHBondContact O-N 3.5Å |
| 172 | N | 94.6 | Very high | 94.3 | Very high | 39 Ų | 39 | 82.8 Ų | 82.8 | 21% | 0.209 | 39% | 0.392 | C | S | . | . | trans | -94.4 | 50.4 | -173.4 | -70.7 | -78.7 | 0 | 0 | 0 | 113.4 | F168 V169 W174 T175 | F168-N172 WeakPolarHBondContact CD2-ND2 3.3Å; F168-N172 WeakPolarHBondContact CE2-ND2 3.48Å; F168-N172 VanDerWaalsContact O-CB 3.3Å; F168-N172 WeakPolarHBondContact O-CB 3.35Å; F168-N172 PolarHBondContact O-N 3.44Å; F168-N172 PolarHBondContact O-ND2 2.65Å; V169-N172 CarbonylContact O-C 3.54Å; V169-N172 PolarHBondContact O-N 3.26Å; N172-W174 PolarHBondContact O-N 2.89Å; N172-W174 PolarHBondContact OD1-NE1 3.43Å; N172-W174 VanDerWaalsContact OD1-NE1 3.14Å; N172-T175 HydrophobicContact CB-CG2 4.06Å; N172-T175 WeakPolarHBondContact O-CB 3.42Å; N172-T175 WeakPolarHBondContact O-CG2 3.32Å; N172-T175 PolarHBondContact O-N 2.99Å; N172-T175 PolarHBondContact O-OG1 2.97Å | ||
| 173 | R | 92.1 | Very high | 94.1 | Very high | 153 Ų | 153 | 80.2 Ų | 80.2 | 58% | 0.577 | 38% | 0.375 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -52.5 | -19 | -178.3 | -71.4 | -176.2 | -74.5 | 132.7 | -4.5 | 115.7 | Q170 R171 T175 Y176 Y177 | Q170-R173 WeakPolarHBondContact O-CG 3.14Å; R171-R173 PolarHBondContact O-N 3.5Å; R173-T175 PolarHBondContact O-N 3.16Å; R173-Y176 PolarHBondContact O-N 2.86Å; R173-Y177 VanDerWaalsContact O-CD2 3.24Å; R173-Y177 WeakPolarHBondContact O-CD2 3.3Å |
| 174 | W | 94.1 | Very high | 94 | Very high | 160 Ų | 160 | 79.1 Ų | 79.1 | 61% | 0.606 | 37% | 0.365 | S | S | * | . | H | α-helix | trans | -59.1 | -33.2 | 171.9 | 69.4 | -93.1 | 0 | 0 | 0 | 112.9 | N172 Y176 Y177 V178 | N172-W174 PolarHBondContact O-N 2.89Å; N172-W174 PolarHBondContact OD1-NE1 3.43Å; N172-W174 VanDerWaalsContact OD1-NE1 3.14Å; W174-Y176 VanDerWaalsContact C-N 3.34Å; W174-Y176 PolarHBondContact O-N 3.14Å; W174-Y177 PolarHBondContact O-N 3.4Å; W174-V178 HydrophobicContact CE3-CG2 3.82Å; W174-V178 HydrophobicContact CZ3-CG2 4.05Å; W174-V178 PolarHBondContact O-N 2.83Å; W174-V178 VanDerWaalsContact O-N 3.08Å |
| 175 | T | 93.1 | Very high | 93.8 | Very high | 14 Ų | 14 | 77 Ų | 77 | 9% | 0.086 | 36% | 0.357 | C | S | . | . | H | α-helix | trans | -60.6 | -39.8 | 178.9 | 55.8 | 0 | 0 | 0 | 0 | 112.5 | N172 R173 Y177 V178 S179 Y216 | N172-T175 HydrophobicContact CB-CG2 4.06Å; N172-T175 WeakPolarHBondContact O-CB 3.42Å; N172-T175 WeakPolarHBondContact O-CG2 3.32Å; N172-T175 PolarHBondContact O-N 2.99Å; N172-T175 PolarHBondContact O-OG1 2.97Å; R173-T175 PolarHBondContact O-N 3.16Å; T175-Y177 PolarHBondContact O-N 2.63Å; T175-V178 PolarHBondContact O-N 2.91Å; T175-S179 PolarHBondContact O-N 3.36Å; T175-S179 PolarHBondContact O-OG 3.29Å; T175-Y216 VanDerWaalsContact CB-OH 3.3Å; T175-Y216 WeakPolarHBondContact CB-OH 3.34Å; T175-Y216 PolarHBondContact OG1-OH 3.49Å |
| 176 | Y | 94 | Very high | 93.6 | Very high | 53 Ų | 53 | 76.9 Ų | 76.9 | 21% | 0.208 | 36% | 0.355 | C | S | . | . | H | α-helix | trans | -58.6 | -46.1 | 175.6 | 174.5 | -100 | 0 | 0 | 0 | 112 | R173 W174 V178 S179 Y180 M217 M220 I221 | R173-Y176 PolarHBondContact O-N 2.86Å; W174-Y176 VanDerWaalsContact C-N 3.34Å; W174-Y176 PolarHBondContact O-N 3.14Å; Y176-V178 VanDerWaalsContact C-N 3.32Å; Y176-V178 PolarHBondContact O-N 3.46Å; Y176-S179 PolarHBondContact O-N 3.43Å; Y176-Y180 WeakPolarHBondContact O-CB 3.09Å; Y176-Y180 PolarHBondContact O-N 2.87Å; Y176-M217 HydrophobicContact CD2-CB 4.21Å; Y176-M217 HydrophobicContact CD2-CG 3.97Å; Y176-M217 HydrophobicContact CE2-CB 3.88Å; Y176-M217 HydrophobicContact CE2-CE 4.4Å; Y176-M217 HydrophobicContact CE2-CG 3.84Å; Y176-M220 HydrophobicContact CD1-CE 4.44Å; Y176-M220 HydrophobicContact CD2-CB 4.38Å; Y176-M220 HydrophobicContact CD2-CE 3.37Å; Y176-M220 HydrophobicContact CD2-CG 4.39Å; Y176-M220 HydrophobicContact CE2-CE 3.93Å; Y176-M220 HydrophobicContact CG-CE 3.66Å; Y176-I221 HydrophobicContact CE2-CD1 4.19Å; Y176-I221 HydrophobicContact CE2-CG1 4.22Å |
| 177 | Y | 94.9 | Very high | 93.3 | Very high | 152 Ų | 152 | 77.5 Ų | 77.5 | 60% | 0.596 | 36% | 0.359 | S | S | * | . | H | α-helix | trans | -67.3 | -32.4 | 177.5 | -61.6 | -72.7 | 0 | 0 | 0 | 112.3 | R173 W174 T175 A181 | R173-Y177 VanDerWaalsContact O-CD2 3.24Å; R173-Y177 WeakPolarHBondContact O-CD2 3.3Å; W174-Y177 PolarHBondContact O-N 3.4Å; T175-Y177 PolarHBondContact O-N 2.63Å; Y177-A181 WeakPolarHBondContact O-CB 3.39Å; Y177-A181 PolarHBondContact O-N 2.93Å |
| 178 | V | 95.3 | Very high | 93 | Very high | 73 Ų | 73 | 77 Ų | 77 | 44% | 0.442 | 36% | 0.356 | S | S | . | . | H | α-helix | trans | -68 | -44.9 | 172.1 | 171.6 | 0 | 0 | 0 | 0 | 111.3 | W174 T175 Y176 Y180 A181 V182 | W174-V178 HydrophobicContact CE3-CG2 3.82Å; W174-V178 HydrophobicContact CZ3-CG2 4.05Å; W174-V178 PolarHBondContact O-N 2.83Å; W174-V178 VanDerWaalsContact O-N 3.08Å; T175-V178 PolarHBondContact O-N 2.91Å; Y176-V178 VanDerWaalsContact C-N 3.32Å; Y176-V178 PolarHBondContact O-N 3.46Å; V178-Y180 VanDerWaalsContact C-N 3.31Å; V178-Y180 PolarHBondContact O-N 2.9Å; V178-A181 PolarHBondContact O-N 3.4Å; V178-V182 WeakPolarHBondContact O-CG2 3.48Å; V178-V182 PolarHBondContact O-N 3.06Å |
| 179 | S | 94.9 | Very high | 92.5 | Very high | 18 Ų | 18 | 74.4 Ų | 74.4 | 13% | 0.126 | 35% | 0.35 | C | S | . | . | H | α-helix | trans | -61.2 | -40.2 | 174.3 | -60.6 | 0 | 0 | 0 | 0 | 112 | T175 Y176 V182 F183 Y216 | T175-S179 PolarHBondContact O-N 3.36Å; T175-S179 PolarHBondContact O-OG 3.29Å; Y176-S179 PolarHBondContact O-N 3.43Å; S179-V182 PolarHBondContact O-N 2.97Å; S179-F183 WeakPolarHBondContact O-CB 3.41Å; S179-F183 PolarHBondContact O-N 2.68Å; S179-Y216 WeakPolarHBondContact OG-CD1 3.49Å |
| 180 | Y | 93.7 | Very high | 91.8 | Very high | 105 Ų | 105 | 75 Ų | 75 | 41% | 0.412 | 35% | 0.352 | S | S | . | . | H | α-helix | trans | -60.9 | -46.1 | 173.5 | -168.6 | -83.6 | 0 | 0 | 0 | 111.6 | Y176 V178 F183 F184 M217 | Y176-Y180 WeakPolarHBondContact O-CB 3.09Å; Y176-Y180 PolarHBondContact O-N 2.87Å; V178-Y180 VanDerWaalsContact C-N 3.31Å; V178-Y180 PolarHBondContact O-N 2.9Å; Y180-F183 PolarHBondContact O-N 3.49Å; Y180-F184 AromaticContact CD1-CD2 3.77Å; Y180-F184 HydrophobicContact CD1-CD2 3.77Å; Y180-F184 HydrophobicContact CD1-CE2 4.07Å; Y180-F184 HydrophobicContact CD2-CE2 4.33Å; Y180-F184 AromaticContact CE1-CD2 3.48Å; Y180-F184 HydrophobicContact CE1-CD2 3.48Å; Y180-F184 VanDerWaalsContact CE1-CD2 3.48Å; Y180-F184 AromaticContact CE1-CE2 3.43Å; Y180-F184 HydrophobicContact CE1-CE2 3.43Å; Y180-F184 VanDerWaalsContact CE1-CE2 3.43Å; Y180-F184 HydrophobicContact CE1-CG 4.3Å; Y180-F184 HydrophobicContact CE1-CZ 4.19Å; Y180-F184 HydrophobicContact CE2-CD2 4.36Å; Y180-F184 AromaticContact CE2-CE2 3.73Å; Y180-F184 HydrophobicContact CE2-CE2 3.73Å; Y180-F184 HydrophobicContact CG-CD2 4.31Å; Y180-F184 HydrophobicContact CG-CE2 4.48Å; Y180-F184 AromaticContact CZ-CD2 3.81Å; Y180-F184 AromaticContact CZ-CE2 3.23Å; Y180-F184 AromaticContact CZ-CZ 3.88Å; Y180-F184 WeakPolarHBondContact O-CD2 3.13Å; Y180-F184 PolarHBondContact O-N 2.88Å; Y180-F184 WeakPolarHBondContact OH-CE2 3.23Å; Y180-F184 WeakPolarHBondContact OH-CZ 3.22Å; Y180-M217 HydrophobicContact CD2-CE 3.68Å; Y180-M217 HydrophobicContact CD2-SD 4.22Å; Y180-M217 HydrophobicContact CE2-CE 4.34Å |
| 181 | A | 94.6 | Very high | 91.2 | Very high | 52 Ų | 52 | 76.1 Ų | 76.1 | 43% | 0.43 | 37% | 0.367 | S | S | . | . | H | α-helix | trans | -62.1 | -43.5 | 175.7 | 0 | 0 | 0 | 0 | 0 | 112.2 | Y177 V178 F183 F184 V185 | Y177-A181 WeakPolarHBondContact O-CB 3.39Å; Y177-A181 PolarHBondContact O-N 2.93Å; V178-A181 PolarHBondContact O-N 3.4Å; A181-F183 PolarHBondContact O-N 3.29Å; A181-F184 PolarHBondContact O-N 2.96Å; A181-V185 WeakPolarHBondContact O-CB 3.32Å; A181-V185 VanDerWaalsContact O-CG2 3.28Å; A181-V185 WeakPolarHBondContact O-CG2 3.28Å; A181-V185 PolarHBondContact O-N 3.44Å |
| 182 | V | 94.9 | Very high | 90.6 | Very high | 59 Ų | 59 | 70.4 Ų | 70.4 | 36% | 0.358 | 36% | 0.359 | S | S | . | . | H | α-helix | trans | -61.7 | -41.9 | 175.7 | 169.3 | 0 | 0 | 0 | 0 | 111.5 | V178 S179 S186 I209 | V178-V182 WeakPolarHBondContact O-CG2 3.48Å; V178-V182 PolarHBondContact O-N 3.06Å; S179-V182 PolarHBondContact O-N 2.97Å; V182-S186 VanDerWaalsContact O-CB 3.27Å; V182-S186 WeakPolarHBondContact O-CB 3.25Å; V182-S186 PolarHBondContact O-N 3.13Å; V182-S186 PolarHBondContact O-OG 3.22Å; V182-I209 HydrophobicContact CG1-CG2 3.57Å |
| 183 | F | 93.2 | Very high | 89.7 | Confident | 14 Ų | 14 | 71.4 Ų | 71.4 | 6% | 0.061 | 37% | 0.369 | C | S | . | . | H | α-helix | trans | -61.2 | -51.2 | 176.2 | -178.2 | -101.2 | 0 | 0 | 0 | 111.3 | S179 Y180 A181 S186 L187 L210 M214 M217 | S179-F183 WeakPolarHBondContact O-CB 3.41Å; S179-F183 PolarHBondContact O-N 2.68Å; Y180-F183 PolarHBondContact O-N 3.49Å; A181-F183 PolarHBondContact O-N 3.29Å; F183-S186 PolarHBondContact O-N 3.39Å; F183-L187 HydrophobicContact CD1-CD1 3.95Å; F183-L187 HydrophobicContact CD1-CG 4.42Å; F183-L187 HydrophobicContact CE1-CD1 3.39Å; F183-L187 HydrophobicContact CE1-CG 4.08Å; F183-L187 HydrophobicContact CZ-CD1 3.82Å; F183-L187 HydrophobicContact CZ-CD2 4.4Å; F183-L187 HydrophobicContact CZ-CG 4.19Å; F183-L187 PolarHBondContact O-N 2.89Å; F183-L210 HydrophobicContact CD2-CB 4.43Å; F183-L210 HydrophobicContact CD2-CD2 3.53Å; F183-L210 HydrophobicContact CE2-CB 4.37Å; F183-L210 HydrophobicContact CE2-CD2 3.66Å; F183-L210 HydrophobicContact CG-CD2 4.2Å; F183-L210 HydrophobicContact CZ-CD2 4.42Å; F183-L210 WeakPolarHBondContact O-CD2 3.42Å; F183-M214 HydrophobicContact CD2-CB 4.08Å; F183-M214 HydrophobicContact CD2-CE 4.45Å; F183-M214 HydrophobicContact CE1-CE 3.94Å; F183-M214 HydrophobicContact CE2-CB 3.99Å; F183-M214 HydrophobicContact CE2-CE 3.65Å; F183-M214 HydrophobicContact CE2-SD 4.21Å; F183-M214 HydrophobicContact CZ-CE 3.36Å; F183-M214 HydrophobicContact CZ-SD 4.36Å; F183-M217 HydrophobicContact CB-SD 4.42Å |
| 184 | F | 91.2 | Very high | 88.5 | Confident | 86 Ų | 86 | 65.2 Ų | 65.2 | 38% | 0.377 | 35% | 0.353 | S | S | . | . | H | α-helix | trans | -66.6 | -41.5 | -179.6 | -89.1 | -95.5 | 0 | 0 | 0 | 113.4 | Y180 A181 S186 L187 I188 | Y180-F184 AromaticContact CD1-CD2 3.77Å; Y180-F184 HydrophobicContact CD1-CD2 3.77Å; Y180-F184 HydrophobicContact CD1-CE2 4.07Å; Y180-F184 HydrophobicContact CD2-CE2 4.33Å; Y180-F184 AromaticContact CE1-CD2 3.48Å; Y180-F184 HydrophobicContact CE1-CD2 3.48Å; Y180-F184 VanDerWaalsContact CE1-CD2 3.48Å; Y180-F184 AromaticContact CE1-CE2 3.43Å; Y180-F184 HydrophobicContact CE1-CE2 3.43Å; Y180-F184 VanDerWaalsContact CE1-CE2 3.43Å; Y180-F184 HydrophobicContact CE1-CG 4.3Å; Y180-F184 HydrophobicContact CE1-CZ 4.19Å; Y180-F184 HydrophobicContact CE2-CD2 4.36Å; Y180-F184 AromaticContact CE2-CE2 3.73Å; Y180-F184 HydrophobicContact CE2-CE2 3.73Å; Y180-F184 HydrophobicContact CG-CD2 4.31Å; Y180-F184 HydrophobicContact CG-CE2 4.48Å; Y180-F184 AromaticContact CZ-CD2 3.81Å; Y180-F184 AromaticContact CZ-CE2 3.23Å; Y180-F184 AromaticContact CZ-CZ 3.88Å; Y180-F184 WeakPolarHBondContact O-CD2 3.13Å; Y180-F184 PolarHBondContact O-N 2.88Å; Y180-F184 WeakPolarHBondContact OH-CE2 3.23Å; Y180-F184 WeakPolarHBondContact OH-CZ 3.22Å; A181-F184 PolarHBondContact O-N 2.96Å; F184-S186 VanDerWaalsContact C-N 3.31Å; F184-S186 PolarHBondContact O-N 2.98Å; F184-L187 PolarHBondContact O-N 3.39Å; F184-I188 WeakPolarHBondContact O-CB 3.22Å; F184-I188 WeakPolarHBondContact O-CD1 3.31Å; F184-I188 VanDerWaalsContact O-CG1 3.25Å; F184-I188 WeakPolarHBondContact O-CG1 3.48Å; F184-I188 PolarHBondContact O-N 2.96Å |
| 185 | V | 91.4 | Very high | 87.1 | Confident | 90 Ų | 90 | 63.6 Ų | 63.6 | 55% | 0.545 | 36% | 0.356 | S | S | . | . | H | α-helix | trans | -59.9 | -44.1 | 173.4 | 169.7 | 0 | 0 | 0 | 0 | 110.3 | A181 L187 I188 T189 | A181-V185 WeakPolarHBondContact O-CB 3.32Å; A181-V185 VanDerWaalsContact O-CG2 3.28Å; A181-V185 WeakPolarHBondContact O-CG2 3.28Å; A181-V185 PolarHBondContact O-N 3.44Å; V185-L187 PolarHBondContact O-N 2.83Å; V185-I188 PolarHBondContact O-N 2.87Å; V185-T189 PolarHBondContact O-N 3.32Å; V185-T189 PolarHBondContact O-OG1 2.96Å; V185-T189 VanDerWaalsContact O-OG1 3.1Å |
| 186 | S | 89.2 | Confident | 85.6 | Confident | 17 Ų | 17 | 66.6 Ų | 66.6 | 12% | 0.119 | 37% | 0.368 | C | S | . | . | H | α-helix | trans | -64.5 | -41 | 178.5 | -57.2 | 0 | 0 | 0 | 0 | 112.5 | V182 F183 F184 T189 I190 I209 | V182-S186 VanDerWaalsContact O-CB 3.27Å; V182-S186 WeakPolarHBondContact O-CB 3.25Å; V182-S186 PolarHBondContact O-N 3.13Å; V182-S186 PolarHBondContact O-OG 3.22Å; F183-S186 PolarHBondContact O-N 3.39Å; F184-S186 VanDerWaalsContact C-N 3.31Å; F184-S186 PolarHBondContact O-N 2.98Å; S186-T189 PolarHBondContact O-N 2.94Å; S186-I190 WeakPolarHBondContact O-CB 3.31Å; S186-I190 VanDerWaalsContact O-CG1 3.27Å; S186-I190 WeakPolarHBondContact O-CG1 3.49Å; S186-I190 PolarHBondContact O-N 3.37Å; S186-I209 VanDerWaalsContact OG-CG2 3.27Å; S186-I209 WeakPolarHBondContact OG-CG2 3.21Å |
| 187 | L | 86.8 | Confident | 84.1 | Confident | 43 Ų | 43 | 66.1 Ų | 66.1 | 23% | 0.225 | 37% | 0.366 | C | S | . | . | H | α-helix | trans | -60.6 | -44.1 | 173 | -76.8 | -177.1 | 0 | 0 | 0 | 111.9 | F183 F184 V185 I190 S191 L210 L325 | F183-L187 HydrophobicContact CD1-CD1 3.95Å; F183-L187 HydrophobicContact CD1-CG 4.42Å; F183-L187 HydrophobicContact CE1-CD1 3.39Å; F183-L187 HydrophobicContact CE1-CG 4.08Å; F183-L187 HydrophobicContact CZ-CD1 3.82Å; F183-L187 HydrophobicContact CZ-CD2 4.4Å; F183-L187 HydrophobicContact CZ-CG 4.19Å; F183-L187 PolarHBondContact O-N 2.89Å; F184-L187 PolarHBondContact O-N 3.39Å; V185-L187 PolarHBondContact O-N 2.83Å; L187-I190 PolarHBondContact O-N 3.43Å; L187-S191 VanDerWaalsContact O-CB 3.24Å; L187-S191 WeakPolarHBondContact O-CB 3.38Å; L187-S191 PolarHBondContact O-N 3.38Å; L187-S191 PolarHBondContact O-OG 2.93Å; L187-L210 HydrophobicContact CD2-CD1 3.94Å; L187-L210 HydrophobicContact CD2-CD2 3.76Å; L187-L210 HydrophobicContact CG-CD2 3.74Å; L187-L325 HydrophobicContact CD2-CD2 3.94Å |
| 188 | I | 87 | Confident | 82.8 | Confident | 99 Ų | 99 | 66 Ų | 66 | 51% | 0.508 | 36% | 0.364 | S | S | . | . | H | α-helix | trans | -65.8 | -46.8 | 179.4 | -68.3 | 164.1 | 0 | 0 | 0 | 110.2 | F184 V185 I190 S191 C192 | F184-I188 WeakPolarHBondContact O-CB 3.22Å; F184-I188 WeakPolarHBondContact O-CD1 3.31Å; F184-I188 VanDerWaalsContact O-CG1 3.25Å; F184-I188 WeakPolarHBondContact O-CG1 3.48Å; F184-I188 PolarHBondContact O-N 2.96Å; V185-I188 PolarHBondContact O-N 2.87Å; I188-I190 PolarHBondContact O-N 2.74Å; I188-S191 PolarHBondContact O-N 3.49Å; I188-S191 VanDerWaalsContact O-N 3.16Å; I188-C192 WeakPolarHBondContact O-CB 3.37Å; I188-C192 PolarHBondContact O-N 3.12Å; I188-C192 PolarHBondContact O-SG 3.16Å |
| 189 | T | 84.4 | Confident | 81.7 | Confident | 56 Ų | 56 | 69.4 Ų | 69.4 | 34% | 0.344 | 37% | 0.373 | S | S | . | . | H | α-helix | trans | -58.6 | -45.9 | 175.7 | -59.6 | 0 | 0 | 0 | 0 | 111.8 | V185 S186 S191 C193 F196 | V185-T189 PolarHBondContact O-N 3.32Å; V185-T189 PolarHBondContact O-OG1 2.96Å; V185-T189 VanDerWaalsContact O-OG1 3.1Å; S186-T189 PolarHBondContact O-N 2.94Å; T189-S191 VanDerWaalsContact C-N 3.3Å; T189-S191 PolarHBondContact O-N 2.93Å; T189-C193 VanDerWaalsContact O-CB 3.26Å; T189-C193 WeakPolarHBondContact O-CB 3.24Å; T189-C193 PolarHBondContact O-N 3.22Å; T189-F196 HydrophobicContact CG2-CD1 4.44Å |
| 190 | I | 79.9 | Confident | 80.7 | Confident | 12 Ų | 12 | 74.9 Ų | 74.9 | 6% | 0.062 | 40% | 0.397 | C | S | . | . | H | α-helix | trans | -63.6 | -36.8 | 176.9 | -72 | 174.5 | 0 | 0 | 0 | 111.7 | S186 L187 I188 R197 A206 L210 | S186-I190 WeakPolarHBondContact O-CB 3.31Å; S186-I190 VanDerWaalsContact O-CG1 3.27Å; S186-I190 WeakPolarHBondContact O-CG1 3.49Å; S186-I190 PolarHBondContact O-N 3.37Å; L187-I190 PolarHBondContact O-N 3.43Å; I188-I190 PolarHBondContact O-N 2.74Å; I190-R197 HydrophobicContact CG2-CG 4.21Å; I190-R197 PolarHBondContact O-NE 2.84Å; I190-R197 VanDerWaalsContact O-NE 3.11Å; I190-R197 PolarHBondContact O-NH2 2.93Å; I190-A206 HydrophobicContact CD1-CB 3.62Å; I190-A206 HydrophobicContact CG1-CB 3.74Å; I190-L210 HydrophobicContact CD1-CD1 3.5Å; I190-L210 VanDerWaalsContact CD1-CD1 3.5Å; I190-L210 HydrophobicContact CD1-CG 4.21Å |
| 191 | S | 81.1 | Confident | 79.9 | Confident | 84 Ų | 84 | 73.1 Ų | 73.1 | 59% | 0.587 | 40% | 0.398 | S | S | * | . | H | α-helix | trans | -75.5 | -40.2 | -178 | -59.5 | 0 | 0 | 0 | 0 | 113 | L187 I188 T189 | L187-S191 VanDerWaalsContact O-CB 3.24Å; L187-S191 WeakPolarHBondContact O-CB 3.38Å; L187-S191 PolarHBondContact O-N 3.38Å; L187-S191 PolarHBondContact O-OG 2.93Å; I188-S191 PolarHBondContact O-N 3.49Å; I188-S191 VanDerWaalsContact O-N 3.16Å; T189-S191 VanDerWaalsContact C-N 3.3Å; T189-S191 PolarHBondContact O-N 2.93Å |
| 192 | C | 81.8 | Confident | 79.3 | Confident | 99 Ų | 99 | 76.5 Ų | 76.5 | 67% | 0.669 | 40% | 0.399 | S | S | * | . | H | α-helix | trans | -88.5 | -25.1 | -177.3 | -62.6 | 0 | 0 | 0 | 0 | 113.8 | I188 | I188-C192 WeakPolarHBondContact O-CB 3.37Å; I188-C192 PolarHBondContact O-N 3.12Å; I188-C192 PolarHBondContact O-SG 3.16Å |
