| 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 | 36.6 | Very low | 41.1 | Very low | 240 Ų | 240 | 135 Ų | 135 | 100% | 1.182 | 82% | 0.82 | S | S | * | * | 0 | 108.9 | 0 | -62 | 162.5 | -179.3 | 0 | 0 | 105.4 | |||||
| 2 | A | 36 | Very low | 40.7 | Very low | 90 Ų | 90 | 137.6 Ų | 137.6 | 74% | 0.744 | 82% | 0.824 | S | S | * | * | 81.9 | 134.5 | 55.9 | 0 | 0 | 0 | 0 | 0 | 112.3 | |||||
| 3 | T | 42.6 | Very low | 40.3 | Very low | 132 Ų | 132 | 135.1 Ų | 135.1 | 81% | 0.81 | 82% | 0.817 | S | S | * | * | cis | -170.8 | 142.8 | -9.9 | 21.1 | 0 | 0 | 0 | 0 | 110.7 | ||||
| 4 | A | 42.7 | Very low | 41.6 | Very low | 103 Ų | 103 | 133.8 Ų | 133.8 | 85% | 0.851 | 81% | 0.813 | S | S | * | * | trans | 61.6 | 174 | 154.9 | 0 | 0 | 0 | 0 | 0 | 118 | ||||
| 5 | A | 40.3 | Very low | 41.2 | Very low | 82 Ų | 82 | 131.7 Ų | 131.7 | 68% | 0.678 | 81% | 0.806 | S | S | * | * | cis | -154.7 | 156.7 | 3.3 | 0 | 0 | 0 | 0 | 0 | 115 | ||||
| 6 | S | 41.8 | Very low | 40.8 | Very low | 118 Ų | 118 | 131.3 Ų | 131.3 | 83% | 0.825 | 81% | 0.811 | S | S | * | * | trans | 61.1 | 139.2 | 139.6 | 59 | 0 | 0 | 0 | 0 | 125.1 | ||||
| 7 | S | 41.5 | Very low | 40.8 | Very low | 114 Ų | 114 | 133.9 Ų | 133.9 | 80% | 0.797 | 81% | 0.814 | S | S | * | * | trans | -96.2 | 174.8 | 164.8 | -43.4 | 0 | 0 | 0 | 0 | 112.9 | ||||
| 8 | P | 55.4 | Low | 41.1 | Very low | 118 Ų | 118 | 135.6 Ų | 135.6 | 77% | 0.766 | 82% | 0.816 | S | S | * | * | -150.5 | 135.5 | 121.7 | 35.7 | -18 | 0 | 0 | 0 | 118.6 | |||||
| 9 | Y | 38.3 | Very low | 41 | Very low | 221 Ų | 221 | 137.8 Ų | 137.8 | 87% | 0.867 | 82% | 0.816 | S | S | * | * | trans | 39.5 | 113.5 | 130.2 | -67.9 | -63.8 | 0 | 0 | 0 | 126.1 | ||||
| 10 | T | 38.6 | Very low | 40.8 | Very low | 114 Ų | 114 | 134.9 Ų | 134.9 | 70% | 0.699 | 81% | 0.808 | S | S | * | * | 72.6 | 150.3 | 121.1 | -17.6 | 0 | 0 | 0 | 0 | 125.2 | |||||
| 11 | L | 37.9 | Very low | 40.4 | Very low | 153 Ų | 153 | 134.9 Ų | 134.9 | 80% | 0.801 | 80% | 0.804 | S | S | * | * | trans | 84.5 | 120.7 | 156.7 | -60.3 | 177.2 | 0 | 0 | 0 | 119.5 | ||||
| 12 | L | 36.7 | Very low | 40.4 | Very low | 166 Ų | 166 | 128 Ų | 128 | 87% | 0.869 | 78% | 0.78 | S | S | * | * | -175 | 156 | 110.9 | -99.1 | 164.3 | 0 | 0 | 0 | 115.1 | |||||
| 13 | S | 35.8 | Very low | 40.5 | Very low | 105 Ų | 105 | 132.9 Ų | 132.9 | 73% | 0.734 | 79% | 0.787 | S | S | * | * | trans | -174.4 | 169.2 | 173.1 | -80.2 | 0 | 0 | 0 | 0 | 106 | ||||