| 193 | C | 76.1 | Confident | 78.5 | Confident | 60 Ų | 60 | 74.1 Ų | 74.1 | 41% | 0.405 | 39% | 0.385 | S | S | . | . | trans | -117.3 | 74 | -174 | -56.3 | 0 | 0 | 0 | 0 | 112.1 | T189 D195 F196 R197 | T189-C193 VanDerWaalsContact O-CB 3.26Å; T189-C193 WeakPolarHBondContact O-CB 3.24Å; T189-C193 PolarHBondContact O-N 3.22Å; C193-D195 VanDerWaalsContact C-N 3.28Å; C193-D195 PolarHBondContact O-N 2.94Å; C193-F196 HydrophobicContact CB-CB 4.08Å; C193-F196 WeakPolarHBondContact O-CB 3.33Å; C193-F196 PolarHBondContact O-N 3.38Å; C193-F196 VanDerWaalsContact O-N 3.09Å; C193-R197 PolarHBondContact O-N 2.92Å | ||
| 194 | G | 66.8 | Low | 78 | Confident | 23 Ų | 23 | 77 Ų | 77 | 24% | 0.237 | 40% | 0.401 | C | S | . | . | H | α-helix | trans | -53.1 | -40 | 178.6 | 0 | 0 | 0 | 0 | 0 | 113.9 | F196 R197 R198 | G194-F196 VanDerWaalsContact C-N 3.26Å; G194-F196 PolarHBondContact O-N 3.34Å; G194-R197 CarbonylContact O-C 3.48Å; G194-R197 WeakPolarHBondContact O-CA 3.5Å; G194-R197 VanDerWaalsContact O-CB 3.29Å; G194-R197 WeakPolarHBondContact O-CB 3.47Å; G194-R197 PolarHBondContact O-N 3.47Å; G194-R198 VanDerWaalsContact O-CG 3.31Å; G194-R198 WeakPolarHBondContact O-CG 3.25Å; G194-R198 PolarHBondContact O-N 2.91Å |
| 195 | D | 64.9 | Low | 77.8 | Confident | 127 Ų | 127 | 75.6 Ų | 75.6 | 68% | 0.679 | 40% | 0.399 | S | S | * | . | H | α-helix | trans | -63.5 | -30.7 | -179.9 | -55.9 | -62.3 | 0 | 0 | 0 | 113.5 | C193 R197 R198 K199 | C193-D195 VanDerWaalsContact C-N 3.28Å; C193-D195 PolarHBondContact O-N 2.94Å; D195-R197 VanDerWaalsContact C-N 3.35Å; D195-R198 PolarHBondContact O-N 3.49Å; D195-K199 PolarHBondContact O-N 3.41Å |
| 196 | F | 62.1 | Low | 77.4 | Confident | 76 Ų | 76 | 71.8 Ų | 71.8 | 33% | 0.333 | 38% | 0.377 | S | S | . | . | H | α-helix | trans | -72.4 | -30.5 | 173.2 | -160.9 | -97.7 | 0 | 0 | 0 | 111.7 | T189 C193 G194 W202 | T189-F196 HydrophobicContact CG2-CD1 4.44Å; C193-F196 HydrophobicContact CB-CB 4.08Å; C193-F196 WeakPolarHBondContact O-CB 3.33Å; C193-F196 PolarHBondContact O-N 3.38Å; C193-F196 VanDerWaalsContact O-N 3.09Å; G194-F196 VanDerWaalsContact C-N 3.26Å; G194-F196 PolarHBondContact O-N 3.34Å; F196-W202 HydrophobicContact CD1-CB 4.13Å; F196-W202 HydrophobicContact CD2-CB 4.37Å; F196-W202 HydrophobicContact CD2-CG 4.26Å; F196-W202 HydrophobicContact CE1-CB 3.97Å; F196-W202 HydrophobicContact CE1-CD2 4.34Å; F196-W202 HydrophobicContact CE1-CE3 4.03Å; F196-W202 HydrophobicContact CE1-CG 4.36Å; F196-W202 HydrophobicContact CE2-CB 4.2Å; F196-W202 AromaticContact CE2-CD2 3.65Å; F196-W202 HydrophobicContact CE2-CD2 3.65Å; F196-W202 AromaticContact CE2-CE3 3.85Å; F196-W202 HydrophobicContact CE2-CE3 3.85Å; F196-W202 AromaticContact CE2-CG 3.83Å; F196-W202 HydrophobicContact CE2-CG 3.83Å; F196-W202 HydrophobicContact CE2-CZ3 4.43Å; F196-W202 HydrophobicContact CG-CB 4.34Å; F196-W202 HydrophobicContact CZ-CB 4.02Å; F196-W202 AromaticContact CZ-CD2 3.55Å; F196-W202 HydrophobicContact CZ-CD2 3.55Å; F196-W202 AromaticContact CZ-CE3 3.27Å; F196-W202 HydrophobicContact CZ-CE3 3.27Å; F196-W202 AromaticContact CZ-CG 3.9Å; F196-W202 HydrophobicContact CZ-CG 3.9Å; F196-W202 AromaticContact CZ-CZ3 3.9Å; F196-W202 HydrophobicContact CZ-CZ3 3.9Å; F196-W202 WeakPolarHBondContact O-CB 3.01Å |
| 197 | R | 61.2 | Low | 77.4 | Confident | 44 Ų | 44 | 71.5 Ų | 71.5 | 17% | 0.166 | 37% | 0.374 | C | S | . | . | H | α-helix | trans | -77 | -24.6 | 173.1 | -160 | -158 | -62.7 | -161.4 | 5.7 | 113 | I190 C193 G194 D195 N203 E318 | I190-R197 HydrophobicContact CG2-CG 4.21Å; I190-R197 PolarHBondContact O-NE 2.84Å; I190-R197 VanDerWaalsContact O-NE 3.11Å; I190-R197 PolarHBondContact O-NH2 2.93Å; C193-R197 PolarHBondContact O-N 2.92Å; G194-R197 CarbonylContact O-C 3.48Å; G194-R197 WeakPolarHBondContact O-CA 3.5Å; G194-R197 VanDerWaalsContact O-CB 3.29Å; G194-R197 WeakPolarHBondContact O-CB 3.47Å; G194-R197 PolarHBondContact O-N 3.47Å; D195-R197 VanDerWaalsContact C-N 3.35Å; R197-N203 WeakPolarHBondContact O-CB 3.48Å; R197-E318 HydrophobicContact CG-CG 4.4Å |
| 198 | R | 68 | Low | 77.6 | Confident | 148 Ų | 148 | 71.9 Ų | 71.9 | 56% | 0.558 | 38% | 0.38 | S | S | * | . | H | α-helix | trans | -83.7 | -33.5 | 179.9 | -71.2 | 163.5 | -176.4 | -148.9 | -17.1 | 113 | G194 D195 E318 | G194-R198 VanDerWaalsContact O-CG 3.31Å; G194-R198 WeakPolarHBondContact O-CG 3.25Å; G194-R198 PolarHBondContact O-N 2.91Å; D195-R198 PolarHBondContact O-N 3.49Å; R198-E318 HydrophobicContact CG-CG 3.85Å; R198-E318 WeakPolarHBondContact CG-OE1 3.18Å; R198-E318 IonicContact CZ-OE1 3.29Å; R198-E318 IonicContact CZ-OE2 3.89Å; R198-E318 VanDerWaalsContact CZ-OE2 3.29Å; R198-E318 IonicContact NE-OE1 3.03Å; R198-E318 PolarHBondContact NE-OE1 3.26Å; R198-E318 IonicContact NE-OE2 3.7Å; R198-E318 PolarHBondContact NE-OE2 3.48Å; R198-E318 IonicContact NH2-OE1 2.73Å; R198-E318 IonicContact NH2-OE2 2.74Å; R198-E318 PolarHBondContact NH2-OE2 3.4Å |
| 199 | K | 72.1 | Confident | 77.8 | Confident | 145 Ų | 145 | 70.3 Ų | 70.3 | 63% | 0.63 | 37% | 0.372 | S | S | * | . | S | Bend | trans | -84.8 | 117 | -173.9 | -160.6 | 166.7 | -171.9 | 172.8 | 0 | 112.3 | D195 W202 N203 | D195-K199 PolarHBondContact O-N 3.41Å; K199-W202 WeakPolarHBondContact O-CB 3.37Å; K199-W202 PolarHBondContact O-N 3.45Å; K199-N203 PolarHBondContact O-N 2.82Å |
| 200 | H | 73.9 | Confident | 78.2 | Confident | 134 Ų | 134 | 67.7 Ų | 67.7 | 62% | 0.62 | 36% | 0.356 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -66.9 | 140.6 | 166 | -173.5 | 77 | 0 | 0 | 0 | 110 | ||
| 201 | P | 78.4 | Confident | 79 | Confident | 67 Ų | 67 | 67.5 Ų | 67.5 | 44% | 0.435 | 36% | 0.355 | S | S | . | . | T | Hydrogen-bonded Turn | cis | -91.5 | 0.2 | 1.4 | 37.7 | -36.5 | 0 | 0 | 0 | 115 | N203 L204 V205 | P201-N203 PolarHBondContact O-N 3.12Å; P201-N203 VanDerWaalsContact O-N 3.1Å; P201-L204 PolarHBondContact O-N 3.17Å; P201-V205 PolarHBondContact O-N 2.94Å; P201-V205 VanDerWaalsContact O-N 3.17Å |
| 202 | W | 80.3 | Confident | 79.7 | Confident | 123 Ų | 123 | 67.2 Ų | 67.2 | 47% | 0.466 | 35% | 0.347 | S | S | . | . | H | α-helix | trans | -55 | -32.9 | -173.8 | -68 | 114.9 | 0 | 0 | 0 | 113.9 | F196 K199 L204 V205 A206 | F196-W202 HydrophobicContact CD1-CB 4.13Å; F196-W202 HydrophobicContact CD2-CB 4.37Å; F196-W202 HydrophobicContact CD2-CG 4.26Å; F196-W202 HydrophobicContact CE1-CB 3.97Å; F196-W202 HydrophobicContact CE1-CD2 4.34Å; F196-W202 HydrophobicContact CE1-CE3 4.03Å; F196-W202 HydrophobicContact CE1-CG 4.36Å; F196-W202 HydrophobicContact CE2-CB 4.2Å; F196-W202 AromaticContact CE2-CD2 3.65Å; F196-W202 HydrophobicContact CE2-CD2 3.65Å; F196-W202 AromaticContact CE2-CE3 3.85Å; F196-W202 HydrophobicContact CE2-CE3 3.85Å; F196-W202 AromaticContact CE2-CG 3.83Å; F196-W202 HydrophobicContact CE2-CG 3.83Å; F196-W202 HydrophobicContact CE2-CZ3 4.43Å; F196-W202 HydrophobicContact CG-CB 4.34Å; F196-W202 HydrophobicContact CZ-CB 4.02Å; F196-W202 AromaticContact CZ-CD2 3.55Å; F196-W202 HydrophobicContact CZ-CD2 3.55Å; F196-W202 AromaticContact CZ-CE3 3.27Å; F196-W202 HydrophobicContact CZ-CE3 3.27Å; F196-W202 AromaticContact CZ-CG 3.9Å; F196-W202 HydrophobicContact CZ-CG 3.9Å; F196-W202 AromaticContact CZ-CZ3 3.9Å; F196-W202 HydrophobicContact CZ-CZ3 3.9Å; F196-W202 WeakPolarHBondContact O-CB 3.01Å; K199-W202 WeakPolarHBondContact O-CB 3.37Å; K199-W202 PolarHBondContact O-N 3.45Å; W202-L204 VanDerWaalsContact C-N 3.34Å; W202-L204 PolarHBondContact O-N 3.44Å; W202-V205 HydrophobicContact CE3-CB 4.41Å; W202-V205 HydrophobicContact CE3-CG1 4.43Å; W202-V205 PolarHBondContact O-N 2.85Å; W202-A206 WeakPolarHBondContact O-CB 3.48Å; W202-A206 PolarHBondContact O-N 2.97Å |
| 203 | N | 79.4 | Confident | 80.4 | Confident | 9 Ų | 9 | 62.9 Ų | 62.9 | 5% | 0.048 | 32% | 0.318 | C | S | . | . | H | α-helix | trans | -62.2 | -36.3 | 175.8 | 71.8 | -22.6 | 0 | 0 | 0 | 114.1 | R197 K199 P201 L207 I321 | R197-N203 WeakPolarHBondContact O-CB 3.48Å; K199-N203 PolarHBondContact O-N 2.82Å; P201-N203 PolarHBondContact O-N 3.12Å; P201-N203 VanDerWaalsContact O-N 3.1Å; N203-L207 WeakPolarHBondContact O-CB 3.43Å; N203-L207 PolarHBondContact O-N 2.92Å; N203-I321 HydrophobicContact CB-CD1 3.66Å |
| 204 | L | 81.6 | Confident | 81.4 | Confident | 76 Ų | 76 | 60.9 Ų | 60.9 | 40% | 0.398 | 30% | 0.302 | S | S | . | . | H | α-helix | trans | -77.3 | -35.2 | 173.1 | -61.8 | -178.6 | 0 | 0 | 0 | 112 | P201 W202 L207 S208 | P201-L204 PolarHBondContact O-N 3.17Å; W202-L204 VanDerWaalsContact C-N 3.34Å; W202-L204 PolarHBondContact O-N 3.44Å; L204-L207 PolarHBondContact O-N 2.93Å; L204-S208 WeakPolarHBondContact O-CB 3.47Å; L204-S208 PolarHBondContact O-N 2.61Å; L204-S208 PolarHBondContact O-OG 3.3Å |
| 205 | V | 86.6 | Confident | 82.8 | Confident | 56 Ų | 56 | 59.8 Ų | 59.8 | 34% | 0.339 | 29% | 0.291 | S | S | . | . | H | α-helix | trans | -63.3 | -47.1 | 176.2 | 177 | 0 | 0 | 0 | 0 | 110.7 | P201 W202 L207 S208 I209 | P201-V205 PolarHBondContact O-N 2.94Å; P201-V205 VanDerWaalsContact O-N 3.17Å; W202-V205 HydrophobicContact CE3-CB 4.41Å; W202-V205 HydrophobicContact CE3-CG1 4.43Å; W202-V205 PolarHBondContact O-N 2.85Å; V205-L207 VanDerWaalsContact C-N 3.34Å; V205-L207 PolarHBondContact O-N 2.91Å; V205-S208 PolarHBondContact O-N 2.76Å; V205-S208 PolarHBondContact O-OG 3.1Å; V205-I209 HydrophobicContact CG1-CD1 3.93Å; V205-I209 VanDerWaalsContact O-CG1 3.3Å; V205-I209 WeakPolarHBondContact O-CG1 3.48Å; V205-I209 PolarHBondContact O-N 2.7Å |
| 206 | A | 84.8 | Confident | 84.4 | Confident | 10 Ų | 10 | 55.4 Ų | 55.4 | 8% | 0.083 | 27% | 0.266 | C | S | . | . | H | α-helix | trans | -65 | -39 | 179.4 | 0 | 0 | 0 | 0 | 0 | 111.8 | I190 W202 I209 L210 | I190-A206 HydrophobicContact CD1-CB 3.62Å; I190-A206 HydrophobicContact CG1-CB 3.74Å; W202-A206 WeakPolarHBondContact O-CB 3.48Å; W202-A206 PolarHBondContact O-N 2.97Å; A206-I209 PolarHBondContact O-N 2.88Å; A206-L210 PolarHBondContact O-N 3.48Å; A206-L210 VanDerWaalsContact O-N 3.12Å |
| 207 | L | 87.6 | Confident | 86 | Confident | 10 Ų | 10 | 52.7 Ų | 52.7 | 5% | 0.052 | 25% | 0.254 | C | S | . | . | H | α-helix | trans | -66.4 | -38.1 | 174.2 | -176.7 | 61.2 | 0 | 0 | 0 | 112.9 | V144 N203 L204 V205 L210 T211 I321 | V144-L207 HydrophobicContact CG1-CD2 3.62Å; N203-L207 WeakPolarHBondContact O-CB 3.43Å; N203-L207 PolarHBondContact O-N 2.92Å; L204-L207 PolarHBondContact O-N 2.93Å; V205-L207 VanDerWaalsContact C-N 3.34Å; V205-L207 PolarHBondContact O-N 2.91Å; L207-L210 PolarHBondContact O-N 3.25Å; L207-T211 WeakPolarHBondContact O-CB 3.3Å; L207-T211 PolarHBondContact O-N 3.37Å; L207-T211 PolarHBondContact O-OG1 3.08Å; L207-I321 HydrophobicContact CD1-CG2 4.16Å; L207-I321 HydrophobicContact CD2-CG2 4.31Å |
| 208 | S | 90.8 | Very high | 87.8 | Confident | 52 Ų | 52 | 50.7 Ų | 50.7 | 36% | 0.364 | 25% | 0.247 | S | C | . | . | H | α-helix | trans | -69 | -37.5 | 177.3 | 72.8 | 0 | 0 | 0 | 0 | 111.8 | L204 V205 T211 L212 | L204-S208 WeakPolarHBondContact O-CB 3.47Å; L204-S208 PolarHBondContact O-N 2.61Å; L204-S208 PolarHBondContact O-OG 3.3Å; V205-S208 PolarHBondContact O-N 2.76Å; V205-S208 PolarHBondContact O-OG 3.1Å; S208-T211 PolarHBondContact O-N 3.42Å; S208-L212 WeakPolarHBondContact O-CB 3.27Å; S208-L212 WeakPolarHBondContact O-CG 3.32Å; S208-L212 PolarHBondContact O-N 3.47Å |
| 209 | I | 93.2 | Very high | 89.2 | Confident | 66 Ų | 66 | 43.7 Ų | 43.7 | 34% | 0.338 | 22% | 0.22 | S | C | . | . | H | α-helix | trans | -63.6 | -45 | 174.5 | -65.4 | 164.3 | 0 | 0 | 0 | 111.2 | V182 S186 V205 A206 T211 S213 | V182-I209 HydrophobicContact CG1-CG2 3.57Å; S186-I209 VanDerWaalsContact OG-CG2 3.27Å; S186-I209 WeakPolarHBondContact OG-CG2 3.21Å; V205-I209 HydrophobicContact CG1-CD1 3.93Å; V205-I209 VanDerWaalsContact O-CG1 3.3Å; V205-I209 WeakPolarHBondContact O-CG1 3.48Å; V205-I209 PolarHBondContact O-N 2.7Å; A206-I209 PolarHBondContact O-N 2.88Å; I209-T211 PolarHBondContact O-N 3.39Å; I209-S213 VanDerWaalsContact O-CB 3.31Å; I209-S213 WeakPolarHBondContact O-CB 3.39Å; I209-S213 PolarHBondContact O-N 3.44Å; I209-S213 PolarHBondContact O-OG 3.48Å |
| 210 | L | 92.6 | Very high | 90.3 | Very high | 0 Ų | 0 | 37.3 Ų | 37.3 | 0% | 0 | 19% | 0.193 | C | C | . | . | H | α-helix | trans | -58.6 | -46.6 | 172.8 | -76.5 | 178.2 | 0 | 0 | 0 | 112.1 | F183 L187 I190 A206 L207 S213 M214 L325 | F183-L210 HydrophobicContact CD2-CB 4.43Å; F183-L210 HydrophobicContact CD2-CD2 3.53Å; F183-L210 HydrophobicContact CE2-CB 4.37Å; F183-L210 HydrophobicContact CE2-CD2 3.66Å; F183-L210 HydrophobicContact CG-CD2 4.2Å; F183-L210 HydrophobicContact CZ-CD2 4.42Å; F183-L210 WeakPolarHBondContact O-CD2 3.42Å; L187-L210 HydrophobicContact CD2-CD1 3.94Å; L187-L210 HydrophobicContact CD2-CD2 3.76Å; L187-L210 HydrophobicContact CG-CD2 3.74Å; I190-L210 HydrophobicContact CD1-CD1 3.5Å; I190-L210 VanDerWaalsContact CD1-CD1 3.5Å; I190-L210 HydrophobicContact CD1-CG 4.21Å; A206-L210 PolarHBondContact O-N 3.48Å; A206-L210 VanDerWaalsContact O-N 3.12Å; L207-L210 PolarHBondContact O-N 3.25Å; L210-S213 WeakPolarHBondContact CA-OG 3.46Å; L210-S213 PolarHBondContact O-OG 2.93Å; L210-S213 VanDerWaalsContact O-OG 3.09Å; L210-M214 WeakPolarHBondContact O-CB 3.47Å; L210-M214 PolarHBondContact O-N 2.94Å; L210-L325 HydrophobicContact CD1-CD1 3.98Å; L210-L325 HydrophobicContact CD1-CD2 3.87Å |
| 211 | T | 95.1 | Very high | 91.4 | Very high | 8 Ų | 8 | 32.9 Ų | 32.9 | 5% | 0.049 | 17% | 0.173 | C | C | . | . | H | α-helix | trans | -64.5 | -45.7 | -178.4 | -58.2 | 0 | 0 | 0 | 0 | 111.1 | Q148 V151 L207 S208 I209 S215 Y328 | Q148-T211 HydrophobicContact CB-CG2 3.78Å; Q148-T211 HydrophobicContact CG-CG2 3.83Å; Q148-T211 WeakPolarHBondContact CG-OG1 3.28Å; Q148-T211 PolarHBondContact NE2-OG1 2.91Å; V151-T211 HydrophobicContact CB-CG2 4.23Å; V151-T211 HydrophobicContact CG1-CG2 4.23Å; L207-T211 WeakPolarHBondContact O-CB 3.3Å; L207-T211 PolarHBondContact O-N 3.37Å; L207-T211 PolarHBondContact O-OG1 3.08Å; S208-T211 PolarHBondContact O-N 3.42Å; I209-T211 PolarHBondContact O-N 3.39Å; T211-S215 WeakPolarHBondContact O-CB 3.3Å; T211-S215 PolarHBondContact O-N 3.05Å; T211-S215 PolarHBondContact O-OG 2.91Å; T211-Y328 PolarHBondContact O-OH 2.92Å |
| 212 | L | 96.8 | Very high | 92.3 | Very high | 79 Ų | 79 | 29.7 Ų | 29.7 | 41% | 0.414 | 15% | 0.153 | S | C | . | . | H | α-helix | trans | -67.1 | -43 | 179.3 | -71.6 | 168.3 | 0 | 0 | 0 | 112.1 | V151 F155 S208 S215 Y216 | V151-L212 HydrophobicContact CG1-CD2 3.88Å; F155-L212 HydrophobicContact CE2-CD2 3.7Å; F155-L212 HydrophobicContact CZ-CD2 4.13Å; S208-L212 WeakPolarHBondContact O-CB 3.27Å; S208-L212 WeakPolarHBondContact O-CG 3.32Å; S208-L212 PolarHBondContact O-N 3.47Å; L212-S215 PolarHBondContact O-N 2.89Å; L212-Y216 WeakPolarHBondContact O-CB 3.44Å; L212-Y216 PolarHBondContact O-N 3.3Å |
| 213 | S | 96.7 | Very high | 93 | Very high | 8 Ų | 8 | 23.8 Ų | 23.8 | 6% | 0.056 | 13% | 0.13 | C | C | . | . | H | α-helix | trans | -66.7 | -43.4 | 179.1 | 52.7 | 0 | 0 | 0 | 0 | 112.3 | I209 L210 Y216 M217 | I209-S213 VanDerWaalsContact O-CB 3.31Å; I209-S213 WeakPolarHBondContact O-CB 3.39Å; I209-S213 PolarHBondContact O-N 3.44Å; I209-S213 PolarHBondContact O-OG 3.48Å; L210-S213 WeakPolarHBondContact CA-OG 3.46Å; L210-S213 PolarHBondContact O-OG 2.93Å; L210-S213 VanDerWaalsContact O-OG 3.09Å; S213-Y216 PolarHBondContact O-N 2.95Å; S213-M217 WeakPolarHBondContact O-CG 3.46Å; S213-M217 PolarHBondContact O-N 3.02Å |
| 214 | M | 96.1 | Very high | 93.7 | Very high | 17 Ų | 17 | 28.5 Ų | 28.5 | 8% | 0.084 | 15% | 0.15 | C | C | . | . | H | α-helix | trans | -67.2 | -41.6 | 172.6 | -179.8 | 159.6 | -85.2 | 0 | 0 | 112.2 | F183 L210 Y216 M217 V218 Y328 T329 I332 | F183-M214 HydrophobicContact CD2-CB 4.08Å; F183-M214 HydrophobicContact CD2-CE 4.45Å; F183-M214 HydrophobicContact CE1-CE 3.94Å; F183-M214 HydrophobicContact CE2-CB 3.99Å; F183-M214 HydrophobicContact CE2-CE 3.65Å; F183-M214 HydrophobicContact CE2-SD 4.21Å; F183-M214 HydrophobicContact CZ-CE 3.36Å; F183-M214 HydrophobicContact CZ-SD 4.36Å; L210-M214 WeakPolarHBondContact O-CB 3.47Å; L210-M214 PolarHBondContact O-N 2.94Å; M214-Y216 VanDerWaalsContact C-N 3.29Å; M214-Y216 PolarHBondContact O-N 3.5Å; M214-M217 WeakPolarHBondContact O-CB 3.29Å; M214-M217 PolarHBondContact O-N 2.82Å; M214-M217 VanDerWaalsContact O-N 3.16Å; M214-V218 HydrophobicContact CG-CG2 4.12Å; M214-V218 WeakPolarHBondContact O-CB 3.37Å; M214-V218 VanDerWaalsContact O-CG2 3.22Å; M214-V218 WeakPolarHBondContact O-CG2 3.48Å; M214-V218 PolarHBondContact O-N 2.73Å; M214-Y328 HydrophobicContact CB-CE1 4.05Å; M214-Y328 HydrophobicContact CG-CE1 3.88Å; M214-Y328 HydrophobicContact SD-CD1 4.08Å; M214-Y328 HydrophobicContact SD-CE1 3.48Å; M214-Y328 WeakPolarHBondContact SD-CE1 3.5Å; M214-T329 HydrophobicContact CE-CG2 4.13Å; M214-T329 HydrophobicContact SD-CG2 4.02Å; M214-I332 HydrophobicContact CG-CG2 4.2Å; M214-I332 HydrophobicContact SD-CB 4.35Å; M214-I332 HydrophobicContact SD-CG1 4.37Å; M214-I332 HydrophobicContact SD-CG2 3.99Å |
| 215 | S | 97.8 | Very high | 94.4 | Very high | 0 Ų | 0 | 27.1 Ų | 27.1 | 0% | 0 | 14% | 0.14 | C | C | . | . | H | α-helix | trans | -58.3 | -41.8 | 175.2 | -64 | 0 | 0 | 0 | 0 | 112 | T152 F155 T211 L212 G219 Y328 | T152-S215 WeakPolarHBondContact CA-OG 3.36Å; T152-S215 PolarHBondContact N-OG 2.99Å; T152-S215 PolarHBondContact OG1-OG 3.01Å; F155-S215 WeakPolarHBondContact CB-O 3.35Å; T211-S215 WeakPolarHBondContact O-CB 3.3Å; T211-S215 PolarHBondContact O-N 3.05Å; T211-S215 PolarHBondContact O-OG 2.91Å; L212-S215 PolarHBondContact O-N 2.89Å; S215-G219 PolarHBondContact O-N 3.09Å; S215-Y328 PolarHBondContact OG-OH 3.49Å |
| 216 | Y | 97.4 | Very high | 94.7 | Very high | 36 Ų | 36 | 30.1 Ų | 30.1 | 14% | 0.141 | 16% | 0.155 | C | C | . | . | H | α-helix | trans | -62.7 | -48.4 | 174 | -171.8 | -85 | 0 | 0 | 0 | 111.5 | F155 F159 V169 T175 S179 L212 S213 M214 V218 G219 M220 | F155-Y216 HydrophobicContact CD1-CD2 4.29Å; F155-Y216 AromaticContact CE1-CD2 3.99Å; F155-Y216 HydrophobicContact CE1-CD2 3.99Å; F159-Y216 AromaticContact CE2-CD2 3.77Å; F159-Y216 HydrophobicContact CE2-CD2 3.77Å; F159-Y216 AromaticContact CE2-CE2 3.72Å; F159-Y216 HydrophobicContact CE2-CE2 3.72Å; F159-Y216 HydrophobicContact CE2-CG 4.34Å; F159-Y216 AromaticContact CZ-CD2 3.76Å; F159-Y216 HydrophobicContact CZ-CD2 3.76Å; F159-Y216 AromaticContact CZ-CE2 3.55Å; F159-Y216 HydrophobicContact CZ-CE2 3.55Å; V169-Y216 HydrophobicContact CG1-CE2 4.44Å; V169-Y216 WeakPolarHBondContact CG1-OH 3.48Å; T175-Y216 VanDerWaalsContact CB-OH 3.3Å; T175-Y216 WeakPolarHBondContact CB-OH 3.34Å; T175-Y216 PolarHBondContact OG1-OH 3.49Å; S179-Y216 WeakPolarHBondContact OG-CD1 3.49Å; L212-Y216 WeakPolarHBondContact O-CB 3.44Å; L212-Y216 PolarHBondContact O-N 3.3Å; S213-Y216 PolarHBondContact O-N 2.95Å; M214-Y216 VanDerWaalsContact C-N 3.29Å; M214-Y216 PolarHBondContact O-N 3.5Å; Y216-V218 VanDerWaalsContact C-N 3.35Å; Y216-V218 PolarHBondContact O-N 3.12Å; Y216-G219 PolarHBondContact O-N 2.67Å; Y216-M220 HydrophobicContact CE1-CB 4.44Å; Y216-M220 HydrophobicContact CE1-CG 4.41Å; Y216-M220 VanDerWaalsContact O-CB 3.23Å; Y216-M220 WeakPolarHBondContact O-CB 3.43Å; Y216-M220 PolarHBondContact O-N 2.97Å |
| 217 | M | 96.8 | Very high | 95.2 | Very high | 18 Ų | 18 | 31.8 Ų | 31.8 | 9% | 0.089 | 16% | 0.163 | C | C | . | . | H | α-helix | trans | -57.3 | -46.2 | 177.3 | -74 | 168.1 | 49.6 | 0 | 0 | 112.2 | Y176 Y180 F183 S213 M214 M220 I221 | Y176-M217 HydrophobicContact CD2-CB 4.21Å; Y176-M217 HydrophobicContact CD2-CG 3.97Å; Y176-M217 HydrophobicContact CE2-CB 3.88Å; Y176-M217 HydrophobicContact CE2-CE 4.4Å; Y176-M217 HydrophobicContact CE2-CG 3.84Å; Y180-M217 HydrophobicContact CD2-CE 3.68Å; Y180-M217 HydrophobicContact CD2-SD 4.22Å; Y180-M217 HydrophobicContact CE2-CE 4.34Å; F183-M217 HydrophobicContact CB-SD 4.42Å; S213-M217 WeakPolarHBondContact O-CG 3.46Å; S213-M217 PolarHBondContact O-N 3.02Å; M214-M217 WeakPolarHBondContact O-CB 3.29Å; M214-M217 PolarHBondContact O-N 2.82Å; M214-M217 VanDerWaalsContact O-N 3.16Å; M217-M220 PolarHBondContact O-N 3.43Å; M217-I221 VanDerWaalsContact O-CG1 3.31Å; M217-I221 WeakPolarHBondContact O-CG1 3.49Å; M217-I221 PolarHBondContact O-N 3.2Å |
| 218 | V | 97.9 | Very high | 95.6 | Very high | 3 Ų | 3 | 36.3 Ų | 36.3 | 2% | 0.018 | 19% | 0.185 | C | C | . | . | H | α-helix | trans | -66.5 | -44.7 | -179.3 | 175 | 0 | 0 | 0 | 0 | 111.2 | T152 V156 M214 Y216 M220 I221 A222 I332 F335 L336 | T152-V218 HydrophobicContact CG2-CB 3.98Å; T152-V218 HydrophobicContact CG2-CG1 3.8Å; T152-V218 HydrophobicContact CG2-CG2 4.47Å; V156-V218 HydrophobicContact CG2-CG1 3.82Å; M214-V218 HydrophobicContact CG-CG2 4.12Å; M214-V218 WeakPolarHBondContact O-CB 3.37Å; M214-V218 VanDerWaalsContact O-CG2 3.22Å; M214-V218 WeakPolarHBondContact O-CG2 3.48Å; M214-V218 PolarHBondContact O-N 2.73Å; Y216-V218 VanDerWaalsContact C-N 3.35Å; Y216-V218 PolarHBondContact O-N 3.12Å; V218-M220 VanDerWaalsContact C-N 3.33Å; V218-M220 PolarHBondContact O-N 2.88Å; V218-I221 PolarHBondContact O-N 3.36Å; V218-A222 WeakPolarHBondContact O-CB 3.31Å; V218-A222 PolarHBondContact O-N 2.89Å; V218-I332 HydrophobicContact CG2-CD1 4.37Å; V218-I332 HydrophobicContact CG2-CG2 3.38Å; V218-F335 HydrophobicContact CG1-CD1 3.64Å; V218-F335 HydrophobicContact CG1-CE1 3.57Å; V218-L336 HydrophobicContact CG1-CD2 4.21Å; V218-L336 HydrophobicContact CG2-CD1 4.31Å |
| 219 | G | 97.1 | Very high | 95.9 | Very high | 0 Ų | 0 | 34 Ų | 34 | 0% | 0 | 17% | 0.168 | C | C | . | . | H | α-helix | trans | -61.8 | -39.9 | 173.2 | 0 | 0 | 0 | 0 | 0 | 112.6 | S215 Y216 A222 S223 | S215-G219 PolarHBondContact O-N 3.09Å; Y216-G219 PolarHBondContact O-N 2.67Å; G219-A222 PolarHBondContact O-N 3.05Å; G219-S223 PolarHBondContact O-N 2.95Å |
| 220 | M | 96.4 | Very high | 96.1 | Very high | 12 Ų | 12 | 31 Ų | 31 | 6% | 0.059 | 15% | 0.153 | C | C | . | . | H | α-helix | trans | -64 | -43.2 | 178.4 | -161.9 | -61.4 | -56.4 | 0 | 0 | 110.3 | V169 Y176 Y216 M217 V218 S223 F224 | V169-M220 HydrophobicContact CB-CG 4.17Å; V169-M220 HydrophobicContact CG2-CG 4.37Å; Y176-M220 HydrophobicContact CD1-CE 4.44Å; Y176-M220 HydrophobicContact CD2-CB 4.38Å; Y176-M220 HydrophobicContact CD2-CE 3.37Å; Y176-M220 HydrophobicContact CD2-CG 4.39Å; Y176-M220 HydrophobicContact CE2-CE 3.93Å; Y176-M220 HydrophobicContact CG-CE 3.66Å; Y216-M220 HydrophobicContact CE1-CB 4.44Å; Y216-M220 HydrophobicContact CE1-CG 4.41Å; Y216-M220 VanDerWaalsContact O-CB 3.23Å; Y216-M220 WeakPolarHBondContact O-CB 3.43Å; Y216-M220 PolarHBondContact O-N 2.97Å; M217-M220 PolarHBondContact O-N 3.43Å; V218-M220 VanDerWaalsContact C-N 3.33Å; V218-M220 PolarHBondContact O-N 2.88Å; M220-S223 WeakPolarHBondContact O-CB 3.33Å; M220-S223 PolarHBondContact O-N 3.46Å; M220-S223 PolarHBondContact O-OG 3.45Å; M220-F224 HydrophobicContact CE-CD2 4.39Å; M220-F224 HydrophobicContact CE-CE2 3.93Å; M220-F224 HydrophobicContact SD-CD2 4.15Å; M220-F224 HydrophobicContact SD-CE2 3.5Å; M220-F224 WeakPolarHBondContact SD-CE2 3.39Å; M220-F224 HydrophobicContact SD-CZ 4.38Å |
| 221 | I | 96.3 | Very high | 96.2 | Very high | 40 Ų | 40 | 35.4 Ų | 35.4 | 21% | 0.205 | 18% | 0.175 | C | C | . | . | H | α-helix | trans | -62.9 | -47 | 173.1 | -65.3 | 161.3 | 0 | 0 | 0 | 110.7 | Y176 M217 V218 S223 F224 Y225 L336 L339 | Y176-I221 HydrophobicContact CE2-CD1 4.19Å; Y176-I221 HydrophobicContact CE2-CG1 4.22Å; M217-I221 VanDerWaalsContact O-CG1 3.31Å; M217-I221 WeakPolarHBondContact O-CG1 3.49Å; M217-I221 PolarHBondContact O-N 3.2Å; V218-I221 PolarHBondContact O-N 3.36Å; I221-S223 PolarHBondContact O-N 3.17Å; I221-F224 PolarHBondContact O-N 3.23Å; I221-F224 VanDerWaalsContact O-N 3.12Å; I221-Y225 HydrophobicContact CG2-CE2 4.01Å; I221-Y225 WeakPolarHBondContact O-CD2 3.24Å; I221-L336 HydrophobicContact CB-CD2 4.11Å; I221-L336 HydrophobicContact CD1-CD1 4.21Å; I221-L336 HydrophobicContact CD1-CD2 3.97Å; I221-L336 HydrophobicContact CG2-CD2 3.84Å; I221-L339 HydrophobicContact CG2-CD2 4.37Å |
| 222 | A | 96.8 | Very high | 96.3 | Very high | 0 Ų | 0 | 37.8 Ų | 37.8 | 0% | 0 | 19% | 0.187 | C | C | . | . | H | α-helix | trans | -58.6 | -33.3 | 177.1 | 0 | 0 | 0 | 0 | 0 | 113 | V156 V218 G219 F224 Y225 V230 L339 | V156-A222 HydrophobicContact CG1-CB 4.01Å; V156-A222 HydrophobicContact CG2-CB 4.39Å; V218-A222 WeakPolarHBondContact O-CB 3.31Å; V218-A222 PolarHBondContact O-N 2.89Å; G219-A222 PolarHBondContact O-N 3.05Å; A222-F224 PolarHBondContact O-N 3.31Å; A222-F224 VanDerWaalsContact O-N 3.13Å; A222-Y225 PolarHBondContact O-N 2.85Å; A222-V230 HydrophobicContact CB-CG1 4.38Å; A222-V230 HydrophobicContact CB-CG2 4.23Å; A222-L339 HydrophobicContact CB-CD2 4.35Å |
| 223 | S | 95.9 | Very high | 96.4 | Very high | 0 Ų | 0 | 34 Ų | 34 | 0% | 0 | 17% | 0.168 | C | C | . | . | T | Hydrogen-bonded Turn | trans | -59.7 | -22.7 | 177.3 | 86.7 | 0 | 0 | 0 | 0 | 113.9 | K166 Q170 G219 M220 I221 | K166-S223 WeakPolarHBondContact CE-O 3.4Å; Q170-S223 PolarHBondContact NE2-O 3.08Å; G219-S223 PolarHBondContact O-N 2.95Å; M220-S223 WeakPolarHBondContact O-CB 3.33Å; M220-S223 PolarHBondContact O-N 3.46Å; M220-S223 PolarHBondContact O-OG 3.45Å; I221-S223 PolarHBondContact O-N 3.17Å |
| 224 | F | 94.6 | Very high | 96.4 | Very high | 107 Ų | 107 | 36.2 Ų | 36.2 | 47% | 0.469 | 18% | 0.181 | S | C | . | . | T | Hydrogen-bonded Turn | trans | -82.9 | -9.2 | 175.9 | -75.7 | -66.6 | 0 | 0 | 0 | 114.1 | Q170 M220 I221 A222 | Q170-F224 HydrophobicContact CB-CE1 4.15Å; Q170-F224 HydrophobicContact CB-CZ 4.34Å; Q170-F224 HydrophobicContact CG-CD1 4.06Å; Q170-F224 HydrophobicContact CG-CE1 3.72Å; Q170-F224 HydrophobicContact CG-CZ 4.09Å; M220-F224 HydrophobicContact CE-CD2 4.39Å; M220-F224 HydrophobicContact CE-CE2 3.93Å; M220-F224 HydrophobicContact SD-CD2 4.15Å; M220-F224 HydrophobicContact SD-CE2 3.5Å; M220-F224 WeakPolarHBondContact SD-CE2 3.39Å; M220-F224 HydrophobicContact SD-CZ 4.38Å; I221-F224 PolarHBondContact O-N 3.23Å; I221-F224 VanDerWaalsContact O-N 3.12Å; A222-F224 PolarHBondContact O-N 3.31Å; A222-F224 VanDerWaalsContact O-N 3.13Å |
| 225 | Y | 94.9 | Very high | 96.4 | Very high | 48 Ų | 48 | 37.2 Ų | 37.2 | 19% | 0.188 | 20% | 0.195 | C | C | . | . | S | Bend | trans | -98.8 | 164.6 | 177.6 | -65.7 | -92.2 | 0 | 0 | 0 | 111.8 | K166 I221 A222 T229 L339 | K166-Y225 PolarHBondContact NZ-O 3.42Å; I221-Y225 HydrophobicContact CG2-CE2 4.01Å; I221-Y225 WeakPolarHBondContact O-CD2 3.24Å; A222-Y225 PolarHBondContact O-N 2.85Å; Y225-T229 HydrophobicContact CD1-CG2 3.96Å; Y225-T229 HydrophobicContact CG-CG2 4.43Å; Y225-L339 HydrophobicContact CD1-CD1 4.37Å; Y225-L339 HydrophobicContact CD1-CG 4.28Å; Y225-L339 HydrophobicContact CD2-CD1 4.07Å; Y225-L339 HydrophobicContact CD2-CD2 3.59Å; Y225-L339 HydrophobicContact CD2-CG 3.72Å; Y225-L339 HydrophobicContact CE1-CG 4.32Å; Y225-L339 HydrophobicContact CE2-CD2 3.62Å; Y225-L339 HydrophobicContact CE2-CG 3.76Å; Y225-L339 HydrophobicContact CG-CD1 3.94Å; Y225-L339 HydrophobicContact CG-CD2 4.31Å; Y225-L339 HydrophobicContact CG-CG 3.98Å |
| 226 | N | 94.2 | Very high | 96.4 | Very high | 119 Ų | 119 | 40.7 Ų | 40.7 | 64% | 0.636 | 21% | 0.213 | S | C | * | . | trans | -71.9 | 142.8 | 171.7 | -69.8 | -45.7 | 0 | 0 | 0 | 110.4 | E228 T229 V230 | N226-E228 PolarHBondContact O-N 3.37Å; N226-T229 WeakPolarHBondContact O-CA 3.31Å; N226-T229 VanDerWaalsContact O-CB 3.25Å; N226-T229 WeakPolarHBondContact O-CB 3.38Å; N226-T229 PolarHBondContact O-N 2.93Å; N226-V230 PolarHBondContact O-N 3.33Å | ||
| 227 | T | 95.1 | Very high | 96.4 | Very high | 44 Ų | 44 | 39.4 Ų | 39.4 | 27% | 0.27 | 21% | 0.209 | S | C | . | . | H | α-helix | trans | -56.7 | -36.9 | -176 | -59 | 0 | 0 | 0 | 0 | 112.8 | T160 F161 V230 I231 | T160-T227 HydrophobicContact CG2-CG2 3.67Å; T160-T227 PolarHBondContact O-OG1 2.82Å; T160-T227 VanDerWaalsContact O-OG1 3.1Å; F161-T227 HydrophobicContact CD1-CG2 3.87Å; F161-T227 HydrophobicContact CE1-CG2 3.46Å; F161-T227 VanDerWaalsContact CE1-CG2 3.46Å; F161-T227 HydrophobicContact CZ-CG2 4.2Å; T227-V230 PolarHBondContact O-N 3.41Å; T227-I231 HydrophobicContact CG2-CD1 3.88Å; T227-I231 WeakPolarHBondContact O-CD1 3.37Å; T227-I231 VanDerWaalsContact O-CG1 3.27Å; T227-I231 WeakPolarHBondContact O-CG1 3.49Å; T227-I231 PolarHBondContact O-N 3.38Å |
| 228 | E | 95.3 | Very high | 96.4 | Very high | 106 Ų | 106 | 42.7 Ų | 42.7 | 50% | 0.495 | 23% | 0.23 | S | C | . | . | H | α-helix | trans | -63.8 | -43.5 | 174 | -158.2 | -157.1 | 136.9 | 0 | 0 | 112.5 | N226 V230 I231 I232 R346 | N226-E228 PolarHBondContact O-N 3.37Å; E228-V230 VanDerWaalsContact C-N 3.33Å; E228-V230 PolarHBondContact O-N 2.87Å; E228-I231 PolarHBondContact O-N 3.4Å; E228-I232 HydrophobicContact CG-CD1 4.12Å; E228-I232 WeakPolarHBondContact O-CB 3.33Å; E228-I232 VanDerWaalsContact O-CG1 3.29Å; E228-I232 WeakPolarHBondContact O-CG1 3.42Å; E228-I232 PolarHBondContact O-N 3.47Å; E228-R346 VanDerWaalsContact CD-NH1 3.29Å; E228-R346 IonicContact OE1-CZ 2.97Å; E228-R346 VanDerWaalsContact OE1-CZ 3.32Å; E228-R346 IonicContact OE1-NH1 3.69Å; E228-R346 PolarHBondContact OE1-NH1 3.39Å; E228-R346 IonicContact OE1-NH2 2.7Å; E228-R346 PolarHBondContact OE1-NH2 2.91Å; E228-R346 IonicContact OE2-CZ 3.31Å; E228-R346 IonicContact OE2-NH1 3.9Å; E228-R346 IonicContact OE2-NH2 2.76Å; E228-R346 PolarHBondContact OE2-NH2 3.23Å |
| 229 | T | 96.3 | Very high | 96.4 | Very high | 3 Ų | 3 | 47 Ų | 47 | 2% | 0.018 | 26% | 0.256 | C | S | . | . | H | α-helix | trans | -58.9 | -43.4 | 174.1 | -61.9 | 0 | 0 | 0 | 0 | 111.4 | Y225 N226 A233 L339 V342 | Y225-T229 HydrophobicContact CD1-CG2 3.96Å; Y225-T229 HydrophobicContact CG-CG2 4.43Å; N226-T229 WeakPolarHBondContact O-CA 3.31Å; N226-T229 VanDerWaalsContact O-CB 3.25Å; N226-T229 WeakPolarHBondContact O-CB 3.38Å; N226-T229 PolarHBondContact O-N 2.93Å; T229-A233 VanDerWaalsContact O-CB 3.28Å; T229-A233 WeakPolarHBondContact O-CB 3.48Å; T229-A233 PolarHBondContact O-N 3.06Å; T229-L339 HydrophobicContact CG2-CD1 4.14Å; T229-V342 HydrophobicContact CG2-CB 4.12Å; T229-V342 HydrophobicContact CG2-CG1 3.97Å |
| 230 | V | 97.2 | Very high | 96.4 | Very high | 4 Ų | 4 | 48.9 Ų | 48.9 | 2% | 0.024 | 27% | 0.268 | C | S | . | . | H | α-helix | trans | -63.8 | -47.5 | 177.6 | 178.4 | 0 | 0 | 0 | 0 | 111.1 | V156 T160 A222 N226 T227 E228 I232 A233 V234 F335 L339 | V156-V230 HydrophobicContact CG1-CG1 3.68Å; T160-V230 HydrophobicContact CG2-CB 4.02Å; T160-V230 HydrophobicContact CG2-CG1 4.09Å; T160-V230 HydrophobicContact CG2-CG2 4.15Å; A222-V230 HydrophobicContact CB-CG1 4.38Å; A222-V230 HydrophobicContact CB-CG2 4.23Å; N226-V230 PolarHBondContact O-N 3.33Å; T227-V230 PolarHBondContact O-N 3.41Å; E228-V230 VanDerWaalsContact C-N 3.33Å; E228-V230 PolarHBondContact O-N 2.87Å; V230-I232 PolarHBondContact O-N 3.1Å; V230-A233 PolarHBondContact O-N 2.83Å; V230-V234 WeakPolarHBondContact O-CG2 3.48Å; V230-V234 PolarHBondContact O-N 2.9Å; V230-F335 HydrophobicContact CG1-CZ 4.43Å; V230-L339 HydrophobicContact CB-CD1 4.39Å; V230-L339 HydrophobicContact CG2-CD1 3.93Å |
| 231 | I | 96.5 | Very high | 96.4 | Very high | 91 Ų | 91 | 48.9 Ų | 48.9 | 47% | 0.467 | 27% | 0.268 | S | S | . | . | H | α-helix | trans | -61.3 | -45.3 | 179.8 | -68.4 | 163.1 | 0 | 0 | 0 | 111.2 | F161 T227 E228 A233 V234 G235 | F161-I231 HydrophobicContact CE1-CD1 4.15Å; F161-I231 HydrophobicContact CZ-CD1 3.97Å; F161-I231 HydrophobicContact CZ-CG1 4.24Å; T227-I231 HydrophobicContact CG2-CD1 3.88Å; T227-I231 WeakPolarHBondContact O-CD1 3.37Å; T227-I231 VanDerWaalsContact O-CG1 3.27Å; T227-I231 WeakPolarHBondContact O-CG1 3.49Å; T227-I231 PolarHBondContact O-N 3.38Å; E228-I231 PolarHBondContact O-N 3.4Å; I231-A233 PolarHBondContact O-N 3.49Å; I231-V234 PolarHBondContact O-N 3.35Å; I231-G235 PolarHBondContact O-N 2.92Å |
| 232 | I | 97.1 | Very high | 96.3 | Very high | 59 Ų | 59 | 53.3 Ų | 53.3 | 30% | 0.303 | 29% | 0.287 | S | S | . | . | H | α-helix | trans | -62.2 | -43.9 | 176.5 | -68.2 | 164.9 | 0 | 0 | 0 | 110.5 | E228 V230 G235 I236 V342 | E228-I232 HydrophobicContact CG-CD1 4.12Å; E228-I232 WeakPolarHBondContact O-CB 3.33Å; E228-I232 VanDerWaalsContact O-CG1 3.29Å; E228-I232 WeakPolarHBondContact O-CG1 3.42Å; E228-I232 PolarHBondContact O-N 3.47Å; V230-I232 PolarHBondContact O-N 3.1Å; I232-G235 PolarHBondContact O-N 3.43Å; I232-I236 HydrophobicContact CG2-CD1 3.7Å; I232-I236 HydrophobicContact CG2-CG1 4.32Å; I232-I236 WeakPolarHBondContact O-CG1 3.32Å; I232-I236 PolarHBondContact O-N 3.42Å; I232-V342 HydrophobicContact CB-CG1 4.11Å; I232-V342 HydrophobicContact CG2-CG1 3.76Å; I232-V342 HydrophobicContact CG2-CG2 4.14Å |
| 233 | A | 97.2 | Very high | 96.2 | Very high | 0 Ų | 0 | 57.3 Ų | 57.3 | 0% | 0 | 31% | 0.311 | C | S | . | . | H | α-helix | trans | -64 | -41.3 | 179.4 | 0 | 0 | 0 | 0 | 0 | 112.8 | T229 V230 I231 T237 F335 I338 L339 | T229-A233 VanDerWaalsContact O-CB 3.28Å; T229-A233 WeakPolarHBondContact O-CB 3.48Å; T229-A233 PolarHBondContact O-N 3.06Å; V230-A233 PolarHBondContact O-N 2.83Å; I231-A233 PolarHBondContact O-N 3.49Å; A233-T237 VanDerWaalsContact O-CB 3.31Å; A233-T237 WeakPolarHBondContact O-CB 3.41Å; A233-T237 PolarHBondContact O-N 3.44Å; A233-T237 PolarHBondContact O-OG1 2.94Å; A233-F335 HydrophobicContact CB-CD2 4.37Å; A233-F335 HydrophobicContact CB-CE2 3.94Å; A233-I338 HydrophobicContact CB-CG2 3.99Å; A233-L339 HydrophobicContact CB-CB 3.93Å; A233-L339 HydrophobicContact CB-CD1 3.82Å |
| 234 | V | 96.9 | Very high | 96 | Very high | 54 Ų | 54 | 58.1 Ų | 58.1 | 33% | 0.327 | 32% | 0.316 | S | S | . | . | H | α-helix | trans | -58.8 | -49.8 | 171.8 | 172 | 0 | 0 | 0 | 0 | 110.2 | V230 I231 I236 T237 T238 F335 | V230-V234 WeakPolarHBondContact O-CG2 3.48Å; V230-V234 PolarHBondContact O-N 2.9Å; I231-V234 PolarHBondContact O-N 3.35Å; V234-I236 PolarHBondContact O-N 3.45Å; V234-T237 WeakPolarHBondContact O-CB 3.35Å; V234-T237 PolarHBondContact O-N 2.87Å; V234-T238 PolarHBondContact O-N 3.19Å; V234-T238 PolarHBondContact O-OG1 3.19Å; V234-T238 VanDerWaalsContact O-OG1 3.08Å; V234-F335 HydrophobicContact CG2-CD2 4.25Å; V234-F335 HydrophobicContact CG2-CE2 3.59Å; V234-F335 HydrophobicContact CG2-CZ 4.25Å |
| 235 | G | 97.3 | Very high | 95.9 | Very high | 37 Ų | 37 | 54.3 Ų | 54.3 | 38% | 0.381 | 30% | 0.301 | S | S | . | . | H | α-helix | trans | -58.3 | -48.8 | -179.3 | 0 | 0 | 0 | 0 | 0 | 113.6 | I231 I232 T237 T238 V239 | I231-G235 PolarHBondContact O-N 2.92Å; I232-G235 PolarHBondContact O-N 3.43Å; G235-T237 PolarHBondContact O-N 2.89Å; G235-T238 PolarHBondContact O-N 3.4Å; G235-V239 WeakPolarHBondContact O-CG2 3.43Å; G235-V239 PolarHBondContact O-N 2.96Å; G235-V239 VanDerWaalsContact O-N 3.12Å |
| 236 | I | 97.6 | Very high | 95.7 | Very high | 73 Ų | 73 | 55.9 Ų | 55.9 | 37% | 0.374 | 31% | 0.313 | S | S | . | . | H | α-helix | trans | -63.7 | -42.3 | 177.3 | -59.7 | 167.5 | 0 | 0 | 0 | 110.2 | I232 V234 T238 V239 V240 I338 V342 | I232-I236 HydrophobicContact CG2-CD1 3.7Å; I232-I236 HydrophobicContact CG2-CG1 4.32Å; I232-I236 WeakPolarHBondContact O-CG1 3.32Å; I232-I236 PolarHBondContact O-N 3.42Å; V234-I236 PolarHBondContact O-N 3.45Å; I236-T238 PolarHBondContact O-N 3.26Å; I236-V239 PolarHBondContact O-N 3.04Å; I236-V240 HydrophobicContact CG2-CG2 4.16Å; I236-V240 WeakPolarHBondContact O-CG2 3.43Å; I236-V240 PolarHBondContact O-N 3.37Å; I236-I338 HydrophobicContact CB-CG2 3.95Å; I236-I338 HydrophobicContact CD1-CG2 4.33Å; I236-I338 HydrophobicContact CG2-CD1 3.97Å; I236-I338 HydrophobicContact CG2-CG2 4.1Å; I236-V342 HydrophobicContact CD1-CG2 3.99Å |
| 237 | T | 97.5 | Very high | 95.4 | Very high | 9 Ų | 9 | 54 Ų | 54 | 6% | 0.055 | 30% | 0.299 | C | S | . | . | H | α-helix | trans | -58.4 | -47 | 176.9 | -57.2 | 0 | 0 | 0 | 0 | 111.5 | A233 V234 G235 V239 V240 C241 I331 I334 F335 | A233-T237 VanDerWaalsContact O-CB 3.31Å; A233-T237 WeakPolarHBondContact O-CB 3.41Å; A233-T237 PolarHBondContact O-N 3.44Å; A233-T237 PolarHBondContact O-OG1 2.94Å; V234-T237 WeakPolarHBondContact O-CB 3.35Å; V234-T237 PolarHBondContact O-N 2.87Å; G235-T237 PolarHBondContact O-N 2.89Å; T237-V239 VanDerWaalsContact C-N 3.34Å; T237-V239 PolarHBondContact O-N 2.86Å; T237-V240 PolarHBondContact O-N 2.8Å; T237-C241 WeakPolarHBondContact O-CB 3.11Å; T237-C241 PolarHBondContact O-N 2.86Å; T237-C241 PolarHBondContact O-SG 2.69Å; T237-I331 HydrophobicContact CG2-CG2 4.32Å; T237-I334 HydrophobicContact CG2-CG2 4.15Å; T237-F335 HydrophobicContact CG2-CB 3.99Å; T237-F335 WeakPolarHBondContact OG1-CA 3.38Å |
| 238 | T | 96.6 | Very high | 95.1 | Very high | 88 Ų | 88 | 52.1 Ų | 52.1 | 54% | 0.54 | 29% | 0.288 | S | S | . | . | H | α-helix | trans | -59.2 | -45.1 | 178 | -57.9 | 0 | 0 | 0 | 0 | 111.4 | V234 G235 I236 F242 | V234-T238 PolarHBondContact O-N 3.19Å; V234-T238 PolarHBondContact O-OG1 3.19Å; V234-T238 VanDerWaalsContact O-OG1 3.08Å; G235-T238 PolarHBondContact O-N 3.4Å; I236-T238 PolarHBondContact O-N 3.26Å; T238-F242 WeakPolarHBondContact O-CB 3.48Å; T238-F242 PolarHBondContact O-N 3.12Å |
| 239 | V | 97.7 | Very high | 94.5 | Very high | 94 Ų | 94 | 51.8 Ų | 51.8 | 57% | 0.57 | 29% | 0.289 | S | S | * | . | H | α-helix | trans | -64.3 | -47.3 | 178.2 | 173.2 | 0 | 0 | 0 | 0 | 111.5 | G235 I236 T237 T243 | G235-V239 WeakPolarHBondContact O-CG2 3.43Å; G235-V239 PolarHBondContact O-N 2.96Å; G235-V239 VanDerWaalsContact O-N 3.12Å; I236-V239 PolarHBondContact O-N 3.04Å; T237-V239 VanDerWaalsContact C-N 3.34Å; T237-V239 PolarHBondContact O-N 2.86Å; V239-T243 VanDerWaalsContact O-CB 3.25Å; V239-T243 WeakPolarHBondContact O-CB 3.21Å; V239-T243 PolarHBondContact O-N 3.27Å; V239-T243 PolarHBondContact O-OG1 3.34Å |
| 240 | V | 96.8 | Very high | 93.8 | Very high | 39 Ų | 39 | 56.5 Ų | 56.5 | 24% | 0.236 | 31% | 0.31 | C | S | . | . | H | α-helix | trans | -60.2 | -53.6 | 178.3 | 170.2 | 0 | 0 | 0 | 0 | 110.8 | I236 T237 F242 T243 V244 T297 I334 I338 | I236-V240 HydrophobicContact CG2-CG2 4.16Å; I236-V240 WeakPolarHBondContact O-CG2 3.43Å; I236-V240 PolarHBondContact O-N 3.37Å; T237-V240 PolarHBondContact O-N 2.8Å; V240-F242 PolarHBondContact O-N 3.19Å; V240-T243 PolarHBondContact O-N 2.73Å; V240-V244 HydrophobicContact CG1-CG2 4.4Å; V240-V244 WeakPolarHBondContact O-CB 3.17Å; V240-V244 WeakPolarHBondContact O-CG2 3.48Å; V240-V244 PolarHBondContact O-N 3.1Å; V240-T297 HydrophobicContact CG1-CG2 3.98Å; V240-I334 HydrophobicContact CG1-CG2 4.28Å; V240-I338 HydrophobicContact CG2-CD1 4.47Å |
| 241 | C | 95.8 | Very high | 92.1 | Very high | 11 Ų | 11 | 62.2 Ų | 62.2 | 7% | 0.074 | 35% | 0.351 | C | S | . | . | H | α-helix | trans | -64.9 | -40.6 | -175.7 | -60.5 | 0 | 0 | 0 | 0 | 112 | T237 V244 V245 L300 I331 | T237-C241 WeakPolarHBondContact O-CB 3.11Å; T237-C241 PolarHBondContact O-N 2.86Å; T237-C241 PolarHBondContact O-SG 2.69Å; C241-V244 PolarHBondContact O-N 3.12Å; C241-V245 WeakPolarHBondContact O-CB 3.21Å; C241-V245 VanDerWaalsContact O-CG2 3.31Å; C241-V245 WeakPolarHBondContact O-CG2 3.48Å; C241-V245 PolarHBondContact O-N 2.98Å; C241-L300 HydrophobicContact CB-CD2 3.82Å; C241-I331 HydrophobicContact CB-CG1 4.23Å |
| 242 | F | 94.5 | Very high | 90.9 | Very high | 134 Ų | 134 | 66.2 Ų | 66.2 | 59% | 0.588 | 36% | 0.364 | S | S | * | . | H | α-helix | trans | -66.6 | -42.1 | 176.7 | -171.8 | -111 | 0 | 0 | 0 | 112 | T238 V240 V244 V245 L246 | T238-F242 WeakPolarHBondContact O-CB 3.48Å; T238-F242 PolarHBondContact O-N 3.12Å; V240-F242 PolarHBondContact O-N 3.19Å; F242-V244 VanDerWaalsContact C-N 3.34Å; F242-V244 PolarHBondContact O-N 3.01Å; F242-V245 PolarHBondContact O-N 2.87Å; F242-L246 HydrophobicContact CD1-CD1 3.88Å; F242-L246 HydrophobicContact CD1-CG 4.4Å; F242-L246 HydrophobicContact CE1-CD1 3.41Å; F242-L246 VanDerWaalsContact CE1-CD1 3.41Å; F242-L246 HydrophobicContact CE1-CG 4.14Å; F242-L246 HydrophobicContact CE2-CD1 4.46Å; F242-L246 HydrophobicContact CE2-CG 4.39Å; F242-L246 HydrophobicContact CZ-CD1 3.75Å; F242-L246 HydrophobicContact CZ-CD2 4.37Å; F242-L246 HydrophobicContact CZ-CG 4.14Å; F242-L246 WeakPolarHBondContact O-CB 3.33Å; F242-L246 WeakPolarHBondContact O-CG 3.38Å; F242-L246 PolarHBondContact O-N 3.31Å |
| 243 | T | 94.7 | Very high | 89.5 | Confident | 83 Ų | 83 | 70.6 Ų | 70.6 | 51% | 0.509 | 38% | 0.378 | S | S | . | . | H | α-helix | trans | -60.6 | -44.4 | 175.8 | -58.8 | 0 | 0 | 0 | 0 | 111.1 | V239 V240 L246 F247 | V239-T243 VanDerWaalsContact O-CB 3.25Å; V239-T243 WeakPolarHBondContact O-CB 3.21Å; V239-T243 PolarHBondContact O-N 3.27Å; V239-T243 PolarHBondContact O-OG1 3.34Å; V240-T243 PolarHBondContact O-N 2.73Å; T243-L246 PolarHBondContact O-N 2.96Å; T243-F247 VanDerWaalsContact O-CB 3.27Å; T243-F247 WeakPolarHBondContact O-CB 3.49Å; T243-F247 PolarHBondContact O-N 3.43Å |
| 244 | V | 93.4 | Very high | 88.5 | Confident | 18 Ų | 18 | 74.8 Ų | 74.8 | 11% | 0.109 | 40% | 0.401 | C | S | . | . | H | α-helix | trans | -67.4 | -44.8 | 179.8 | 171.1 | 0 | 0 | 0 | 0 | 111.9 | V240 C241 F242 L246 F247 S248 T297 L300 A301 | V240-V244 HydrophobicContact CG1-CG2 4.4Å; V240-V244 WeakPolarHBondContact O-CB 3.17Å; V240-V244 WeakPolarHBondContact O-CG2 3.48Å; V240-V244 PolarHBondContact O-N 3.1Å; C241-V244 PolarHBondContact O-N 3.12Å; F242-V244 VanDerWaalsContact C-N 3.34Å; F242-V244 PolarHBondContact O-N 3.01Å; V244-L246 PolarHBondContact O-N 3.31Å; V244-F247 PolarHBondContact O-N 3.22Å; V244-F247 VanDerWaalsContact O-N 3.17Å; V244-S248 WeakPolarHBondContact O-CB 3.49Å; V244-S248 PolarHBondContact O-N 3.36Å; V244-S248 PolarHBondContact O-OG 2.88Å; V244-T297 HydrophobicContact CG2-CG2 3.49Å; V244-T297 VanDerWaalsContact CG2-CG2 3.49Å; V244-L300 HydrophobicContact CB-CD2 4.3Å; V244-L300 HydrophobicContact CG1-CB 4.29Å; V244-L300 HydrophobicContact CG1-CD2 4.11Å; V244-L300 HydrophobicContact CG1-CG 3.99Å; V244-A301 HydrophobicContact CG1-CB 3.71Å |
| 245 | V | 91.5 | Very high | 87.5 | Confident | 26 Ų | 26 | 75.2 Ų | 75.2 | 16% | 0.158 | 40% | 0.398 | C | S | . | . | H | α-helix | trans | -63.1 | -42.7 | 176.4 | 170.1 | 0 | 0 | 0 | 0 | 111.1 | F142 C241 F242 F247 S248 L249 T304 | F142-V245 HydrophobicContact CE1-CG1 4.07Å; F142-V245 HydrophobicContact CZ-CG1 3.98Å; C241-V245 WeakPolarHBondContact O-CB 3.21Å; C241-V245 VanDerWaalsContact O-CG2 3.31Å; C241-V245 WeakPolarHBondContact O-CG2 3.48Å; C241-V245 PolarHBondContact O-N 2.98Å; F242-V245 PolarHBondContact O-N 2.87Å; V245-F247 VanDerWaalsContact C-N 3.29Å; V245-F247 PolarHBondContact O-N 3.49Å; V245-S248 PolarHBondContact O-N 3.24Å; V245-L249 WeakPolarHBondContact O-CG 3.21Å; V245-L249 PolarHBondContact O-N 3.35Å; V245-L249 VanDerWaalsContact O-N 3.12Å; V245-T304 HydrophobicContact CG1-CG2 4.37Å |
| 246 | L | 90.5 | Very high | 86.5 | Confident | 82 Ų | 82 | 75.4 Ų | 75.4 | 43% | 0.429 | 39% | 0.392 | S | S | . | . | H | α-helix | trans | -64.2 | -31.5 | 174 | -74.1 | -173.4 | 0 | 0 | 0 | 113.5 | F242 T243 V244 L249 | F242-L246 HydrophobicContact CD1-CD1 3.88Å; F242-L246 HydrophobicContact CD1-CG 4.4Å; F242-L246 HydrophobicContact CE1-CD1 3.41Å; F242-L246 VanDerWaalsContact CE1-CD1 3.41Å; F242-L246 HydrophobicContact CE1-CG 4.14Å; F242-L246 HydrophobicContact CE2-CD1 4.46Å; F242-L246 HydrophobicContact CE2-CG 4.39Å; F242-L246 HydrophobicContact CZ-CD1 3.75Å; F242-L246 HydrophobicContact CZ-CD2 4.37Å; F242-L246 HydrophobicContact CZ-CG 4.14Å; F242-L246 WeakPolarHBondContact O-CB 3.33Å; F242-L246 WeakPolarHBondContact O-CG 3.38Å; F242-L246 PolarHBondContact O-N 3.31Å; T243-L246 PolarHBondContact O-N 2.96Å; V244-L246 PolarHBondContact O-N 3.31Å; L246-L249 HydrophobicContact CD2-CD1 4.17Å |
| 247 | F | 88.9 | Confident | 85.7 | Confident | 80 Ų | 80 | 76.9 Ų | 76.9 | 35% | 0.351 | 41% | 0.409 | S | S | . | . | H | α-helix | trans | -76 | -42 | 176.1 | -176.9 | -122.5 | 0 | 0 | 0 | 111.7 | T243 V244 V245 L249 Q250 Y253 F255 | T243-F247 VanDerWaalsContact O-CB 3.27Å; T243-F247 WeakPolarHBondContact O-CB 3.49Å; T243-F247 PolarHBondContact O-N 3.43Å; V244-F247 PolarHBondContact O-N 3.22Å; V244-F247 VanDerWaalsContact O-N 3.17Å; V245-F247 VanDerWaalsContact C-N 3.29Å; V245-F247 PolarHBondContact O-N 3.49Å; F247-L249 VanDerWaalsContact C-N 3.26Å; F247-L249 PolarHBondContact O-N 3.48Å; F247-Q250 WeakPolarHBondContact O-CA 3.46Å; F247-Q250 VanDerWaalsContact O-CB 3.28Å; F247-Q250 WeakPolarHBondContact O-CB 3.2Å; F247-Q250 PolarHBondContact O-N 3.27Å; F247-Y253 HydrophobicContact CE2-CD2 4.25Å; F247-Y253 HydrophobicContact CZ-CD2 4.11Å; F247-F255 HydrophobicContact CD1-CE2 4.21Å; F247-F255 AromaticContact CE1-CE2 3.49Å; F247-F255 HydrophobicContact CE1-CE2 3.49Å; F247-F255 VanDerWaalsContact CE1-CE2 3.49Å; F247-F255 AromaticContact CE1-CZ 3.56Å; F247-F255 HydrophobicContact CE1-CZ 3.56Å; F247-F255 HydrophobicContact CZ-CE2 4.13Å; F247-F255 HydrophobicContact CZ-CZ 4.13Å |
| 248 | S | 87.1 | Confident | 85.1 | Confident | 4 Ų | 4 | 78.3 Ų | 78.3 | 3% | 0.028 | 42% | 0.419 | C | S | . | . | H | α-helix | trans | -65.4 | -24 | 175.8 | -77.1 | 0 | 0 | 0 | 0 | 114.2 | V244 V245 Q250 A301 | V244-S248 WeakPolarHBondContact O-CB 3.49Å; V244-S248 PolarHBondContact O-N 3.36Å; V244-S248 PolarHBondContact O-OG 2.88Å; V245-S248 PolarHBondContact O-N 3.24Å; S248-Q250 PolarHBondContact O-N 3.26Å; S248-A301 WeakPolarHBondContact OG-CA 3.19Å; S248-A301 PolarHBondContact OG-O 3.2Å |
| 249 | L | 82.6 | Confident | 84.6 | Confident | 99 Ų | 99 | 80.2 Ų | 80.2 | 52% | 0.518 | 42% | 0.416 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -62.8 | -18.3 | 167.4 | -74.9 | 168.3 | 0 | 0 | 0 | 113 | V245 L246 F247 S251 L308 | V245-L249 WeakPolarHBondContact O-CG 3.21Å; V245-L249 PolarHBondContact O-N 3.35Å; V245-L249 VanDerWaalsContact O-N 3.12Å; L246-L249 HydrophobicContact CD2-CD1 4.17Å; F247-L249 VanDerWaalsContact C-N 3.26Å; F247-L249 PolarHBondContact O-N 3.48Å; L249-S251 PolarHBondContact O-N 3.45Å; L249-L308 HydrophobicContact CD2-CD1 3.68Å; L249-L308 HydrophobicContact CD2-CD2 3.74Å; L249-L308 HydrophobicContact CD2-CG 4.38Å; L249-L308 HydrophobicContact CG-CD1 4.22Å |
| 250 | Q | 82.1 | Confident | 84.2 | Confident | 102 Ų | 102 | 78.3 Ų | 78.3 | 48% | 0.477 | 42% | 0.415 | S | S | . | . | trans | -91 | 98.7 | 178.4 | -56.7 | -178.5 | 54.5 | 0 | 0 | 110.9 | F247 S248 K252 | F247-Q250 WeakPolarHBondContact O-CA 3.46Å; F247-Q250 VanDerWaalsContact O-CB 3.28Å; F247-Q250 WeakPolarHBondContact O-CB 3.2Å; F247-Q250 PolarHBondContact O-N 3.27Å; S248-Q250 PolarHBondContact O-N 3.26Å; Q250-K252 PolarHBondContact O-N 3.48Å | ||
| 251 | S | 62.8 | Low | 84 | Confident | 124 Ų | 124 | 80.8 Ų | 80.8 | 87% | 0.867 | 43% | 0.43 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -65 | 22 | -179.9 | -169.6 | 0 | 0 | 0 | 0 | 115.9 | L249 | L249-S251 PolarHBondContact O-N 3.45Š|
| 252 | K | 69.5 | Low | 83.8 | Confident | 174 Ų | 174 | 80.9 Ų | 80.9 | 76% | 0.757 | 43% | 0.43 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -87 | -23.2 | 179.1 | -71 | -175.4 | 176.9 | 178.9 | 0 | 113.9 | Q250 | Q250-K252 PolarHBondContact O-N 3.48Š|
| 253 | Y | 69.6 | Low | 83.8 | Confident | 152 Ų | 152 | 80.5 Ų | 80.5 | 60% | 0.596 | 43% | 0.428 | S | S | * | . | S | Bend | trans | -128.7 | 114.2 | 178.7 | -63.4 | -80 | 0 | 0 | 0 | 108.4 | F247 Q305 | F247-Y253 HydrophobicContact CE2-CD2 4.25Å; F247-Y253 HydrophobicContact CZ-CD2 4.11Å; Y253-Q305 PolarHBondContact O-NE2 3.38Å |
| 254 | D | 76.1 | Confident | 83.8 | Confident | 88 Ų | 88 | 80.7 Ų | 80.7 | 47% | 0.471 | 43% | 0.429 | S | S | . | . | trans | -87.3 | 108.6 | 176.5 | 178.1 | 49.6 | 0 | 0 | 0 | 110.9 | T256 S257 | D254-T256 WeakPolarHBondContact OD1-CA 3.22Å; D254-T256 WeakPolarHBondContact OD1-CB 3.41Å; D254-T256 PolarHBondContact OD1-N 3.44Å; D254-T256 PolarHBondContact OD1-OG1 3.47Å; D254-S257 VanDerWaalsContact OD2-CB 3.28Å; D254-S257 WeakPolarHBondContact OD2-CB 3.4Å; D254-S257 PolarHBondContact OD2-N 3.01Å; D254-S257 PolarHBondContact OD2-OG 2.87Å | ||
| 255 | F | 74.3 | Confident | 83.9 | Confident | 63 Ų | 63 | 82.4 Ų | 82.4 | 28% | 0.276 | 44% | 0.441 | S | S | . | . | trans | -84.2 | -16.9 | 169.7 | -63.4 | -83.2 | 0 | 0 | 0 | 111.5 | F247 S257 C258 V302 | F247-F255 HydrophobicContact CD1-CE2 4.21Å; F247-F255 AromaticContact CE1-CE2 3.49Å; F247-F255 HydrophobicContact CE1-CE2 3.49Å; F247-F255 VanDerWaalsContact CE1-CE2 3.49Å; F247-F255 AromaticContact CE1-CZ 3.56Å; F247-F255 HydrophobicContact CE1-CZ 3.56Å; F247-F255 HydrophobicContact CZ-CE2 4.13Å; F247-F255 HydrophobicContact CZ-CZ 4.13Å; F255-S257 PolarHBondContact O-N 2.88Å; F255-S257 VanDerWaalsContact O-N 3.15Å; F255-C258 PolarHBondContact O-N 2.87Å; F255-C258 PolarHBondContact O-SG 3.33Å; F255-V302 HydrophobicContact CB-CG2 3.6Å; F255-V302 VanDerWaalsContact O-CG2 3.31Å; F255-V302 WeakPolarHBondContact O-CG2 3.46Å | ||
| 256 | T | 77.1 | Confident | 84.1 | Confident | 40 Ų | 40 | 83.7 Ų | 83.7 | 25% | 0.245 | 45% | 0.447 | C | S | . | . | G | 310 helix | trans | -55.6 | -36 | 178 | -37.8 | 0 | 0 | 0 | 0 | 111.8 | D254 C258 R259 L306 | D254-T256 WeakPolarHBondContact OD1-CA 3.22Å; D254-T256 WeakPolarHBondContact OD1-CB 3.41Å; D254-T256 PolarHBondContact OD1-N 3.44Å; D254-T256 PolarHBondContact OD1-OG1 3.47Å; T256-C258 VanDerWaalsContact C-N 3.26Å; T256-C258 PolarHBondContact O-N 2.76Å; T256-R259 WeakPolarHBondContact O-CB 3.34Å; T256-R259 WeakPolarHBondContact O-CD 3.34Å; T256-R259 WeakPolarHBondContact O-CG 3.21Å; T256-R259 PolarHBondContact O-N 2.9Å; T256-L306 HydrophobicContact CG2-CD2 3.46Å; T256-L306 VanDerWaalsContact CG2-CD2 3.46Å; T256-L306 HydrophobicContact CG2-CG 4.04Å |
| 257 | S | 80.6 | Confident | 84.3 | Confident | 104 Ų | 104 | 83.6 Ų | 83.6 | 73% | 0.727 | 45% | 0.446 | S | S | * | . | G | 310 helix | trans | -60.4 | -25 | 174 | -67.9 | 0 | 0 | 0 | 0 | 114.7 | D254 F255 | D254-S257 VanDerWaalsContact OD2-CB 3.28Å; D254-S257 WeakPolarHBondContact OD2-CB 3.4Å; D254-S257 PolarHBondContact OD2-N 3.01Å; D254-S257 PolarHBondContact OD2-OG 2.87Å; F255-S257 PolarHBondContact O-N 2.88Å; F255-S257 VanDerWaalsContact O-N 3.15Å |
| 258 | C | 84.8 | Confident | 84.7 | Confident | 40 Ų | 40 | 84.1 Ų | 84.1 | 27% | 0.27 | 46% | 0.456 | S | S | . | . | G | 310 helix | trans | -90.8 | 2.9 | -179.6 | 81.5 | 0 | 0 | 0 | 0 | 114.7 | F255 T256 G260 V261 L262 | F255-C258 PolarHBondContact O-N 2.87Å; F255-C258 PolarHBondContact O-SG 3.33Å; T256-C258 VanDerWaalsContact C-N 3.26Å; T256-C258 PolarHBondContact O-N 2.76Å; C258-G260 VanDerWaalsContact C-N 3.27Å; C258-G260 PolarHBondContact O-N 3.39Å; C258-G260 VanDerWaalsContact O-N 3.12Å; C258-V261 WeakPolarHBondContact O-CA 3.43Å; C258-V261 WeakPolarHBondContact O-CB 3.49Å; C258-V261 PolarHBondContact O-N 2.93Å; C258-L262 PolarHBondContact O-N 2.8Å; C258-L262 VanDerWaalsContact O-N 3.08Å |
| 259 | R | 86.6 | Confident | 85.1 | Confident | 128 Ų | 128 | 84.7 Ų | 84.7 | 48% | 0.483 | 46% | 0.458 | S | S | . | . | H | α-helix | trans | -47.6 | -42.3 | -179 | -80.8 | 174.8 | 87.4 | -164 | 11.2 | 115.1 | T256 V261 L262 F263 V302 L306 | T256-R259 WeakPolarHBondContact O-CB 3.34Å; T256-R259 WeakPolarHBondContact O-CD 3.34Å; T256-R259 WeakPolarHBondContact O-CG 3.21Å; T256-R259 PolarHBondContact O-N 2.9Å; R259-V261 VanDerWaalsContact C-N 3.3Å; R259-V261 PolarHBondContact O-N 3.04Å; R259-L262 PolarHBondContact O-N 3.1Å; R259-F263 PolarHBondContact O-N 3.37Å; R259-V302 HydrophobicContact CG-CG1 3.41Å; R259-V302 VanDerWaalsContact CG-CG1 3.41Å; R259-L306 VanDerWaalsContact CZ-CD1 3.41Å |
| 260 | G | 89.2 | Confident | 85.6 | Confident | 53 Ų | 53 | 84.4 Ų | 84.4 | 55% | 0.546 | 46% | 0.457 | S | S | . | . | H | α-helix | trans | -63.5 | -35.2 | 177.5 | 0 | 0 | 0 | 0 | 0 | 113 | C258 V264 | C258-G260 VanDerWaalsContact C-N 3.27Å; C258-G260 PolarHBondContact O-N 3.39Å; C258-G260 VanDerWaalsContact O-N 3.12Å; G260-V264 WeakPolarHBondContact O-CG2 3.15Å; G260-V264 PolarHBondContact O-N 3.34Å |
| 261 | V | 92.1 | Very high | 86.3 | Confident | 92 Ų | 92 | 83.3 Ų | 83.3 | 56% | 0.558 | 46% | 0.457 | S | S | * | . | H | α-helix | trans | -70.7 | -45.6 | 175.6 | -174.7 | 0 | 0 | 0 | 0 | 110.3 | C258 R259 F263 V264 C265 | C258-V261 WeakPolarHBondContact O-CA 3.43Å; C258-V261 WeakPolarHBondContact O-CB 3.49Å; C258-V261 PolarHBondContact O-N 2.93Å; R259-V261 VanDerWaalsContact C-N 3.3Å; R259-V261 PolarHBondContact O-N 3.04Å; V261-F263 VanDerWaalsContact C-N 3.28Å; V261-F263 PolarHBondContact O-N 3.45Å; V261-V264 PolarHBondContact O-N 2.95Å; V261-V264 VanDerWaalsContact O-N 3.12Å; V261-C265 PolarHBondContact O-N 3.43Å; V261-C265 PolarHBondContact O-SG 3.17Å; V261-C265 VanDerWaalsContact O-SG 3.33Å |
| 262 | L | 92.6 | Very high | 87.7 | Confident | 13 Ų | 13 | 79.6 Ų | 79.6 | 7% | 0.068 | 43% | 0.425 | C | S | . | . | H | α-helix | trans | -59.6 | -39.1 | 177.4 | -58.9 | -174.3 | 0 | 0 | 0 | 112.1 | C258 R259 C265 L266 L295 C298 F299 V302 | C258-L262 PolarHBondContact O-N 2.8Å; C258-L262 VanDerWaalsContact O-N 3.08Å; R259-L262 PolarHBondContact O-N 3.1Å; L262-C265 PolarHBondContact O-N 2.87Å; L262-L266 WeakPolarHBondContact O-CB 3.06Å; L262-L266 PolarHBondContact O-N 3.23Å; L262-L295 HydrophobicContact CB-CD1 4.41Å; L262-L295 HydrophobicContact CD2-CD1 4.04Å; L262-C298 HydrophobicContact CD1-CB 4.01Å; L262-C298 HydrophobicContact CD2-CB 3.64Å; L262-F299 HydrophobicContact CB-CD1 4.35Å; L262-F299 HydrophobicContact CB-CE1 3.77Å; L262-F299 HydrophobicContact CB-CE2 4.06Å; L262-F299 HydrophobicContact CB-CZ 3.61Å; L262-F299 HydrophobicContact CD1-CD1 4.23Å; L262-F299 HydrophobicContact CD1-CE1 4.45Å; L262-F299 HydrophobicContact CD1-CG 4.43Å; L262-F299 WeakPolarHBondContact O-CZ 3.45Å; L262-V302 HydrophobicContact CD1-CB 4.3Å; L262-V302 HydrophobicContact CD1-CG2 3.64Å |
| 263 | F | 92.8 | Very high | 88.9 | Confident | 126 Ų | 126 | 72.8 Ų | 72.8 | 55% | 0.553 | 40% | 0.4 | S | S | * | . | H | α-helix | trans | -61.5 | -45.4 | 173.8 | -178.5 | -100.9 | 0 | 0 | 0 | 112.4 | R259 V261 C265 L266 I267 | R259-F263 PolarHBondContact O-N 3.37Å; V261-F263 VanDerWaalsContact C-N 3.28Å; V261-F263 PolarHBondContact O-N 3.45Å; F263-C265 PolarHBondContact O-N 3.27Å; F263-L266 WeakPolarHBondContact O-CB 3.27Å; F263-L266 PolarHBondContact O-N 2.91Å; F263-I267 HydrophobicContact CE1-CG1 4.21Å; F263-I267 HydrophobicContact CZ-CD1 4.27Å; F263-I267 HydrophobicContact CZ-CG1 4.28Å; F263-I267 WeakPolarHBondContact O-CG1 3.44Å; F263-I267 PolarHBondContact O-N 3.32Å; F263-I267 VanDerWaalsContact O-N 3.11Å |
| 264 | V | 95.9 | Very high | 90 | Very high | 87 Ų | 87 | 69.3 Ų | 69.3 | 53% | 0.527 | 39% | 0.391 | S | S | . | . | H | α-helix | trans | -62.7 | -42.6 | 174.9 | 173.3 | 0 | 0 | 0 | 0 | 111.1 | G260 V261 L266 I267 V268 | G260-V264 WeakPolarHBondContact O-CG2 3.15Å; G260-V264 PolarHBondContact O-N 3.34Å; V261-V264 PolarHBondContact O-N 2.95Å; V261-V264 VanDerWaalsContact O-N 3.12Å; V264-L266 VanDerWaalsContact C-N 3.29Å; V264-L266 PolarHBondContact O-N 3.27Å; V264-I267 PolarHBondContact O-N 2.98Å; V264-V268 HydrophobicContact CG1-CG2 4.5Å; V264-V268 WeakPolarHBondContact O-CG2 3.3Å; V264-V268 PolarHBondContact O-N 2.69Å |
| 265 | C | 95.5 | Very high | 90.7 | Very high | 54 Ų | 54 | 69.3 Ų | 69.3 | 37% | 0.365 | 39% | 0.39 | S | S | . | . | H | α-helix | trans | -61 | -35.8 | 174.9 | -68.3 | 0 | 0 | 0 | 0 | 112.7 | V261 L262 F263 V268 L269 L295 | V261-C265 PolarHBondContact O-N 3.43Å; V261-C265 PolarHBondContact O-SG 3.17Å; V261-C265 VanDerWaalsContact O-SG 3.33Å; L262-C265 PolarHBondContact O-N 2.87Å; F263-C265 PolarHBondContact O-N 3.27Å; C265-V268 PolarHBondContact O-N 3.41Å; C265-L269 VanDerWaalsContact O-CB 3.3Å; C265-L269 WeakPolarHBondContact O-CB 2.95Å; C265-L269 PolarHBondContact O-N 2.99Å; C265-L295 HydrophobicContact CB-CD1 3.6Å; C265-L295 HydrophobicContact CB-CD2 4.15Å |
| 266 | L | 94.6 | Very high | 91.5 | Very high | 53 Ų | 53 | 66.9 Ų | 66.9 | 28% | 0.277 | 38% | 0.381 | S | S | . | . | H | α-helix | trans | -64.6 | -44.4 | 174.5 | -174.3 | 157.3 | 0 | 0 | 0 | 111.5 | L262 F263 V264 L269 L270 L295 F299 | L262-L266 WeakPolarHBondContact O-CB 3.06Å; L262-L266 PolarHBondContact O-N 3.23Å; F263-L266 WeakPolarHBondContact O-CB 3.27Å; F263-L266 PolarHBondContact O-N 2.91Å; V264-L266 VanDerWaalsContact C-N 3.29Å; V264-L266 PolarHBondContact O-N 3.27Å; L266-L269 PolarHBondContact O-N 3.48Å; L266-L270 WeakPolarHBondContact O-CB 3.44Å; L266-L270 PolarHBondContact O-N 3.17Å; L266-L295 HydrophobicContact CB-CD2 4.22Å; L266-F299 HydrophobicContact CB-CE2 4.11Å; L266-F299 HydrophobicContact CB-CZ 4.1Å; L266-F299 HydrophobicContact CD1-CE2 3.85Å; L266-F299 HydrophobicContact CD1-CZ 3.79Å |
| 267 | I | 95.9 | Very high | 92.1 | Very high | 79 Ų | 79 | 71.1 Ų | 71.1 | 41% | 0.405 | 40% | 0.4 | S | S | . | . | H | α-helix | trans | -64 | -42.1 | 175.9 | -60.5 | -58.9 | 0 | 0 | 0 | 111.2 | F263 V264 L269 L270 V271 | F263-I267 HydrophobicContact CE1-CG1 4.21Å; F263-I267 HydrophobicContact CZ-CD1 4.27Å; F263-I267 HydrophobicContact CZ-CG1 4.28Å; F263-I267 WeakPolarHBondContact O-CG1 3.44Å; F263-I267 PolarHBondContact O-N 3.32Å; F263-I267 VanDerWaalsContact O-N 3.11Å; V264-I267 PolarHBondContact O-N 2.98Å; I267-L269 PolarHBondContact O-N 2.89Å; I267-L270 PolarHBondContact O-N 3.33Å; I267-V271 WeakPolarHBondContact O-CG2 3.36Å; I267-V271 PolarHBondContact O-N 2.89Å |
| 268 | V | 96.6 | Very high | 92.7 | Very high | 92 Ų | 92 | 73.9 Ų | 73.9 | 56% | 0.558 | 40% | 0.4 | S | S | * | . | H | α-helix | trans | -61.5 | -43.2 | 174.8 | 171.3 | 0 | 0 | 0 | 0 | 111.2 | V264 C265 V271 F272 | V264-V268 HydrophobicContact CG1-CG2 4.5Å; V264-V268 WeakPolarHBondContact O-CG2 3.3Å; V264-V268 PolarHBondContact O-N 2.69Å; C265-V268 PolarHBondContact O-N 3.41Å; V268-V271 PolarHBondContact O-N 3.32Å; V268-F272 WeakPolarHBondContact O-CB 3.27Å; V268-F272 PolarHBondContact O-N 2.99Å |
| 269 | L | 95.4 | Very high | 92.9 | Very high | 16 Ų | 16 | 76.7 Ų | 76.7 | 8% | 0.084 | 41% | 0.411 | C | S | . | . | H | α-helix | trans | -68 | -38.2 | 178.7 | -170.4 | 140.6 | 0 | 0 | 0 | 111.9 | C265 L266 I267 F272 S273 Y288 L291 L295 | C265-L269 VanDerWaalsContact O-CB 3.3Å; C265-L269 WeakPolarHBondContact O-CB 2.95Å; C265-L269 PolarHBondContact O-N 2.99Å; L266-L269 PolarHBondContact O-N 3.48Å; I267-L269 PolarHBondContact O-N 2.89Å; L269-F272 PolarHBondContact O-N 3.22Å; L269-S273 PolarHBondContact O-N 2.94Å; L269-Y288 HydrophobicContact CD2-CE2 3.56Å; L269-Y288 HydrophobicContact CG-CD2 4.29Å; L269-Y288 HydrophobicContact CG-CE2 3.76Å; L269-L291 HydrophobicContact CD1-CB 4.06Å; L269-L295 HydrophobicContact CB-CD2 4.19Å; L269-L295 HydrophobicContact CD1-CD2 4.1Å |
| 270 | L | 94.5 | Very high | 93 | Very high | 92 Ų | 92 | 80.7 Ų | 80.7 | 48% | 0.482 | 43% | 0.426 | S | S | . | . | H | α-helix | trans | -59.4 | -48 | 172.9 | -169.4 | 164.2 | 0 | 0 | 0 | 110.7 | L266 I267 F272 S273 I274 | L266-L270 WeakPolarHBondContact O-CB 3.44Å; L266-L270 PolarHBondContact O-N 3.17Å; I267-L270 PolarHBondContact O-N 3.33Å; L270-F272 VanDerWaalsContact C-N 3.33Å; L270-F272 PolarHBondContact O-N 2.9Å; L270-S273 WeakPolarHBondContact O-CB 3.4Å; L270-S273 PolarHBondContact O-N 2.97Å; L270-S273 PolarHBondContact O-OG 2.94Å; L270-I274 HydrophobicContact CD2-CD1 4.22Å; L270-I274 PolarHBondContact O-N 3.44Å |
| 271 | V | 95.1 | Very high | 93 | Very high | 80 Ų | 80 | 81.5 Ų | 81.5 | 49% | 0.485 | 42% | 0.418 | S | S | . | . | H | α-helix | trans | -63 | -39.3 | 175.8 | 174.1 | 0 | 0 | 0 | 0 | 111.3 | I267 V268 S273 I274 L275 | I267-V271 WeakPolarHBondContact O-CG2 3.36Å; I267-V271 PolarHBondContact O-N 2.89Å; V268-V271 PolarHBondContact O-N 3.32Å; V271-S273 VanDerWaalsContact C-N 3.33Å; V271-S273 PolarHBondContact O-N 2.79Å; V271-I274 WeakPolarHBondContact O-CB 3.4Å; V271-I274 PolarHBondContact O-N 2.92Å; V271-L275 PolarHBondContact O-N 3.35Å |
| 272 | F | 94.2 | Very high | 92.9 | Very high | 45 Ų | 45 | 82 Ų | 82 | 20% | 0.197 | 41% | 0.412 | C | S | . | . | H | α-helix | trans | -66.1 | -33 | 176.2 | -174.8 | -146.6 | 0 | 0 | 0 | 112.6 | V268 L269 L270 I274 L275 C276 L284 V287 Y288 L291 | V268-F272 WeakPolarHBondContact O-CB 3.27Å; V268-F272 PolarHBondContact O-N 2.99Å; L269-F272 PolarHBondContact O-N 3.22Å; L270-F272 VanDerWaalsContact C-N 3.33Å; L270-F272 PolarHBondContact O-N 2.9Å; F272-I274 VanDerWaalsContact C-N 3.26Å; F272-I274 PolarHBondContact O-N 3.05Å; F272-L275 HydrophobicContact CD2-CB 4.34Å; F272-L275 HydrophobicContact CD2-CD1 4.43Å; F272-L275 WeakPolarHBondContact O-CB 3.28Å; F272-L275 PolarHBondContact O-N 3.36Å; F272-L275 VanDerWaalsContact O-N 3.14Å; F272-C276 PolarHBondContact O-N 3.3Å; F272-C276 PolarHBondContact O-SG 3.28Å; F272-L284 HydrophobicContact CZ-CD2 4.37Å; F272-V287 HydrophobicContact CE1-CG1 4.32Å; F272-V287 HydrophobicContact CZ-CG1 4.48Å; F272-Y288 AromaticContact CD1-CD2 3.76Å; F272-Y288 HydrophobicContact CD1-CD2 3.76Å; F272-Y288 HydrophobicContact CE1-CD2 4.21Å; F272-Y288 HydrophobicContact CG-CD2 4.31Å; F272-L291 HydrophobicContact CD1-CD1 4.35Å; F272-L291 HydrophobicContact CE1-CD1 4.1Å |
| 273 | S | 92.6 | Very high | 92.9 | Very high | 31 Ų | 31 | 87.2 Ų | 87.2 | 22% | 0.217 | 44% | 0.44 | C | S | . | . | H | α-helix | trans | -60.1 | -36.7 | 174 | 82.8 | 0 | 0 | 0 | 0 | 112.4 | L269 L270 V271 C276 I277 Y288 | L269-S273 PolarHBondContact O-N 2.94Å; L270-S273 WeakPolarHBondContact O-CB 3.4Å; L270-S273 PolarHBondContact O-N 2.97Å; L270-S273 PolarHBondContact O-OG 2.94Å; V271-S273 VanDerWaalsContact C-N 3.33Å; V271-S273 PolarHBondContact O-N 2.79Å; S273-C276 PolarHBondContact O-N 3.09Å; S273-I277 PolarHBondContact O-N 2.93Å; S273-Y288 WeakPolarHBondContact CB-OH 3.45Å |
| 274 | I | 93.3 | Very high | 92.8 | Very high | 80 Ų | 80 | 83.5 Ų | 83.5 | 41% | 0.41 | 43% | 0.425 | S | S | . | . | H | α-helix | trans | -66 | -40.6 | 176.4 | -60.3 | 170.8 | 0 | 0 | 0 | 110.4 | L270 V271 F272 I277 F278 | L270-I274 HydrophobicContact CD2-CD1 4.22Å; L270-I274 PolarHBondContact O-N 3.44Å; V271-I274 WeakPolarHBondContact O-CB 3.4Å; V271-I274 PolarHBondContact O-N 2.92Å; F272-I274 VanDerWaalsContact C-N 3.26Å; F272-I274 PolarHBondContact O-N 3.05Å; I274-I277 PolarHBondContact O-N 3.48Å; I274-F278 HydrophobicContact CG2-CD2 4.39Å; I274-F278 HydrophobicContact CG2-CE2 3.87Å; I274-F278 WeakPolarHBondContact O-CD2 3.44Å |
| 275 | L | 91.4 | Very high | 92.7 | Very high | 88 Ų | 88 | 80.9 Ų | 80.9 | 46% | 0.461 | 41% | 0.408 | S | S | . | . | H | α-helix | trans | -65.4 | -37.8 | 175 | -60.8 | 176.3 | 0 | 0 | 0 | 112.1 | V271 F272 I277 F278 I279 | V271-L275 PolarHBondContact O-N 3.35Å; F272-L275 HydrophobicContact CD2-CB 4.34Å; F272-L275 HydrophobicContact CD2-CD1 4.43Å; F272-L275 WeakPolarHBondContact O-CB 3.28Å; F272-L275 PolarHBondContact O-N 3.36Å; F272-L275 VanDerWaalsContact O-N 3.14Å; L275-I277 VanDerWaalsContact C-N 3.31Å; L275-I277 PolarHBondContact O-N 3.2Å; L275-F278 PolarHBondContact O-N 2.83Å; L275-I279 HydrophobicContact CB-CD1 4.41Å; L275-I279 WeakPolarHBondContact O-CG1 3.43Å; L275-I279 PolarHBondContact O-N 3.08Å |
| 276 | C | 90.8 | Very high | 92.6 | Very high | 12 Ų | 12 | 81 Ų | 81 | 8% | 0.081 | 41% | 0.405 | C | S | . | . | H | α-helix | trans | -61.9 | -37.4 | 176.7 | -65.3 | 0 | 0 | 0 | 0 | 112.3 | F272 S273 F278 I279 R280 | F272-C276 PolarHBondContact O-N 3.3Å; F272-C276 PolarHBondContact O-SG 3.28Å; S273-C276 PolarHBondContact O-N 3.09Å; C276-F278 VanDerWaalsContact C-N 3.31Å; C276-F278 PolarHBondContact O-N 2.84Å; C276-I279 PolarHBondContact O-N 3.48Å; C276-R280 WeakPolarHBondContact O-CA 3.38Å; C276-R280 PolarHBondContact O-N 2.87Å |
| 277 | I | 90.6 | Very high | 92.6 | Very high | 128 Ų | 128 | 81.5 Ų | 81.5 | 66% | 0.656 | 41% | 0.41 | S | S | * | . | H | α-helix | trans | -58.7 | -41 | 176 | -69.6 | 163.2 | 0 | 0 | 0 | 111.8 | S273 I274 L275 | S273-I277 PolarHBondContact O-N 2.93Å; I274-I277 PolarHBondContact O-N 3.48Å; L275-I277 VanDerWaalsContact C-N 3.31Å; L275-I277 PolarHBondContact O-N 3.2Å |
| 278 | F | 92.1 | Very high | 92.6 | Very high | 163 Ų | 163 | 80 Ų | 80 | 72% | 0.715 | 40% | 0.399 | S | S | * | . | H | α-helix | trans | -79.8 | -39.6 | -179.8 | -66.5 | -68.5 | 0 | 0 | 0 | 113.5 | I274 L275 C276 | I274-F278 HydrophobicContact CG2-CD2 4.39Å; I274-F278 HydrophobicContact CG2-CE2 3.87Å; I274-F278 WeakPolarHBondContact O-CD2 3.44Å; L275-F278 PolarHBondContact O-N 2.83Å; C276-F278 VanDerWaalsContact C-N 3.31Å; C276-F278 PolarHBondContact O-N 2.84Å |
| 279 | I | 89.5 | Confident | 92.6 | Very high | 98 Ų | 98 | 75.7 Ų | 75.7 | 50% | 0.503 | 37% | 0.373 | S | S | . | . | H | α-helix | trans | -86.6 | -31.1 | -172.5 | -55.2 | 167.4 | 0 | 0 | 0 | 112 | L275 C276 N281 L284 | L275-I279 HydrophobicContact CB-CD1 4.41Å; L275-I279 WeakPolarHBondContact O-CG1 3.43Å; L275-I279 PolarHBondContact O-N 3.08Å; C276-I279 PolarHBondContact O-N 3.48Å; I279-N281 HydrophobicContact CG2-CB 4.31Å; I279-N281 PolarHBondContact O-N 3.11Å; I279-L284 HydrophobicContact CB-CD1 3.91Å; I279-L284 HydrophobicContact CD1-CD1 4.04Å; I279-L284 HydrophobicContact CG2-CD1 3.5Å |
| 280 | R | 87.4 | Confident | 92.7 | Very high | 212 Ų | 212 | 77.2 Ų | 77.2 | 80% | 0.8 | 39% | 0.385 | S | S | * | . | trans | 45.3 | 58.6 | 170.5 | -165.4 | -179.7 | 60.1 | 124.2 | 1.1 | 113.8 | C276 | C276-R280 WeakPolarHBondContact O-CA 3.38Å; C276-R280 PolarHBondContact O-N 2.87Å | ||
| 281 | N | 90.8 | Very high | 92.8 | Very high | 71 Ų | 71 | 77 Ų | 77 | 38% | 0.38 | 38% | 0.384 | S | S | . | . | trans | -120.3 | 128.2 | -176 | 179.6 | -39.1 | 0 | 0 | 0 | 110 | I279 I283 L284 D285 | I279-N281 HydrophobicContact CG2-CB 4.31Å; I279-N281 PolarHBondContact O-N 3.11Å; N281-I283 PolarHBondContact O-N 3.31Å; N281-I283 VanDerWaalsContact O-N 3.08Å; N281-I283 PolarHBondContact OD1-N 2.96Å; N281-L284 HydrophobicContact CB-CB 4.32Å; N281-L284 HydrophobicContact CB-CD1 4.21Å; N281-L284 HydrophobicContact CB-CG 4.17Å; N281-L284 WeakPolarHBondContact O-CA 3.31Å; N281-L284 PolarHBondContact O-N 2.83Å; N281-D285 PolarHBondContact O-N 3.41Å | ||
| 282 | K | 89.1 | Confident | 92.9 | Very high | 101 Ų | 101 | 73.1 Ų | 73.1 | 44% | 0.439 | 36% | 0.361 | S | S | . | . | H | α-helix | trans | -48.5 | -38.5 | -180 | -76.6 | -172.7 | 171.6 | -178.7 | 0 | 114.1 | L286 E347 | K282-L286 WeakPolarHBondContact O-CB 3.31Å; K282-L286 PolarHBondContact O-N 3.14Å; K282-E347 PolarHBondContact NZ-O 3.09Å; K282-E347 PolarHBondContact NZ-OXT 3.39Å |
| 283 | I | 92.1 | Very high | 93.1 | Very high | 124 Ų | 124 | 71.6 Ų | 71.6 | 64% | 0.636 | 36% | 0.356 | S | S | * | . | H | α-helix | trans | -71 | -39.8 | -179.6 | -58.3 | 175.8 | 0 | 0 | 0 | 110.3 | N281 L286 V287 | N281-I283 PolarHBondContact O-N 3.31Å; N281-I283 VanDerWaalsContact O-N 3.08Å; N281-I283 PolarHBondContact OD1-N 2.96Å; I283-L286 PolarHBondContact O-N 3.41Å; I283-V287 HydrophobicContact CG2-CG2 4.49Å; I283-V287 WeakPolarHBondContact O-CB 3.36Å; I283-V287 VanDerWaalsContact O-CG2 3.29Å; I283-V287 WeakPolarHBondContact O-CG2 3.37Å; I283-V287 PolarHBondContact O-N 3.22Å |
| 284 | L | 92.4 | Very high | 93.2 | Very high | 47 Ų | 47 | 75.4 Ų | 75.4 | 25% | 0.246 | 37% | 0.374 | C | S | . | . | H | α-helix | trans | -69.3 | -41.2 | 175.6 | -64.8 | -178.4 | 0 | 0 | 0 | 111.6 | F272 I279 N281 L286 V287 Y288 | F272-L284 HydrophobicContact CZ-CD2 4.37Å; I279-L284 HydrophobicContact CB-CD1 3.91Å; I279-L284 HydrophobicContact CD1-CD1 4.04Å; I279-L284 HydrophobicContact CG2-CD1 3.5Å; N281-L284 HydrophobicContact CB-CB 4.32Å; N281-L284 HydrophobicContact CB-CD1 4.21Å; N281-L284 HydrophobicContact CB-CG 4.17Å; N281-L284 WeakPolarHBondContact O-CA 3.31Å; N281-L284 PolarHBondContact O-N 2.83Å; L284-L286 VanDerWaalsContact C-N 3.29Å; L284-L286 PolarHBondContact O-N 3.05Å; L284-V287 PolarHBondContact O-N 3.4Å; L284-Y288 WeakPolarHBondContact O-CB 3.4Å; L284-Y288 PolarHBondContact O-N 3.08Å |
| 285 | D | 91.9 | Very high | 93.4 | Very high | 33 Ų | 33 | 72.1 Ų | 72.1 | 18% | 0.176 | 36% | 0.357 | C | S | . | . | H | α-helix | trans | -54.8 | -45.9 | 172.3 | -74.8 | 16.4 | 0 | 0 | 0 | 111.1 | N281 A289 R344 | N281-D285 PolarHBondContact O-N 3.41Å; D285-A289 VanDerWaalsContact O-CB 3.3Å; D285-A289 WeakPolarHBondContact O-CB 3.43Å; D285-A289 PolarHBondContact O-N 3.29Å; D285-R344 HydrophobicContact CB-CG 4.39Å; D285-R344 IonicContact OD2-CZ 2.76Å; D285-R344 VanDerWaalsContact OD2-CZ 3.31Å; D285-R344 IonicContact OD2-NE 3.32Å; D285-R344 PolarHBondContact OD2-NE 2.88Å; D285-R344 IonicContact OD2-NH2 2.69Å; D285-R344 PolarHBondContact OD2-NH2 3.49Å |
| 286 | L | 94.1 | Very high | 93.7 | Very high | 57 Ų | 57 | 69.1 Ų | 69.1 | 30% | 0.298 | 34% | 0.34 | S | S | . | . | H | α-helix | trans | -71.2 | -40.8 | -178.2 | -169.2 | 152.1 | 0 | 0 | 0 | 111.9 | K282 I283 L284 A289 S290 | K282-L286 WeakPolarHBondContact O-CB 3.31Å; K282-L286 PolarHBondContact O-N 3.14Å; I283-L286 PolarHBondContact O-N 3.41Å; L284-L286 VanDerWaalsContact C-N 3.29Å; L284-L286 PolarHBondContact O-N 3.05Å; L286-A289 PolarHBondContact O-N 3.19Å; L286-S290 WeakPolarHBondContact O-CB 3.23Å; L286-S290 PolarHBondContact O-N 3Å; L286-S290 PolarHBondContact O-OG 2.97Å |
| 287 | V | 95.7 | Very high | 93.9 | Very high | 62 Ų | 62 | 70.1 Ų | 70.1 | 38% | 0.376 | 35% | 0.346 | S | S | . | . | H | α-helix | trans | -64.8 | -45.4 | 174.1 | 169.1 | 0 | 0 | 0 | 0 | 111 | F272 I283 L284 A289 S290 L291 | F272-V287 HydrophobicContact CE1-CG1 4.32Å; F272-V287 HydrophobicContact CZ-CG1 4.48Å; I283-V287 HydrophobicContact CG2-CG2 4.49Å; I283-V287 WeakPolarHBondContact O-CB 3.36Å; I283-V287 VanDerWaalsContact O-CG2 3.29Å; I283-V287 WeakPolarHBondContact O-CG2 3.37Å; I283-V287 PolarHBondContact O-N 3.22Å; L284-V287 PolarHBondContact O-N 3.4Å; V287-A289 PolarHBondContact O-N 2.76Å; V287-S290 PolarHBondContact O-N 2.82Å; V287-L291 HydrophobicContact CG1-CD1 4.05Å; V287-L291 HydrophobicContact CG1-CG 4.49Å; V287-L291 WeakPolarHBondContact O-CG 3.24Å; V287-L291 PolarHBondContact O-N 3.12Å |
| 288 | Y | 96 | Very high | 94.1 | Very high | 47 Ų | 47 | 65.9 Ų | 65.9 | 18% | 0.184 | 33% | 0.327 | C | S | . | . | H | α-helix | trans | -56.7 | -48.3 | 174.2 | 172 | -102 | 0 | 0 | 0 | 111.4 | L269 F272 S273 L284 S290 L291 G292 Y337 | L269-Y288 HydrophobicContact CD2-CE2 3.56Å; L269-Y288 HydrophobicContact CG-CD2 4.29Å; L269-Y288 HydrophobicContact CG-CE2 3.76Å; F272-Y288 AromaticContact CD1-CD2 3.76Å; F272-Y288 HydrophobicContact CD1-CD2 3.76Å; F272-Y288 HydrophobicContact CE1-CD2 4.21Å; F272-Y288 HydrophobicContact CG-CD2 4.31Å; S273-Y288 WeakPolarHBondContact CB-OH 3.45Å; L284-Y288 WeakPolarHBondContact O-CB 3.4Å; L284-Y288 PolarHBondContact O-N 3.08Å; Y288-S290 PolarHBondContact O-N 3.03Å; Y288-L291 PolarHBondContact O-N 3.24Å; Y288-G292 PolarHBondContact O-N 2.87Å; Y288-Y337 HydrophobicContact CD1-CE1 4.34Å; Y288-Y337 AromaticContact CE1-CE1 3.69Å; Y288-Y337 HydrophobicContact CE1-CE1 3.69Å; Y288-Y337 PolarHBondContact OH-OH 2.96Å |
| 289 | A | 96.2 | Very high | 94.2 | Very high | 2 Ų | 2 | 59.5 Ų | 59.5 | 2% | 0.017 | 30% | 0.299 | C | S | . | . | H | α-helix | trans | -66.6 | -36.1 | 178.1 | 0 | 0 | 0 | 0 | 0 | 112.7 | D285 L286 V287 G292 A293 Y337 A340 I341 | D285-A289 VanDerWaalsContact O-CB 3.3Å; D285-A289 WeakPolarHBondContact O-CB 3.43Å; D285-A289 PolarHBondContact O-N 3.29Å; L286-A289 PolarHBondContact O-N 3.19Å; V287-A289 PolarHBondContact O-N 2.76Å; A289-G292 PolarHBondContact O-N 2.86Å; A289-A293 WeakPolarHBondContact O-CB 3.31Å; A289-A293 PolarHBondContact O-N 2.85Å; A289-Y337 HydrophobicContact CB-CD1 4.09Å; A289-Y337 WeakPolarHBondContact O-CB 3.41Å; A289-A340 HydrophobicContact CB-CB 3.99Å; A289-I341 HydrophobicContact CB-CD1 4.37Å; A289-I341 HydrophobicContact CB-CG1 3.72Å |
| 290 | S | 96.8 | Very high | 94.5 | Very high | 48 Ų | 48 | 54.9 Ų | 54.9 | 34% | 0.336 | 28% | 0.276 | S | S | . | . | H | α-helix | trans | -65.3 | -42.9 | 176 | -58.4 | 0 | 0 | 0 | 0 | 111.9 | L286 V287 Y288 L294 | L286-S290 WeakPolarHBondContact O-CB 3.23Å; L286-S290 PolarHBondContact O-N 3Å; L286-S290 PolarHBondContact O-OG 2.97Å; V287-S290 PolarHBondContact O-N 2.82Å; Y288-S290 PolarHBondContact O-N 3.03Å; S290-L294 WeakPolarHBondContact O-CB 3.43Å; S290-L294 PolarHBondContact O-N 3.09Å; S290-L294 VanDerWaalsContact O-N 3.1Å |
| 291 | L | 97.4 | Very high | 94.8 | Very high | 87 Ų | 87 | 45.1 Ų | 45.1 | 46% | 0.455 | 24% | 0.241 | S | C | . | . | H | α-helix | trans | -66 | -38.2 | 173.4 | -68.5 | 172.9 | 0 | 0 | 0 | 111.7 | L269 F272 V287 Y288 L295 | L269-L291 HydrophobicContact CD1-CB 4.06Å; F272-L291 HydrophobicContact CD1-CD1 4.35Å; F272-L291 HydrophobicContact CE1-CD1 4.1Å; V287-L291 HydrophobicContact CG1-CD1 4.05Å; V287-L291 HydrophobicContact CG1-CG 4.49Å; V287-L291 WeakPolarHBondContact O-CG 3.24Å; V287-L291 PolarHBondContact O-N 3.12Å; Y288-L291 PolarHBondContact O-N 3.24Å; L291-L295 WeakPolarHBondContact O-CB 2.9Å; L291-L295 PolarHBondContact O-N 3.44Å |
| 292 | G | 97.1 | Very high | 94.8 | Very high | 0 Ų | 0 | 41.8 Ų | 41.8 | 0% | 0 | 22% | 0.223 | C | C | . | . | H | α-helix | trans | -63.9 | -49.6 | 176 | 0 | 0 | 0 | 0 | 0 | 112.5 | Y288 A289 L294 L295 F296 | Y288-G292 PolarHBondContact O-N 2.87Å; A289-G292 PolarHBondContact O-N 2.86Å; G292-L294 VanDerWaalsContact C-N 3.35Å; G292-L294 PolarHBondContact O-N 3.34Å; G292-L295 PolarHBondContact O-N 3.24Å; G292-F296 WeakPolarHBondContact O-CD2 3.47Å; G292-F296 PolarHBondContact O-N 3.45Å |
| 293 | A | 97.3 | Very high | 95 | Very high | 12 Ų | 12 | 38 Ų | 38 | 10% | 0.099 | 21% | 0.208 | C | C | . | . | H | α-helix | trans | -57.3 | -47.2 | 176.2 | 0 | 0 | 0 | 0 | 0 | 111.3 | A289 T297 I338 I341 | A289-A293 WeakPolarHBondContact O-CB 3.31Å; A289-A293 PolarHBondContact O-N 2.85Å; A293-T297 WeakPolarHBondContact O-CB 3.29Å; A293-T297 PolarHBondContact O-N 2.99Å; A293-T297 PolarHBondContact O-OG1 3.37Å; A293-I338 HydrophobicContact CB-CG1 4.41Å; A293-I341 HydrophobicContact CB-CD1 4.26Å |
| 294 | L | 96.3 | Very high | 94.9 | Very high | 111 Ų | 111 | 32.2 Ų | 32.2 | 58% | 0.581 | 18% | 0.178 | S | C | * | . | H | α-helix | trans | -62.6 | -48 | 177.3 | -172.2 | 158.4 | 0 | 0 | 0 | 111.7 | S290 G292 T297 C298 | S290-L294 WeakPolarHBondContact O-CB 3.43Å; S290-L294 PolarHBondContact O-N 3.09Å; S290-L294 VanDerWaalsContact O-N 3.1Å; G292-L294 VanDerWaalsContact C-N 3.35Å; G292-L294 PolarHBondContact O-N 3.34Å; L294-T297 WeakPolarHBondContact O-CB 3.26Å; L294-T297 PolarHBondContact O-N 3.14Å; L294-C298 PolarHBondContact O-N 3.21Å; L294-C298 PolarHBondContact O-SG 3.28Å |
| 295 | L | 96.5 | Very high | 94.8 | Very high | 11 Ų | 11 | 30.7 Ų | 30.7 | 6% | 0.058 | 17% | 0.169 | C | C | . | . | H | α-helix | trans | -63 | -46.8 | -177.2 | 179.2 | 60.2 | 0 | 0 | 0 | 112.3 | L262 C265 L266 L269 L291 G292 T297 C298 F299 | L262-L295 HydrophobicContact CB-CD1 4.41Å; L262-L295 HydrophobicContact CD2-CD1 4.04Å; C265-L295 HydrophobicContact CB-CD1 3.6Å; C265-L295 HydrophobicContact CB-CD2 4.15Å; L266-L295 HydrophobicContact CB-CD2 4.22Å; L269-L295 HydrophobicContact CB-CD2 4.19Å; L269-L295 HydrophobicContact CD1-CD2 4.1Å; L291-L295 WeakPolarHBondContact O-CB 2.9Å; L291-L295 PolarHBondContact O-N 3.44Å; G292-L295 PolarHBondContact O-N 3.24Å; L295-T297 VanDerWaalsContact C-N 3.31Å; L295-T297 PolarHBondContact O-N 3.41Å; L295-C298 WeakPolarHBondContact O-CB 3.43Å; L295-C298 PolarHBondContact O-N 2.65Å; L295-C298 VanDerWaalsContact O-N 3.12Å; L295-F299 HydrophobicContact CD1-CD2 4.12Å; L295-F299 HydrophobicContact CD1-CE2 3.73Å; L295-F299 HydrophobicContact CD2-CE2 4.24Å; L295-F299 HydrophobicContact CG-CD2 4Å; L295-F299 HydrophobicContact CG-CE2 3.77Å; L295-F299 WeakPolarHBondContact O-CD2 3.26Å; L295-F299 PolarHBondContact O-N 3.01Å |
| 296 | F | 96.8 | Very high | 94.5 | Very high | 26 Ų | 26 | 30.4 Ų | 30.4 | 11% | 0.114 | 17% | 0.168 | C | C | . | . | H | α-helix | trans | -71.6 | -25.9 | 177.3 | -78.7 | -81.9 | 0 | 0 | 0 | 112.7 | G292 C298 F299 L300 D330 N333 I334 Y337 | G292-F296 WeakPolarHBondContact O-CD2 3.47Å; G292-F296 PolarHBondContact O-N 3.45Å; F296-C298 VanDerWaalsContact C-N 3.31Å; F296-F299 HydrophobicContact CD1-CD2 4.34Å; F296-F299 PolarHBondContact O-N 3.21Å; F296-L300 WeakPolarHBondContact O-CB 3.5Å; F296-L300 PolarHBondContact O-N 3.24Å; F296-D330 WeakPolarHBondContact CD1-OD1 3.29Å; F296-N333 HydrophobicContact CB-CB 4.17Å; F296-N333 HydrophobicContact CD1-CB 3.75Å; F296-N333 HydrophobicContact CD2-CB 3.9Å; F296-N333 HydrophobicContact CE1-CB 4.08Å; F296-N333 WeakPolarHBondContact CE1-ND2 3.36Å; F296-N333 HydrophobicContact CE2-CB 4.21Å; F296-N333 HydrophobicContact CG-CB 3.64Å; F296-N333 HydrophobicContact CZ-CB 4.29Å; F296-N333 WeakPolarHBondContact CZ-ND2 3.46Å; F296-I334 HydrophobicContact CB-CG1 3.81Å; F296-Y337 HydrophobicContact CD2-CD2 4.15Å; F296-Y337 AromaticContact CD2-CE2 3.54Å; F296-Y337 HydrophobicContact CD2-CE2 3.54Å; F296-Y337 AromaticContact CE2-CE2 3.76Å; F296-Y337 HydrophobicContact CE2-CE2 3.76Å |
| 297 | T | 96.3 | Very high | 94.2 | Very high | 32 Ų | 32 | 28.2 Ų | 28.2 | 20% | 0.196 | 16% | 0.156 | C | C | . | . | H | α-helix | trans | -62.4 | -38.3 | 166.9 | -62.1 | 0 | 0 | 0 | 0 | 111.2 | V240 V244 A293 L294 L295 A301 | V240-T297 HydrophobicContact CG1-CG2 3.98Å; V244-T297 HydrophobicContact CG2-CG2 3.49Å; V244-T297 VanDerWaalsContact CG2-CG2 3.49Å; A293-T297 WeakPolarHBondContact O-CB 3.29Å; A293-T297 PolarHBondContact O-N 2.99Å; A293-T297 PolarHBondContact O-OG1 3.37Å; L294-T297 WeakPolarHBondContact O-CB 3.26Å; L294-T297 PolarHBondContact O-N 3.14Å; L295-T297 VanDerWaalsContact C-N 3.31Å; L295-T297 PolarHBondContact O-N 3.41Å; T297-A301 PolarHBondContact O-N 3.37Å; T297-A301 VanDerWaalsContact O-N 3.12Å |
| 298 | C | 94.6 | Very high | 93.6 | Very high | 39 Ų | 39 | 27 Ų | 27 | 26% | 0.264 | 15% | 0.147 | S | C | . | . | H | α-helix | trans | -71.7 | -37.2 | 173.4 | -66 | 0 | 0 | 0 | 0 | 113.2 | L262 L294 L295 F296 A301 V302 | L262-C298 HydrophobicContact CD1-CB 4.01Å; L262-C298 HydrophobicContact CD2-CB 3.64Å; L294-C298 PolarHBondContact O-N 3.21Å; L294-C298 PolarHBondContact O-SG 3.28Å; L295-C298 WeakPolarHBondContact O-CB 3.43Å; L295-C298 PolarHBondContact O-N 2.65Å; L295-C298 VanDerWaalsContact O-N 3.12Å; F296-C298 VanDerWaalsContact C-N 3.31Å; C298-A301 WeakPolarHBondContact O-CB 3.4Å; C298-A301 PolarHBondContact O-N 2.82Å; C298-V302 WeakPolarHBondContact O-CG2 3.05Å; C298-V302 PolarHBondContact O-N 2.89Å; C298-V302 VanDerWaalsContact O-N 3.09Å |
| 299 | F | 94.6 | Very high | 92.5 | Very high | 30 Ų | 30 | 27.6 Ų | 27.6 | 13% | 0.132 | 17% | 0.167 | C | C | . | . | H | α-helix | trans | -61.9 | -47.2 | 171.4 | -81.3 | -71.9 | 0 | 0 | 0 | 111.4 | L262 L266 L295 F296 A301 V302 D303 D330 | L262-F299 HydrophobicContact CB-CD1 4.35Å; L262-F299 HydrophobicContact CB-CE1 3.77Å; L262-F299 HydrophobicContact CB-CE2 4.06Å; L262-F299 HydrophobicContact CB-CZ 3.61Å; L262-F299 HydrophobicContact CD1-CD1 4.23Å; L262-F299 HydrophobicContact CD1-CE1 4.45Å; L262-F299 HydrophobicContact CD1-CG 4.43Å; L262-F299 WeakPolarHBondContact O-CZ 3.45Å; L266-F299 HydrophobicContact CB-CE2 4.11Å; L266-F299 HydrophobicContact CB-CZ 4.1Å; L266-F299 HydrophobicContact CD1-CE2 3.85Å; L266-F299 HydrophobicContact CD1-CZ 3.79Å; L295-F299 HydrophobicContact CD1-CD2 4.12Å; L295-F299 HydrophobicContact CD1-CE2 3.73Å; L295-F299 HydrophobicContact CD2-CE2 4.24Å; L295-F299 HydrophobicContact CG-CD2 4Å; L295-F299 HydrophobicContact CG-CE2 3.77Å; L295-F299 WeakPolarHBondContact O-CD2 3.26Å; L295-F299 PolarHBondContact O-N 3.01Å; F296-F299 HydrophobicContact CD1-CD2 4.34Å; F296-F299 PolarHBondContact O-N 3.21Å; F299-A301 PolarHBondContact O-N 3.11Å; F299-V302 WeakPolarHBondContact O-CB 3.49Å; F299-V302 PolarHBondContact O-N 3.35Å; F299-D303 PolarHBondContact O-N 2.94Å; F299-D330 VanDerWaalsContact C-OD2 3.29Å |
| 300 | L | 95.2 | Very high | 91.2 | Very high | 0 Ų | 0 | 30.6 Ų | 30.6 | 0% | 0 | 18% | 0.183 | C | C | . | . | H | α-helix | trans | -55 | -41.5 | 175.4 | 179.3 | 61.5 | 0 | 0 | 0 | 111.9 | C241 V244 F296 T304 L327 D330 I331 I334 | C241-L300 HydrophobicContact CB-CD2 3.82Å; V244-L300 HydrophobicContact CB-CD2 4.3Å; V244-L300 HydrophobicContact CG1-CB 4.29Å; V244-L300 HydrophobicContact CG1-CD2 4.11Å; V244-L300 HydrophobicContact CG1-CG 3.99Å; F296-L300 WeakPolarHBondContact O-CB 3.5Å; F296-L300 PolarHBondContact O-N 3.24Å; L300-T304 WeakPolarHBondContact O-CB 3.47Å; L300-T304 PolarHBondContact O-N 3.11Å; L300-T304 VanDerWaalsContact O-N 3.08Å; L300-T304 PolarHBondContact O-OG1 3.43Å; L300-L327 HydrophobicContact CD1-CD2 3.72Å; L300-D330 WeakPolarHBondContact CA-OD2 3.37Å; L300-D330 HydrophobicContact CB-CB 4.02Å; L300-D330 HydrophobicContact CD1-CB 4.4Å; L300-D330 PolarHBondContact N-OD2 3.15Å; L300-I331 HydrophobicContact CD1-CD1 4.16Å; L300-I331 HydrophobicContact CD1-CG1 3.88Å; L300-I331 HydrophobicContact CD2-CG1 4Å; L300-I334 HydrophobicContact CB-CD1 4.11Å; L300-I334 HydrophobicContact CD2-CD1 3.75Å |
| 301 | A | 93.3 | Very high | 89.4 | Confident | 8 Ų | 8 | 34.1 Ų | 34.1 | 7% | 0.066 | 19% | 0.193 | C | C | . | . | H | α-helix | trans | -62.1 | -46.6 | 177.1 | 0 | 0 | 0 | 0 | 0 | 111.8 | V244 S248 T297 C298 F299 Q305 | V244-A301 HydrophobicContact CG1-CB 3.71Å; S248-A301 WeakPolarHBondContact OG-CA 3.19Å; S248-A301 PolarHBondContact OG-O 3.2Å; T297-A301 PolarHBondContact O-N 3.37Å; T297-A301 VanDerWaalsContact O-N 3.12Å; C298-A301 WeakPolarHBondContact O-CB 3.4Å; C298-A301 PolarHBondContact O-N 2.82Å; F299-A301 PolarHBondContact O-N 3.11Å; A301-Q305 WeakPolarHBondContact O-CG 3.36Å; A301-Q305 PolarHBondContact O-N 3.41Å; A301-Q305 VanDerWaalsContact O-N 3.1Å |
| 302 | V | 92 | Very high | 87.4 | Confident | 1 Ų | 1 | 37.7 Ų | 37.7 | 1% | 0.006 | 21% | 0.207 | C | C | . | . | H | α-helix | trans | -67.6 | -49.2 | -179.5 | 162.9 | 0 | 0 | 0 | 0 | 112.7 | F255 R259 L262 C298 F299 T304 Q305 L306 | F255-V302 HydrophobicContact CB-CG2 3.6Å; F255-V302 VanDerWaalsContact O-CG2 3.31Å; F255-V302 WeakPolarHBondContact O-CG2 3.46Å; R259-V302 HydrophobicContact CG-CG1 3.41Å; R259-V302 VanDerWaalsContact CG-CG1 3.41Å; L262-V302 HydrophobicContact CD1-CB 4.3Å; L262-V302 HydrophobicContact CD1-CG2 3.64Å; C298-V302 WeakPolarHBondContact O-CG2 3.05Å; C298-V302 PolarHBondContact O-N 2.89Å; C298-V302 VanDerWaalsContact O-N 3.09Å; F299-V302 WeakPolarHBondContact O-CB 3.49Å; F299-V302 PolarHBondContact O-N 3.35Å; V302-T304 VanDerWaalsContact C-N 3.26Å; V302-T304 PolarHBondContact O-N 2.96Å; V302-Q305 CarbonylContact O-C 3.57Å; V302-Q305 WeakPolarHBondContact O-CA 3.41Å; V302-Q305 PolarHBondContact O-N 3.47Å; V302-L306 HydrophobicContact CG1-CD1 4.05Å; V302-L306 WeakPolarHBondContact O-CG 3.39Å; V302-L306 PolarHBondContact O-N 3.49Å |
| 303 | D | 92.1 | Very high | 85.5 | Confident | 22 Ų | 22 | 40.8 Ų | 40.8 | 12% | 0.118 | 22% | 0.223 | C | C | . | . | H | α-helix | trans | -71.9 | -26.5 | -176.9 | -85.6 | 33.5 | 0 | 0 | 0 | 111.1 | F299 L306 L307 N326 L327 | F299-D303 PolarHBondContact O-N 2.94Å; D303-L306 WeakPolarHBondContact OD1-CD1 3.44Å; D303-L307 WeakPolarHBondContact O-CB 3.35Å; D303-L307 PolarHBondContact O-N 2.96Å; D303-N326 VanDerWaalsContact OD2-CB 3.29Å; D303-N326 WeakPolarHBondContact OD2-CB 3.45Å; D303-N326 PolarHBondContact OD2-ND2 3.1Å; D303-L327 HydrophobicContact CB-CD2 4.05Å |
| 304 | T | 91.3 | Very high | 83.6 | Confident | 1 Ų | 1 | 40.9 Ų | 40.9 | 1% | 0.006 | 22% | 0.224 | C | C | . | . | H | α-helix | trans | -64.5 | -43 | 164.7 | -58.6 | 0 | 0 | 0 | 0 | 111.4 | V245 L300 V302 L307 L308 L327 | V245-T304 HydrophobicContact CG1-CG2 4.37Å; L300-T304 WeakPolarHBondContact O-CB 3.47Å; L300-T304 PolarHBondContact O-N 3.11Å; L300-T304 VanDerWaalsContact O-N 3.08Å; L300-T304 PolarHBondContact O-OG1 3.43Å; V302-T304 VanDerWaalsContact C-N 3.26Å; V302-T304 PolarHBondContact O-N 2.96Å; T304-L307 WeakPolarHBondContact O-CB 3.42Å; T304-L307 PolarHBondContact O-N 3.5Å; T304-L308 HydrophobicContact CG2-CD1 3.83Å; T304-L308 HydrophobicContact CG2-CG 4.48Å; T304-L308 WeakPolarHBondContact O-CD1 3.48Å; T304-L308 WeakPolarHBondContact O-CG 3.34Å; T304-L308 PolarHBondContact O-N 3.34Å; T304-L308 VanDerWaalsContact O-N 3.14Å; T304-L327 WeakPolarHBondContact OG1-CD2 3.49Å |
| 305 | Q | 89.9 | Confident | 81.7 | Confident | 16 Ų | 16 | 41.6 Ų | 41.6 | 8% | 0.075 | 23% | 0.228 | C | C | . | . | H | α-helix | trans | -68.6 | -36.6 | 177.5 | -75.6 | -172.5 | -24.2 | 0 | 0 | 113.1 | Y253 A301 V302 L308 G309 | Y253-Q305 PolarHBondContact O-NE2 3.38Å; A301-Q305 WeakPolarHBondContact O-CG 3.36Å; A301-Q305 PolarHBondContact O-N 3.41Å; A301-Q305 VanDerWaalsContact O-N 3.1Å; V302-Q305 CarbonylContact O-C 3.57Å; V302-Q305 WeakPolarHBondContact O-CA 3.41Å; V302-Q305 PolarHBondContact O-N 3.47Å; Q305-L308 PolarHBondContact O-N 3.45Å; Q305-G309 PolarHBondContact O-N 2.83Å |
| 306 | L | 86.3 | Confident | 80.2 | Confident | 27 Ų | 27 | 42.6 Ų | 42.6 | 14% | 0.141 | 24% | 0.236 | C | C | . | . | H | α-helix | trans | -60.9 | -44.9 | 172.5 | -73.1 | 167.8 | 0 | 0 | 0 | 112 | T256 R259 V302 D303 L308 N310 | T256-L306 HydrophobicContact CG2-CD2 3.46Å; T256-L306 VanDerWaalsContact CG2-CD2 3.46Å; T256-L306 HydrophobicContact CG2-CG 4.04Å; R259-L306 VanDerWaalsContact CZ-CD1 3.41Å; V302-L306 HydrophobicContact CG1-CD1 4.05Å; V302-L306 WeakPolarHBondContact O-CG 3.39Å; V302-L306 PolarHBondContact O-N 3.49Å; D303-L306 WeakPolarHBondContact OD1-CD1 3.44Å; L306-L308 VanDerWaalsContact C-N 3.29Å; L306-L308 PolarHBondContact O-N 2.86Å; L306-N310 WeakPolarHBondContact O-CB 3.48Å; L306-N310 PolarHBondContact O-N 3.25Å |
| 307 | L | 86.9 | Confident | 78.5 | Confident | 10 Ų | 10 | 44.7 Ų | 44.7 | 5% | 0.052 | 25% | 0.252 | C | S | . | . | H | α-helix | trans | -59 | -38.8 | 175.9 | 174.4 | 67.5 | 0 | 0 | 0 | 112.4 | F137 I138 V141 F142 D303 T304 A323 L327 | F137-L307 HydrophobicContact CD1-CD1 4.09Å; F137-L307 HydrophobicContact CE1-CD1 3.55Å; F137-L307 HydrophobicContact CZ-CD1 4.36Å; I138-L307 HydrophobicContact CG1-CG 4.41Å; V141-L307 HydrophobicContact CB-CD1 3.92Å; V141-L307 HydrophobicContact CB-CD2 4.2Å; V141-L307 HydrophobicContact CG1-CD1 3.94Å; V141-L307 HydrophobicContact CG1-CD2 3.78Å; V141-L307 HydrophobicContact CG2-CD1 3.7Å; F142-L307 HydrophobicContact CD2-CD2 4.1Å; F142-L307 HydrophobicContact CE2-CD2 3.54Å; F142-L307 HydrophobicContact CZ-CD2 4.12Å; D303-L307 WeakPolarHBondContact O-CB 3.35Å; D303-L307 PolarHBondContact O-N 2.96Å; T304-L307 WeakPolarHBondContact O-CB 3.42Å; T304-L307 PolarHBondContact O-N 3.5Å; L307-A323 HydrophobicContact CD1-CB 4.16Å; L307-L327 HydrophobicContact CD2-CD1 3.83Å |
| 308 | L | 82.9 | Confident | 77 | Confident | 37 Ų | 37 | 44.4 Ų | 44.4 | 19% | 0.194 | 25% | 0.248 | C | C | . | . | H | α-helix | trans | -83.5 | -37.9 | -175.8 | -67.1 | 167.6 | 0 | 0 | 0 | 113.2 | I138 L249 T304 Q305 L306 | I138-L308 HydrophobicContact CD1-CD2 3.87Å; I138-L308 HydrophobicContact CG1-CD2 4.4Å; I138-L308 HydrophobicContact CG2-CD2 4.38Å; L249-L308 HydrophobicContact CD2-CD1 3.68Å; L249-L308 HydrophobicContact CD2-CD2 3.74Å; L249-L308 HydrophobicContact CD2-CG 4.38Å; L249-L308 HydrophobicContact CG-CD1 4.22Å; T304-L308 HydrophobicContact CG2-CD1 3.83Å; T304-L308 HydrophobicContact CG2-CG 4.48Å; T304-L308 WeakPolarHBondContact O-CD1 3.48Å; T304-L308 WeakPolarHBondContact O-CG 3.34Å; T304-L308 PolarHBondContact O-N 3.34Å; T304-L308 VanDerWaalsContact O-N 3.14Å; Q305-L308 PolarHBondContact O-N 3.45Å; L306-L308 VanDerWaalsContact C-N 3.29Å; L306-L308 PolarHBondContact O-N 2.86Å |
| 309 | G | 72.8 | Confident | 76.1 | Confident | 59 Ų | 59 | 45.1 Ų | 45.1 | 61% | 0.608 | 25% | 0.247 | S | C | * | . | H | α-helix | trans | -92.5 | -31.9 | -168.3 | 0 | 0 | 0 | 0 | 0 | 115.4 | Q305 K311 | Q305-G309 PolarHBondContact O-N 2.83Å; G309-K311 PolarHBondContact O-N 3.17Å |
| 310 | N | 68.9 | Low | 75.6 | Confident | 65 Ų | 65 | 44.2 Ų | 44.2 | 35% | 0.348 | 24% | 0.243 | S | C | . | . | trans | -86.2 | 106.2 | -171.4 | -165.7 | -23.2 | 0 | 0 | 0 | 112.6 | L306 Q312 L313 | L306-N310 WeakPolarHBondContact O-CB 3.48Å; L306-N310 PolarHBondContact O-N 3.25Å; N310-Q312 VanDerWaalsContact C-N 3.35Å; N310-Q312 PolarHBondContact O-N 3.15Å; N310-Q312 PolarHBondContact OD1-N 2.7Å; N310-L313 HydrophobicContact CB-CB 4.31Å; N310-L313 HydrophobicContact CB-CD1 3.88Å; N310-L313 HydrophobicContact CB-CG 4.05Å; N310-L313 WeakPolarHBondContact ND2-CD1 3.49Å; N310-L313 WeakPolarHBondContact ND2-CG 3.42Å | ||
| 311 | K | 59.2 | Low | 75 | Confident | 122 Ų | 122 | 44.5 Ų | 44.5 | 53% | 0.53 | 25% | 0.245 | S | C | . | . | S | Bend | trans | -60.5 | -36.1 | 178.1 | -68.2 | -168.6 | 175.4 | -161.2 | 0 | 114.3 | D130 G309 | D130-K311 WeakPolarHBondContact OD2-CE 3.3Å; D130-K311 IonicContact OD2-NZ 3.05Å; D130-K311 PolarHBondContact OD2-NZ 3.06Å; G309-K311 PolarHBondContact O-N 3.17Å |
| 312 | Q | 56.4 | Low | 74.6 | Confident | 163 Ų | 163 | 49.5 Ų | 49.5 | 76% | 0.762 | 27% | 0.265 | S | S | * | . | G | 310 helix | trans | -78.7 | -25.9 | -173.3 | -66.8 | -166.6 | 2.6 | 0 | 0 | 112.8 | N310 A314 | N310-Q312 VanDerWaalsContact C-N 3.35Å; N310-Q312 PolarHBondContact O-N 3.15Å; N310-Q312 PolarHBondContact OD1-N 2.7Å; Q312-A314 PolarHBondContact O-N 3.32Å |
| 313 | L | 55.8 | Low | 74.5 | Confident | 65 Ų | 65 | 50.3 Ų | 50.3 | 34% | 0.34 | 27% | 0.272 | S | S | . | . | G | 310 helix | trans | -75 | 2.5 | 176.6 | -63 | 179.6 | 0 | 0 | 0 | 114.2 | F137 N310 E319 | F137-L313 VanDerWaalsContact CE2-O 3.24Å; F137-L313 WeakPolarHBondContact CE2-O 2.98Å; F137-L313 WeakPolarHBondContact CZ-O 3.4Å; N310-L313 HydrophobicContact CB-CB 4.31Å; N310-L313 HydrophobicContact CB-CD1 3.88Å; N310-L313 HydrophobicContact CB-CG 4.05Å; N310-L313 WeakPolarHBondContact ND2-CD1 3.49Å; N310-L313 WeakPolarHBondContact ND2-CG 3.42Å; L313-E319 VanDerWaalsContact C-OE2 3.24Å; L313-E319 WeakPolarHBondContact CA-OE2 3.44Å; L313-E319 HydrophobicContact CD2-CG 4.17Å; L313-E319 VanDerWaalsContact CD2-OE1 3.26Å; L313-E319 WeakPolarHBondContact CD2-OE1 3.42Å; L313-E319 WeakPolarHBondContact O-CB 3.31Å; L313-E319 VanDerWaalsContact O-OE2 3.07Å |
| 314 | A | 58.2 | Low | 74.5 | Confident | 13 Ų | 13 | 49.3 Ų | 49.3 | 11% | 0.107 | 27% | 0.267 | C | S | . | . | G | 310 helix | trans | -87.9 | -2 | -176.9 | 0 | 0 | 0 | 0 | 0 | 113.8 | F137 Q312 | F137-A314 HydrophobicContact CB-CB 4.33Å; F137-A314 HydrophobicContact CD1-CB 4.17Å; F137-A314 HydrophobicContact CG-CB 4.14Å; Q312-A314 PolarHBondContact O-N 3.32Å |
| 315 | L | 56.2 | Low | 74.4 | Confident | 127 Ų | 127 | 49.9 Ų | 49.9 | 67% | 0.665 | 27% | 0.27 | S | S | * | . | S | Bend | trans | -112.2 | -25.4 | -162.8 | -64.2 | 171.4 | 0 | 0 | 0 | 114.3 | I133 | I133-L315 HydrophobicContact CG2-CD2 4.18Š|
| 316 | S | 64.1 | Low | 74.5 | Confident | 32 Ų | 32 | 50.8 Ų | 50.8 | 22% | 0.224 | 28% | 0.275 | C | S | . | . | trans | -88.5 | 136.4 | 178.7 | -173.1 | 0 | 0 | 0 | 0 | 113.2 | E318 E319 | S316-E318 PolarHBondContact O-N 2.74Å; S316-E318 PolarHBondContact OG-N 2.73Å; S316-E318 VanDerWaalsContact OG-N 3.15Å; S316-E319 WeakPolarHBondContact CA-OE2 3.44Å; S316-E319 VanDerWaalsContact CB-CD 3.42Å; S316-E319 WeakPolarHBondContact CB-OE2 3.18Å; S316-E319 PolarHBondContact N-OE2 3.21Å; S316-E319 PolarHBondContact O-N 3.03Å | ||
| 317 | P | 61.6 | Low | 75 | Confident | 69 Ų | 69 | 49.6 Ų | 49.6 | 45% | 0.448 | 27% | 0.269 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -58.1 | -13.2 | 165 | -24.8 | 35.4 | 0 | 0 | 0 | 114.9 | Y320 | P317-Y320 HydrophobicContact CB-CE1 4.32Å; P317-Y320 WeakPolarHBondContact O-CD1 3.36Å; P317-Y320 WeakPolarHBondContact O-CE1 3.29Å |
| 318 | E | 65.1 | Low | 75.4 | Confident | 26 Ų | 26 | 49.1 Ų | 49.1 | 12% | 0.121 | 27% | 0.266 | C | S | . | . | T | Hydrogen-bonded Turn | trans | -86.2 | -29.1 | 178 | -58 | -179 | 115.8 | 0 | 0 | 112.8 | R197 R198 S316 F322 | R197-E318 HydrophobicContact CG-CG 4.4Å; R198-E318 HydrophobicContact CG-CG 3.85Å; R198-E318 WeakPolarHBondContact CG-OE1 3.18Å; R198-E318 IonicContact CZ-OE1 3.29Å; R198-E318 IonicContact CZ-OE2 3.89Å; R198-E318 VanDerWaalsContact CZ-OE2 3.29Å; R198-E318 IonicContact NE-OE1 3.03Å; R198-E318 PolarHBondContact NE-OE1 3.26Å; R198-E318 IonicContact NE-OE2 3.7Å; R198-E318 PolarHBondContact NE-OE2 3.48Å; R198-E318 IonicContact NH2-OE1 2.73Å; R198-E318 IonicContact NH2-OE2 2.74Å; R198-E318 PolarHBondContact NH2-OE2 3.4Å; S316-E318 PolarHBondContact O-N 2.74Å; S316-E318 PolarHBondContact OG-N 2.73Å; S316-E318 VanDerWaalsContact OG-N 3.15Å; E318-F322 PolarHBondContact O-N 2.91Å |
| 319 | E | 76.6 | Confident | 76 | Confident | 54 Ų | 54 | 48.8 Ų | 48.8 | 25% | 0.252 | 27% | 0.266 | S | S | . | . | H | α-helix | trans | -76.5 | -39.7 | -170.9 | -71.6 | 161.4 | 155.3 | 0 | 0 | 111.5 | F137 L313 S316 I321 F322 A323 | F137-E319 HydrophobicContact CE2-CB 4.29Å; F137-E319 HydrophobicContact CZ-CB 4.22Å; L313-E319 VanDerWaalsContact C-OE2 3.24Å; L313-E319 WeakPolarHBondContact CA-OE2 3.44Å; L313-E319 HydrophobicContact CD2-CG 4.17Å; L313-E319 VanDerWaalsContact CD2-OE1 3.26Å; L313-E319 WeakPolarHBondContact CD2-OE1 3.42Å; L313-E319 WeakPolarHBondContact O-CB 3.31Å; L313-E319 VanDerWaalsContact O-OE2 3.07Å; S316-E319 WeakPolarHBondContact CA-OE2 3.44Å; S316-E319 VanDerWaalsContact CB-CD 3.42Å; S316-E319 WeakPolarHBondContact CB-OE2 3.18Å; S316-E319 PolarHBondContact N-OE2 3.21Å; S316-E319 PolarHBondContact O-N 3.03Å; E319-I321 PolarHBondContact O-N 3.2Å; E319-F322 PolarHBondContact O-N 3.25Å; E319-A323 VanDerWaalsContact O-CB 3.31Å; E319-A323 WeakPolarHBondContact O-CB 3.27Å; E319-A323 PolarHBondContact O-N 3.3Å |
| 320 | Y | 82.8 | Confident | 77.2 | Confident | 11 Ų | 11 | 46.4 Ų | 46.4 | 4% | 0.043 | 24% | 0.239 | C | C | . | . | H | α-helix | trans | -63.8 | -33 | 176.3 | 86.3 | -93.2 | 0 | 0 | 0 | 112 | K140 V144 P317 S324 | K140-Y320 HydrophobicContact CD-CD1 4.27Å; K140-Y320 HydrophobicContact CD-CD2 4Å; K140-Y320 HydrophobicContact CD-CE1 4.48Å; K140-Y320 HydrophobicContact CD-CE2 4.21Å; K140-Y320 HydrophobicContact CD-CG 4.04Å; K140-Y320 VanDerWaalsContact CE-CZ 3.48Å; K140-Y320 HydrophobicContact CG-CD2 4.1Å; K140-Y320 HydrophobicContact CG-CE2 4.4Å; V144-Y320 HydrophobicContact CG2-CD2 4.4Å; V144-Y320 HydrophobicContact CG2-CE2 4.19Å; P317-Y320 HydrophobicContact CB-CE1 4.32Å; P317-Y320 WeakPolarHBondContact O-CD1 3.36Å; P317-Y320 WeakPolarHBondContact O-CE1 3.29Å; Y320-S324 WeakPolarHBondContact O-CB 3.47Å; Y320-S324 PolarHBondContact O-N 2.9Å; Y320-S324 PolarHBondContact O-OG 2.7Å; Y320-S324 VanDerWaalsContact O-OG 3.06Å |
| 321 | I | 83.7 | Confident | 78.5 | Confident | 6 Ų | 6 | 44.2 Ų | 44.2 | 3% | 0.031 | 23% | 0.227 | C | C | . | . | H | α-helix | trans | -70.5 | -48.3 | 177.8 | -63.1 | 178.9 | 0 | 0 | 0 | 110 | N203 L207 E319 S324 L325 | N203-I321 HydrophobicContact CB-CD1 3.66Å; L207-I321 HydrophobicContact CD1-CG2 4.16Å; L207-I321 HydrophobicContact CD2-CG2 4.31Å; E319-I321 PolarHBondContact O-N 3.2Å; I321-S324 WeakPolarHBondContact CA-OG 3.5Å; I321-S324 PolarHBondContact O-N 2.81Å; I321-S324 PolarHBondContact O-OG 3.4Å; I321-L325 VanDerWaalsContact O-CB 3.31Å; I321-L325 WeakPolarHBondContact O-CB 3.06Å; I321-L325 PolarHBondContact O-N 2.8Å |
| 322 | F | 84.8 | Confident | 80.4 | Confident | 113 Ų | 113 | 38.7 Ų | 38.7 | 50% | 0.496 | 20% | 0.203 | S | C | . | . | H | α-helix | trans | -63.2 | -45 | 178.6 | -172.5 | -105.4 | 0 | 0 | 0 | 111.7 | E318 E319 S324 L325 N326 | E318-F322 PolarHBondContact O-N 2.91Å; E319-F322 PolarHBondContact O-N 3.25Å; F322-S324 PolarHBondContact O-N 3.34Å; F322-L325 PolarHBondContact O-N 3.05Å; F322-N326 WeakPolarHBondContact CE1-ND2 3.37Å; F322-N326 PolarHBondContact O-N 2.62Å; F322-N326 PolarHBondContact O-OD1 3.33Å |
| 323 | A | 89.1 | Confident | 82.3 | Confident | 19 Ų | 19 | 32.8 Ų | 32.8 | 16% | 0.157 | 18% | 0.177 | C | C | . | . | H | α-helix | trans | -62.3 | -42.4 | 175.5 | 0 | 0 | 0 | 0 | 0 | 112.5 | V141 L307 E319 L325 L327 | V141-A323 HydrophobicContact CG1-CB 4.2Å; V141-A323 HydrophobicContact CG2-CB 4.32Å; L307-A323 HydrophobicContact CD1-CB 4.16Å; E319-A323 VanDerWaalsContact O-CB 3.31Å; E319-A323 WeakPolarHBondContact O-CB 3.27Å; E319-A323 PolarHBondContact O-N 3.3Å; A323-L325 VanDerWaalsContact C-N 3.33Å; A323-L325 PolarHBondContact O-N 3.3Å; A323-L327 VanDerWaalsContact O-CG 3.29Å; A323-L327 WeakPolarHBondContact O-CG 3.4Å; A323-L327 PolarHBondContact O-N 2.89Å |
| 324 | S | 91.2 | Very high | 84.3 | Confident | 0 Ų | 0 | 29.7 Ų | 29.7 | 0% | 0 | 16% | 0.161 | C | C | . | . | H | α-helix | trans | -63.9 | -38.8 | 174.3 | 60.9 | 0 | 0 | 0 | 0 | 112.3 | V144 Q148 Y320 I321 F322 Y328 | V144-S324 WeakPolarHBondContact CG1-OG 3.25Å; Q148-S324 PolarHBondContact OE1-O 3.47Å; Y320-S324 WeakPolarHBondContact O-CB 3.47Å; Y320-S324 PolarHBondContact O-N 2.9Å; Y320-S324 PolarHBondContact O-OG 2.7Å; Y320-S324 VanDerWaalsContact O-OG 3.06Å; I321-S324 WeakPolarHBondContact CA-OG 3.5Å; I321-S324 PolarHBondContact O-N 2.81Å; I321-S324 PolarHBondContact O-OG 3.4Å; F322-S324 PolarHBondContact O-N 3.34Å; S324-Y328 WeakPolarHBondContact O-CB 3.36Å; S324-Y328 PolarHBondContact O-N 3.22Å |
| 325 | L | 90.7 | Very high | 86.2 | Confident | 14 Ų | 14 | 29.8 Ų | 29.8 | 7% | 0.073 | 16% | 0.159 | C | C | . | . | H | α-helix | trans | -67.1 | -44 | -179.7 | -178.1 | 63.6 | 0 | 0 | 0 | 111.8 | L187 L210 I321 F322 A323 Y328 T329 | L187-L325 HydrophobicContact CD2-CD2 3.94Å; L210-L325 HydrophobicContact CD1-CD1 3.98Å; L210-L325 HydrophobicContact CD1-CD2 3.87Å; I321-L325 VanDerWaalsContact O-CB 3.31Å; I321-L325 WeakPolarHBondContact O-CB 3.06Å; I321-L325 PolarHBondContact O-N 2.8Å; F322-L325 PolarHBondContact O-N 3.05Å; A323-L325 VanDerWaalsContact C-N 3.33Å; A323-L325 PolarHBondContact O-N 3.3Å; L325-Y328 HydrophobicContact CD1-CD1 4.39Å; L325-Y328 WeakPolarHBondContact O-CB 3.24Å; L325-Y328 PolarHBondContact O-N 3.22Å; L325-T329 HydrophobicContact CD1-CG2 4.48Å; L325-T329 WeakPolarHBondContact O-CG2 3.47Å; L325-T329 PolarHBondContact O-N 3.02Å; L325-T329 PolarHBondContact O-OG1 3.37Å; L325-T329 VanDerWaalsContact O-OG1 3.11Å |
| 326 | N | 92.4 | Very high | 88.2 | Confident | 34 Ų | 34 | 25.5 Ų | 25.5 | 18% | 0.182 | 14% | 0.137 | C | C | . | . | H | α-helix | trans | -61.9 | -54.1 | 177.5 | -73.2 | 16 | 0 | 0 | 0 | 111.3 | D303 F322 Y328 T329 D330 | D303-N326 VanDerWaalsContact OD2-CB 3.29Å; D303-N326 WeakPolarHBondContact OD2-CB 3.45Å; D303-N326 PolarHBondContact OD2-ND2 3.1Å; F322-N326 WeakPolarHBondContact CE1-ND2 3.37Å; F322-N326 PolarHBondContact O-N 2.62Å; F322-N326 PolarHBondContact O-OD1 3.33Å; N326-Y328 PolarHBondContact O-N 3.38Å; N326-T329 WeakPolarHBondContact CA-OG1 3.42Å; N326-T329 PolarHBondContact O-N 3.31Å; N326-T329 PolarHBondContact O-OG1 3.34Å; N326-D330 PolarHBondContact O-N 3.01Å |
| 327 | L | 95 | Very high | 89.8 | Confident | 2 Ų | 2 | 25.5 Ų | 25.5 | 1% | 0.01 | 13% | 0.132 | C | C | . | . | H | α-helix | trans | -58.3 | -37.2 | 178.2 | -66 | 171.5 | 0 | 0 | 0 | 111.9 | V141 L145 L300 D303 T304 L307 A323 I331 | V141-L327 HydrophobicContact CG1-CD1 4.05Å; L145-L327 HydrophobicContact CD1-CB 4.19Å; L145-L327 HydrophobicContact CD2-CB 3.83Å; L145-L327 HydrophobicContact CD2-CD1 4.25Å; L300-L327 HydrophobicContact CD1-CD2 3.72Å; D303-L327 HydrophobicContact CB-CD2 4.05Å; T304-L327 WeakPolarHBondContact OG1-CD2 3.49Å; L307-L327 HydrophobicContact CD2-CD1 3.83Å; A323-L327 VanDerWaalsContact O-CG 3.29Å; A323-L327 WeakPolarHBondContact O-CG 3.4Å; A323-L327 PolarHBondContact O-N 2.89Å; L327-I331 WeakPolarHBondContact O-CD1 3.4Å; L327-I331 VanDerWaalsContact O-CG1 3.24Å; L327-I331 WeakPolarHBondContact O-CG1 3.44Å; L327-I331 PolarHBondContact O-N 3.11Å; L327-I331 VanDerWaalsContact O-N 3.12Å |
| 328 | Y | 96.4 | Very high | 91.6 | Very high | 0 Ų | 0 | 22.8 Ų | 22.8 | 0% | 0 | 11% | 0.113 | C | C | . | . | H | α-helix | trans | -63.2 | -51 | 172.5 | 173.2 | -113.9 | 0 | 0 | 0 | 111.3 | Q148 L149 T152 T211 M214 S215 S324 L325 N326 D330 I331 I332 | Q148-Y328 HydrophobicContact CB-CD2 3.6Å; Q148-Y328 HydrophobicContact CB-CE2 3.8Å; Q148-Y328 HydrophobicContact CB-CG 4.13Å; L149-Y328 HydrophobicContact CD2-CD2 3.96Å; L149-Y328 HydrophobicContact CD2-CE2 4.29Å; L149-Y328 HydrophobicContact CG-CD2 4.44Å; T152-Y328 VanDerWaalsContact OG1-CE2 3.28Å; T152-Y328 WeakPolarHBondContact OG1-CE2 3.37Å; T152-Y328 PolarHBondContact OG1-OH 2.86Å; T211-Y328 PolarHBondContact O-OH 2.92Å; M214-Y328 HydrophobicContact CB-CE1 4.05Å; M214-Y328 HydrophobicContact CG-CE1 3.88Å; M214-Y328 HydrophobicContact SD-CD1 4.08Å; M214-Y328 HydrophobicContact SD-CE1 3.48Å; M214-Y328 WeakPolarHBondContact SD-CE1 3.5Å; S215-Y328 PolarHBondContact OG-OH 3.49Å; S324-Y328 WeakPolarHBondContact O-CB 3.36Å; S324-Y328 PolarHBondContact O-N 3.22Å; L325-Y328 HydrophobicContact CD1-CD1 4.39Å; L325-Y328 WeakPolarHBondContact O-CB 3.24Å; L325-Y328 PolarHBondContact O-N 3.22Å; N326-Y328 PolarHBondContact O-N 3.38Å; Y328-D330 VanDerWaalsContact C-N 3.31Å; Y328-D330 PolarHBondContact O-N 3.49Å; Y328-I331 PolarHBondContact O-N 3.37Å; Y328-I332 HydrophobicContact CD2-CG1 3.93Å; Y328-I332 HydrophobicContact CE1-CG1 4.38Å; Y328-I332 HydrophobicContact CE2-CD1 3.91Å; Y328-I332 HydrophobicContact CE2-CG1 3.6Å; Y328-I332 HydrophobicContact CG-CG1 4.44Å; Y328-I332 WeakPolarHBondContact O-CB 3.48Å; Y328-I332 VanDerWaalsContact O-CG1 3.25Å; Y328-I332 WeakPolarHBondContact O-CG1 3.45Å; Y328-I332 PolarHBondContact O-N 3.29Å |
| 329 | T | 95.3 | Very high | 93.1 | Very high | 30 Ų | 30 | 21.5 Ų | 21.5 | 18% | 0.184 | 11% | 0.108 | C | C | . | . | H | α-helix | trans | -62.5 | -35.8 | 178.7 | 49.3 | 0 | 0 | 0 | 0 | 113 | M214 L325 N326 I332 N333 | M214-T329 HydrophobicContact CE-CG2 4.13Å; M214-T329 HydrophobicContact SD-CG2 4.02Å; L325-T329 HydrophobicContact CD1-CG2 4.48Å; L325-T329 WeakPolarHBondContact O-CG2 3.47Å; L325-T329 PolarHBondContact O-N 3.02Å; L325-T329 PolarHBondContact O-OG1 3.37Å; L325-T329 VanDerWaalsContact O-OG1 3.11Å; N326-T329 WeakPolarHBondContact CA-OG1 3.42Å; N326-T329 PolarHBondContact O-N 3.31Å; N326-T329 PolarHBondContact O-OG1 3.34Å; T329-I332 PolarHBondContact O-N 3Å; T329-N333 WeakPolarHBondContact O-CB 3.32Å; T329-N333 VanDerWaalsContact O-CG 3.23Å; T329-N333 PolarHBondContact O-N 3.45Å; T329-N333 PolarHBondContact O-ND2 2.89Å |
| 330 | D | 96.9 | Very high | 94 | Very high | 9 Ų | 9 | 19.9 Ų | 19.9 | 5% | 0.048 | 10% | 0.104 | C | C | . | . | H | α-helix | trans | -65.1 | -50.3 | 176.4 | -69.2 | -19.5 | 0 | 0 | 0 | 111.1 | F296 F299 L300 N326 Y328 I332 N333 I334 | F296-D330 WeakPolarHBondContact CD1-OD1 3.29Å; F299-D330 VanDerWaalsContact C-OD2 3.29Å; L300-D330 WeakPolarHBondContact CA-OD2 3.37Å; L300-D330 HydrophobicContact CB-CB 4.02Å; L300-D330 HydrophobicContact CD1-CB 4.4Å; L300-D330 PolarHBondContact N-OD2 3.15Å; N326-D330 PolarHBondContact O-N 3.01Å; Y328-D330 VanDerWaalsContact C-N 3.31Å; Y328-D330 PolarHBondContact O-N 3.49Å; D330-I332 VanDerWaalsContact C-N 3.3Å; D330-I332 PolarHBondContact O-N 2.59Å; D330-N333 PolarHBondContact O-N 2.91Å; D330-I334 WeakPolarHBondContact O-CB 3.42Å; D330-I334 WeakPolarHBondContact O-CD1 3.46Å; D330-I334 WeakPolarHBondContact O-CG1 3.39Å; D330-I334 PolarHBondContact O-N 3.08Å |
| 331 | I | 97.7 | Very high | 94.7 | Very high | 19 Ų | 19 | 21.3 Ų | 21.3 | 10% | 0.097 | 11% | 0.111 | C | C | . | . | H | α-helix | trans | -61.8 | -38.9 | 178.2 | -66.3 | 170.2 | 0 | 0 | 0 | 111.2 | L145 L149 T237 C241 L300 L327 Y328 F335 | L145-I331 HydrophobicContact CD1-CD1 4.37Å; L145-I331 HydrophobicContact CD2-CD1 4.18Å; L149-I331 HydrophobicContact CD1-CD1 3.94Å; L149-I331 HydrophobicContact CD1-CG2 4.28Å; L149-I331 HydrophobicContact CD2-CB 4.21Å; L149-I331 HydrophobicContact CD2-CG2 3.61Å; T237-I331 HydrophobicContact CG2-CG2 4.32Å; C241-I331 HydrophobicContact CB-CG1 4.23Å; L300-I331 HydrophobicContact CD1-CD1 4.16Å; L300-I331 HydrophobicContact CD1-CG1 3.88Å; L300-I331 HydrophobicContact CD2-CG1 4Å; L327-I331 WeakPolarHBondContact O-CD1 3.4Å; L327-I331 VanDerWaalsContact O-CG1 3.24Å; L327-I331 WeakPolarHBondContact O-CG1 3.44Å; L327-I331 PolarHBondContact O-N 3.11Å; L327-I331 VanDerWaalsContact O-N 3.12Å; Y328-I331 PolarHBondContact O-N 3.37Å; I331-F335 WeakPolarHBondContact O-CB 3.17Å; I331-F335 PolarHBondContact O-N 3.32Å |
| 332 | I | 98 | Very high | 95.3 | Very high | 6 Ų | 6 | 21.8 Ų | 21.8 | 3% | 0.031 | 11% | 0.114 | C | C | . | . | H | α-helix | trans | -66.7 | -41.1 | 175.4 | -70.5 | -54.9 | 0 | 0 | 0 | 112.1 | L149 T152 M214 V218 Y328 T329 D330 F335 L336 | L149-I332 HydrophobicContact CD2-CD1 4.41Å; T152-I332 HydrophobicContact CG2-CD1 3.58Å; M214-I332 HydrophobicContact CG-CG2 4.2Å; M214-I332 HydrophobicContact SD-CB 4.35Å; M214-I332 HydrophobicContact SD-CG1 4.37Å; M214-I332 HydrophobicContact SD-CG2 3.99Å; V218-I332 HydrophobicContact CG2-CD1 4.37Å; V218-I332 HydrophobicContact CG2-CG2 3.38Å; Y328-I332 HydrophobicContact CD2-CG1 3.93Å; Y328-I332 HydrophobicContact CE1-CG1 4.38Å; Y328-I332 HydrophobicContact CE2-CD1 3.91Å; Y328-I332 HydrophobicContact CE2-CG1 3.6Å; Y328-I332 HydrophobicContact CG-CG1 4.44Å; Y328-I332 WeakPolarHBondContact O-CB 3.48Å; Y328-I332 VanDerWaalsContact O-CG1 3.25Å; Y328-I332 WeakPolarHBondContact O-CG1 3.45Å; Y328-I332 PolarHBondContact O-N 3.29Å; T329-I332 PolarHBondContact O-N 3Å; D330-I332 VanDerWaalsContact C-N 3.3Å; D330-I332 PolarHBondContact O-N 2.59Å; I332-F335 WeakPolarHBondContact O-CB 3.28Å; I332-F335 PolarHBondContact O-N 3.35Å; I332-L336 HydrophobicContact CG2-CD1 4.19Å; I332-L336 WeakPolarHBondContact O-CG 3.4Å; I332-L336 PolarHBondContact O-N 2.87Å |
| 333 | N | 97.3 | Very high | 95.7 | Very high | 40 Ų | 40 | 16.6 Ų | 16.6 | 21% | 0.214 | 9% | 0.093 | C | C | . | . | H | α-helix | trans | -67.7 | -43 | 176 | -75 | -38.5 | 0 | 0 | 0 | 111.3 | F296 T329 D330 F335 L336 Y337 | F296-N333 HydrophobicContact CB-CB 4.17Å; F296-N333 HydrophobicContact CD1-CB 3.75Å; F296-N333 HydrophobicContact CD2-CB 3.9Å; F296-N333 HydrophobicContact CE1-CB 4.08Å; F296-N333 WeakPolarHBondContact CE1-ND2 3.36Å; F296-N333 HydrophobicContact CE2-CB 4.21Å; F296-N333 HydrophobicContact CG-CB 3.64Å; F296-N333 HydrophobicContact CZ-CB 4.29Å; F296-N333 WeakPolarHBondContact CZ-ND2 3.46Å; T329-N333 WeakPolarHBondContact O-CB 3.32Å; T329-N333 VanDerWaalsContact O-CG 3.23Å; T329-N333 PolarHBondContact O-N 3.45Å; T329-N333 PolarHBondContact O-ND2 2.89Å; D330-N333 PolarHBondContact O-N 2.91Å; N333-F335 VanDerWaalsContact C-N 3.29Å; N333-F335 PolarHBondContact O-N 3.33Å; N333-L336 PolarHBondContact O-N 3.43Å; N333-Y337 HydrophobicContact CB-CD2 4.35Å; N333-Y337 HydrophobicContact CB-CE2 4.15Å; N333-Y337 WeakPolarHBondContact O-CB 3.5Å; N333-Y337 WeakPolarHBondContact O-CD2 3.37Å; N333-Y337 PolarHBondContact O-N 3.12Å |
| 334 | I | 98.1 | Very high | 95.9 | Very high | 0 Ų | 0 | 19.8 Ų | 19.8 | 0% | 0 | 10% | 0.101 | C | C | . | . | H | α-helix | trans | -55.2 | -45.9 | 172.1 | -66.3 | 162.4 | 0 | 0 | 0 | 110 | T237 V240 F296 L300 D330 Y337 I338 | T237-I334 HydrophobicContact CG2-CG2 4.15Å; V240-I334 HydrophobicContact CG1-CG2 4.28Å; F296-I334 HydrophobicContact CB-CG1 3.81Å; L300-I334 HydrophobicContact CB-CD1 4.11Å; L300-I334 HydrophobicContact CD2-CD1 3.75Å; D330-I334 WeakPolarHBondContact O-CB 3.42Å; D330-I334 WeakPolarHBondContact O-CD1 3.46Å; D330-I334 WeakPolarHBondContact O-CG1 3.39Å; D330-I334 PolarHBondContact O-N 3.08Å; I334-Y337 PolarHBondContact O-N 2.86Å; I334-I338 HydrophobicContact CG2-CD1 3.54Å; I334-I338 HydrophobicContact CG2-CG1 4.36Å; I334-I338 WeakPolarHBondContact O-CB 2.99Å; I334-I338 VanDerWaalsContact O-CG1 3.25Å; I334-I338 WeakPolarHBondContact O-CG1 3.5Å; I334-I338 PolarHBondContact O-N 2.89Å |
| 335 | F | 98.3 | Very high | 95.7 | Very high | 14 Ų | 14 | 23.3 Ų | 23.3 | 6% | 0.061 | 13% | 0.125 | C | C | . | . | H | α-helix | trans | -58.2 | -52.3 | 174.6 | 172.7 | -112 | 0 | 0 | 0 | 112.8 | V156 V218 V230 A233 V234 T237 I331 I332 N333 Y337 I338 L339 | V156-F335 HydrophobicContact CG1-CZ 4.43Å; V156-F335 HydrophobicContact CG2-CE1 4.38Å; V218-F335 HydrophobicContact CG1-CD1 3.64Å; V218-F335 HydrophobicContact CG1-CE1 3.57Å; V230-F335 HydrophobicContact CG1-CZ 4.43Å; A233-F335 HydrophobicContact CB-CD2 4.37Å; A233-F335 HydrophobicContact CB-CE2 3.94Å; V234-F335 HydrophobicContact CG2-CD2 4.25Å; V234-F335 HydrophobicContact CG2-CE2 3.59Å; V234-F335 HydrophobicContact CG2-CZ 4.25Å; T237-F335 HydrophobicContact CG2-CB 3.99Å; T237-F335 WeakPolarHBondContact OG1-CA 3.38Å; I331-F335 WeakPolarHBondContact O-CB 3.17Å; I331-F335 PolarHBondContact O-N 3.32Å; I332-F335 WeakPolarHBondContact O-CB 3.28Å; I332-F335 PolarHBondContact O-N 3.35Å; N333-F335 VanDerWaalsContact C-N 3.29Å; N333-F335 PolarHBondContact O-N 3.33Å; F335-Y337 VanDerWaalsContact C-N 3.31Å; F335-Y337 PolarHBondContact O-N 2.87Å; F335-I338 PolarHBondContact O-N 3.12Å; F335-L339 HydrophobicContact CE1-CD2 4.09Å; F335-L339 HydrophobicContact CE2-CB 4.5Å; F335-L339 HydrophobicContact CZ-CD1 4.37Å; F335-L339 HydrophobicContact CZ-CD2 4.01Å; F335-L339 WeakPolarHBondContact O-CB 3.34Å; F335-L339 PolarHBondContact O-N 3.44Å |
| 336 | L | 97.8 | Very high | 95.4 | Very high | 37 Ų | 37 | 28.8 Ų | 28.8 | 19% | 0.194 | 15% | 0.145 | C | C | . | . | H | α-helix | trans | -63.3 | -36.3 | -177.5 | -70.3 | 176 | 0 | 0 | 0 | 112.3 | V218 I221 I332 N333 L339 A340 | V218-L336 HydrophobicContact CG1-CD2 4.21Å; V218-L336 HydrophobicContact CG2-CD1 4.31Å; I221-L336 HydrophobicContact CB-CD2 4.11Å; I221-L336 HydrophobicContact CD1-CD1 4.21Å; I221-L336 HydrophobicContact CD1-CD2 3.97Å; I221-L336 HydrophobicContact CG2-CD2 3.84Å; I332-L336 HydrophobicContact CG2-CD1 4.19Å; I332-L336 WeakPolarHBondContact O-CG 3.4Å; I332-L336 PolarHBondContact O-N 2.87Å; N333-L336 PolarHBondContact O-N 3.43Å; L336-L339 HydrophobicContact CD2-CD2 4.49Å; L336-A340 WeakPolarHBondContact O-CB 3.42Å; L336-A340 PolarHBondContact O-N 3.25Å |
| 337 | Y | 98.1 | Very high | 94.1 | Very high | 32 Ų | 32 | 33.6 Ų | 33.6 | 13% | 0.125 | 17% | 0.167 | C | C | . | . | H | α-helix | trans | -71.8 | -43.6 | 175.4 | -72.3 | -54.4 | 0 | 0 | 0 | 112.7 | Y288 A289 F296 N333 I334 F335 L339 A340 I341 | Y288-Y337 HydrophobicContact CD1-CE1 4.34Å; Y288-Y337 AromaticContact CE1-CE1 3.69Å; Y288-Y337 HydrophobicContact CE1-CE1 3.69Å; Y288-Y337 PolarHBondContact OH-OH 2.96Å; A289-Y337 HydrophobicContact CB-CD1 4.09Å; A289-Y337 WeakPolarHBondContact O-CB 3.41Å; F296-Y337 HydrophobicContact CD2-CD2 4.15Å; F296-Y337 AromaticContact CD2-CE2 3.54Å; F296-Y337 HydrophobicContact CD2-CE2 3.54Å; F296-Y337 AromaticContact CE2-CE2 3.76Å; F296-Y337 HydrophobicContact CE2-CE2 3.76Å; N333-Y337 HydrophobicContact CB-CD2 4.35Å; N333-Y337 HydrophobicContact CB-CE2 4.15Å; N333-Y337 WeakPolarHBondContact O-CB 3.5Å; N333-Y337 WeakPolarHBondContact O-CD2 3.37Å; N333-Y337 PolarHBondContact O-N 3.12Å; I334-Y337 PolarHBondContact O-N 2.86Å; F335-Y337 VanDerWaalsContact C-N 3.31Å; F335-Y337 PolarHBondContact O-N 2.87Å; Y337-L339 VanDerWaalsContact C-N 3.32Å; Y337-L339 PolarHBondContact O-N 3.23Å; Y337-A340 PolarHBondContact O-N 3.25Å; Y337-I341 VanDerWaalsContact O-CG1 3.3Å; Y337-I341 WeakPolarHBondContact O-CG1 3.36Å; Y337-I341 PolarHBondContact O-N 2.73Å |
| 338 | I | 97.8 | Very high | 94.1 | Very high | 12 Ų | 12 | 35.2 Ų | 35.2 | 6% | 0.062 | 17% | 0.174 | C | C | . | . | H | α-helix | trans | -62 | -42.4 | 174.2 | -70.5 | 170.3 | 0 | 0 | 0 | 110.5 | A233 I236 V240 A293 I334 F335 A340 I341 V342 | A233-I338 HydrophobicContact CB-CG2 3.99Å; I236-I338 HydrophobicContact CB-CG2 3.95Å; I236-I338 HydrophobicContact CD1-CG2 4.33Å; I236-I338 HydrophobicContact CG2-CD1 3.97Å; I236-I338 HydrophobicContact CG2-CG2 4.1Å; V240-I338 HydrophobicContact CG2-CD1 4.47Å; A293-I338 HydrophobicContact CB-CG1 4.41Å; I334-I338 HydrophobicContact CG2-CD1 3.54Å; I334-I338 HydrophobicContact CG2-CG1 4.36Å; I334-I338 WeakPolarHBondContact O-CB 2.99Å; I334-I338 VanDerWaalsContact O-CG1 3.25Å; I334-I338 WeakPolarHBondContact O-CG1 3.5Å; I334-I338 PolarHBondContact O-N 2.89Å; F335-I338 PolarHBondContact O-N 3.12Å; I338-A340 VanDerWaalsContact C-N 3.33Å; I338-A340 PolarHBondContact O-N 2.88Å; I338-I341 PolarHBondContact O-N 3.03Å; I338-I341 VanDerWaalsContact O-N 3.16Å; I338-V342 HydrophobicContact CG2-CG2 4.19Å; I338-V342 WeakPolarHBondContact O-CG2 3.31Å; I338-V342 PolarHBondContact O-N 3.16Å |
| 339 | L | 97.3 | Very high | 94 | Very high | 0 Ų | 0 | 37.1 Ų | 37.1 | 0% | 0 | 18% | 0.184 | C | C | . | . | H | α-helix | trans | -58.2 | -43.8 | 175.4 | -178.2 | 70.4 | 0 | 0 | 0 | 111.7 | I221 A222 Y225 T229 V230 A233 F335 L336 Y337 G343 | I221-L339 HydrophobicContact CG2-CD2 4.37Å; A222-L339 HydrophobicContact CB-CD2 4.35Å; Y225-L339 HydrophobicContact CD1-CD1 4.37Å; Y225-L339 HydrophobicContact CD1-CG 4.28Å; Y225-L339 HydrophobicContact CD2-CD1 4.07Å; Y225-L339 HydrophobicContact CD2-CD2 3.59Å; Y225-L339 HydrophobicContact CD2-CG 3.72Å; Y225-L339 HydrophobicContact CE1-CG 4.32Å; Y225-L339 HydrophobicContact CE2-CD2 3.62Å; Y225-L339 HydrophobicContact CE2-CG 3.76Å; Y225-L339 HydrophobicContact CG-CD1 3.94Å; Y225-L339 HydrophobicContact CG-CD2 4.31Å; Y225-L339 HydrophobicContact CG-CG 3.98Å; T229-L339 HydrophobicContact CG2-CD1 4.14Å; V230-L339 HydrophobicContact CB-CD1 4.39Å; V230-L339 HydrophobicContact CG2-CD1 3.93Å; A233-L339 HydrophobicContact CB-CB 3.93Å; A233-L339 HydrophobicContact CB-CD1 3.82Å; F335-L339 HydrophobicContact CE1-CD2 4.09Å; F335-L339 HydrophobicContact CE2-CB 4.5Å; F335-L339 HydrophobicContact CZ-CD1 4.37Å; F335-L339 HydrophobicContact CZ-CD2 4.01Å; F335-L339 WeakPolarHBondContact O-CB 3.34Å; F335-L339 PolarHBondContact O-N 3.44Å; L336-L339 HydrophobicContact CD2-CD2 4.49Å; Y337-L339 VanDerWaalsContact C-N 3.32Å; Y337-L339 PolarHBondContact O-N 3.23Å; L339-G343 PolarHBondContact O-N 3.09Å |
| 340 | A | 96.1 | Very high | 93.9 | Very high | 20 Ų | 20 | 37.4 Ų | 37.4 | 17% | 0.165 | 18% | 0.184 | C | C | . | . | H | α-helix | trans | -63.3 | -41.8 | 174.2 | 0 | 0 | 0 | 0 | 0 | 112.4 | A289 L336 Y337 I338 R344 | A289-A340 HydrophobicContact CB-CB 3.99Å; L336-A340 WeakPolarHBondContact O-CB 3.42Å; L336-A340 PolarHBondContact O-N 3.25Å; Y337-A340 PolarHBondContact O-N 3.25Å; I338-A340 VanDerWaalsContact C-N 3.33Å; I338-A340 PolarHBondContact O-N 2.88Å; A340-R344 VanDerWaalsContact O-CB 3.27Å; A340-R344 WeakPolarHBondContact O-CB 3.4Å; A340-R344 VanDerWaalsContact O-CG 3.32Å; A340-R344 WeakPolarHBondContact O-CG 3.26Å; A340-R344 PolarHBondContact O-N 3.09Å |
| 341 | I | 96.6 | Very high | 93.7 | Very high | 41 Ų | 41 | 39.1 Ų | 39.1 | 21% | 0.21 | 19% | 0.192 | C | C | . | . | H | α-helix | trans | -63.5 | -50.8 | 176.9 | -64.2 | 161.5 | 0 | 0 | 0 | 111 | A289 A293 Y337 I338 G343 R344 S345 | A289-I341 HydrophobicContact CB-CD1 4.37Å; A289-I341 HydrophobicContact CB-CG1 3.72Å; A293-I341 HydrophobicContact CB-CD1 4.26Å; Y337-I341 VanDerWaalsContact O-CG1 3.3Å; Y337-I341 WeakPolarHBondContact O-CG1 3.36Å; Y337-I341 PolarHBondContact O-N 2.73Å; I338-I341 PolarHBondContact O-N 3.03Å; I338-I341 VanDerWaalsContact O-N 3.16Å; I341-G343 VanDerWaalsContact C-N 3.3Å; I341-G343 PolarHBondContact O-N 2.76Å; I341-R344 PolarHBondContact O-N 2.95Å; I341-S345 VanDerWaalsContact O-CB 3.27Å; I341-S345 WeakPolarHBondContact O-CB 3.26Å; I341-S345 PolarHBondContact O-N 2.84Å; I341-S345 PolarHBondContact O-OG 3.42Å |
| 342 | V | 96.3 | Very high | 93.5 | Very high | 15 Ų | 15 | 40.4 Ų | 40.4 | 9% | 0.091 | 20% | 0.197 | C | C | . | . | H | α-helix | trans | -68.8 | -28.7 | -178.8 | -176.2 | 0 | 0 | 0 | 0 | 111.6 | T229 I232 I236 I338 S345 R346 | T229-V342 HydrophobicContact CG2-CB 4.12Å; T229-V342 HydrophobicContact CG2-CG1 3.97Å; I232-V342 HydrophobicContact CB-CG1 4.11Å; I232-V342 HydrophobicContact CG2-CG1 3.76Å; I232-V342 HydrophobicContact CG2-CG2 4.14Å; I236-V342 HydrophobicContact CD1-CG2 3.99Å; I338-V342 HydrophobicContact CG2-CG2 4.19Å; I338-V342 WeakPolarHBondContact O-CG2 3.31Å; I338-V342 PolarHBondContact O-N 3.16Å; V342-S345 PolarHBondContact O-OG 2.91Å; V342-R346 VanDerWaalsContact O-CD 3.31Å; V342-R346 WeakPolarHBondContact O-CD 3.41Å; V342-R346 VanDerWaalsContact O-CG 3.31Å; V342-R346 WeakPolarHBondContact O-CG 3.45Å |
| 343 | G | 93.9 | Very high | 93.2 | Very high | 4 Ų | 4 | 42.7 Ų | 42.7 | 4% | 0.041 | 21% | 0.209 | C | C | . | . | H | α-helix | trans | -69.5 | -60.3 | 169.9 | 0 | 0 | 0 | 0 | 0 | 112.2 | L339 I341 S345 R346 E347 | L339-G343 PolarHBondContact O-N 3.09Å; I341-G343 VanDerWaalsContact C-N 3.3Å; I341-G343 PolarHBondContact O-N 2.76Å; G343-S345 VanDerWaalsContact C-N 3.25Å; G343-S345 PolarHBondContact O-N 3.45Å; G343-R346 PolarHBondContact O-N 3.3Å; G343-E347 PolarHBondContact O-N 3.43Å |
| 344 | R | 91.9 | Very high | 92.9 | Very high | 86 Ų | 86 | 42.9 Ų | 42.9 | 33% | 0.325 | 21% | 0.208 | S | C | . | . | H | α-helix | trans | -63.5 | -25.1 | -175.4 | -71.7 | -56.2 | -159.4 | -138.4 | -1.9 | 114.6 | D285 A340 I341 R346 E347 | D285-R344 HydrophobicContact CB-CG 4.39Å; D285-R344 IonicContact OD2-CZ 2.76Å; D285-R344 VanDerWaalsContact OD2-CZ 3.31Å; D285-R344 IonicContact OD2-NE 3.32Å; D285-R344 PolarHBondContact OD2-NE 2.88Å; D285-R344 IonicContact OD2-NH2 2.69Å; D285-R344 PolarHBondContact OD2-NH2 3.49Å; A340-R344 VanDerWaalsContact O-CB 3.27Å; A340-R344 WeakPolarHBondContact O-CB 3.4Å; A340-R344 VanDerWaalsContact O-CG 3.32Å; A340-R344 WeakPolarHBondContact O-CG 3.26Å; A340-R344 PolarHBondContact O-N 3.09Å; I341-R344 PolarHBondContact O-N 2.95Å; R344-R346 VanDerWaalsContact C-N 3.26Å; R344-E347 VanDerWaalsContact CD-OE2 3.31Å; R344-E347 WeakPolarHBondContact CD-OE2 3.48Å; R344-E347 IonicContact CZ-OE2 3.7Å; R344-E347 IonicContact NE-OE2 2.88Å; R344-E347 IonicContact NH1-OE1 3.73Å; R344-E347 IonicContact NH1-OE2 3.64Å; R344-E347 PolarHBondContact NH1-OE2 3.46Å |
| 345 | S | 88.9 | Confident | 92.5 | Very high | 74 Ų | 74 | 46.2 Ų | 46.2 | 52% | 0.517 | 22% | 0.224 | S | C | . | . | T | Hydrogen-bonded Turn | trans | -78.4 | -6.9 | 174.5 | 54.5 | 0 | 0 | 0 | 0 | 114.1 | I341 V342 G343 | I341-S345 VanDerWaalsContact O-CB 3.27Å; I341-S345 WeakPolarHBondContact O-CB 3.26Å; I341-S345 PolarHBondContact O-N 2.84Å; I341-S345 PolarHBondContact O-OG 3.42Å; V342-S345 PolarHBondContact O-OG 2.91Å; G343-S345 VanDerWaalsContact C-N 3.25Å; G343-S345 PolarHBondContact O-N 3.45Å |
| 346 | R | 82.4 | Confident | 92 | Very high | 129 Ų | 129 | 48.8 Ų | 48.8 | 49% | 0.487 | 24% | 0.238 | S | C | . | . | trans | -117.9 | 4 | -179.6 | -62.8 | 179.4 | 64.7 | 150.9 | -0.5 | 113.3 | E228 V342 G343 R344 | E228-R346 VanDerWaalsContact CD-NH1 3.29Å; E228-R346 IonicContact OE1-CZ 2.97Å; E228-R346 VanDerWaalsContact OE1-CZ 3.32Å; E228-R346 IonicContact OE1-NH1 3.69Å; E228-R346 PolarHBondContact OE1-NH1 3.39Å; E228-R346 IonicContact OE1-NH2 2.7Å; E228-R346 PolarHBondContact OE1-NH2 2.91Å; E228-R346 IonicContact OE2-CZ 3.31Å; E228-R346 IonicContact OE2-NH1 3.9Å; E228-R346 IonicContact OE2-NH2 2.76Å; E228-R346 PolarHBondContact OE2-NH2 3.23Å; V342-R346 VanDerWaalsContact O-CD 3.31Å; V342-R346 WeakPolarHBondContact O-CD 3.41Å; V342-R346 VanDerWaalsContact O-CG 3.31Å; V342-R346 WeakPolarHBondContact O-CG 3.45Å; G343-R346 PolarHBondContact O-N 3.3Å; R344-R346 VanDerWaalsContact C-N 3.26Å | ||
| 347 | E | 67.2 | Low | 91.5 | Very high | 136 Ų | 136 | 49.9 Ų | 49.9 | 64% | 0.636 | 24% | 0.242 | S | C | * | . | trans | -107.7 | 0 | 178.1 | -73.9 | -177.1 | 158.2 | 0 | 0 | 112.5 | K282 G343 R344 | K282-E347 PolarHBondContact NZ-O 3.09Å; K282-E347 PolarHBondContact NZ-OXT 3.39Å; G343-E347 PolarHBondContact O-N 3.43Å; R344-E347 VanDerWaalsContact CD-OE2 3.31Å; R344-E347 WeakPolarHBondContact CD-OE2 3.48Å; R344-E347 IonicContact CZ-OE2 3.7Å; R344-E347 IonicContact NE-OE2 2.88Å; R344-E347 IonicContact NH1-OE1 3.73Å; R344-E347 IonicContact NH1-OE2 3.64Å; R344-E347 PolarHBondContact NH1-OE2 3.46Å |
Retrieved 347 of 347 residues in 536.2 ms
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