| 14 | P | 57.8 | Low | 40.4 | Very low | 117 Ų | 117 | 130.3 Ų | 130.3 | 76% | 0.76 | 78% | 0.779 | S | S | * | * | cis | -129.5 | -164.7 | -10.2 | 35.9 | -15.8 | 0 | 0 | 0 | 112.3 | ||||
| 15 | S | 35.8 | Very low | 40.4 | Very low | 102 Ų | 102 | 134.2 Ų | 134.2 | 71% | 0.713 | 78% | 0.782 | S | S | * | * | trans | 136.8 | 131.9 | 130.2 | -59.7 | 0 | 0 | 0 | 0 | 116.5 | ||||
| 16 | S | 35.1 | Very low | 40.7 | Very low | 126 Ų | 126 | 138 Ų | 138 | 88% | 0.881 | 79% | 0.786 | S | S | * | * | trans | -165.3 | 145.4 | 151.8 | -78.6 | 0 | 0 | 0 | 0 | 108.8 | ||||
| 17 | M | 41.6 | Very low | 41.1 | Very low | 176 Ų | 176 | 138.2 Ų | 138.2 | 87% | 0.867 | 78% | 0.784 | S | S | * | * | trans | -135.9 | 144.9 | -167 | -59.8 | 176.4 | -73.9 | 0 | 0 | 113.3 | ||||
| 18 | I | 45.1 | Very low | 40.7 | Very low | 164 Ų | 164 | 137.3 Ų | 137.3 | 84% | 0.841 | 78% | 0.784 | S | S | * | * | trans | -174.5 | 128.9 | 146.1 | 36.1 | 177.7 | 0 | 0 | 0 | 106.7 | ||||
| 19 | H | 38.8 | Very low | 39.8 | Very low | 177 Ų | 177 | 137.2 Ų | 137.2 | 82% | 0.819 | 79% | 0.786 | S | S | * | * | 55.9 | 130.8 | 66.1 | -89.4 | -92.9 | 0 | 0 | 0 | 114 | |||||
| 20 | A | 38.4 | Very low | 40.6 | Very low | 80 Ų | 80 | 131.5 Ų | 131.5 | 66% | 0.661 | 78% | 0.776 | S | S | * | * | cis | -161.6 | -163.6 | -1 | 0 | 0 | 0 | 0 | 0 | 109.7 | ||||
| 21 | D | 32.4 | Very low | 40.3 | Very low | 134 Ų | 134 | 136.5 Ų | 136.5 | 72% | 0.717 | 78% | 0.784 | S | S | * | * | cis | -162 | 167.5 | 2.9 | -141.4 | 120.2 | 0 | 0 | 0 | 112.8 | ||||
| 22 | S | 36.6 | Very low | 40.2 | Very low | 96 Ų | 96 | 140.6 Ų | 140.6 | 67% | 0.671 | 79% | 0.788 | S | S | * | * | trans | 47.3 | 143.2 | 145.9 | -77.1 | 0 | 0 | 0 | 0 | 127.4 | ||||
| 23 | Q | 36.8 | Very low | 40 | Very low | 192 Ų | 192 | 136.2 Ų | 136.2 | 90% | 0.897 | 78% | 0.783 | S | S | * | * | trans | 67.5 | 154.7 | 156.3 | -72.2 | -176.1 | -15.6 | 0 | 0 | 120.7 | ||||
| 24 | A | 40.6 | Very low | 40.1 | Very low | 78 Ų | 78 | 140.8 Ų | 140.8 | 65% | 0.645 | 79% | 0.792 | S | S | * | * | 173 | 118.7 | -51.9 | 0 | 0 | 0 | 0 | 0 | 109.7 | |||||
| 25 | M | 42.7 | Very low | 38.9 | Very low | 185 Ų | 185 | 144.3 Ų | 144.3 | 91% | 0.911 | 80% | 0.799 | S | S | * | * | trans | -158.1 | 150 | 156.6 | -100.1 | -52.7 | 110.2 | 0 | 0 | 111.4 | ||||
| 26 | Q | 46.4 | Very low | 38.9 | Very low | 162 Ų | 162 | 148.1 Ų | 148.1 | 76% | 0.757 | 80% | 0.802 | S | S | * | * | trans | -113.3 | 153.1 | 173.8 | -83.1 | -81.2 | -20.7 | 0 | 0 | 108.4 | ||||
| 27 | P | 50.1 | Low | 38.9 | Very low | 122 Ų | 122 | 150.6 Ų | 150.6 | 79% | 0.792 | 81% | 0.805 | S | S | * | * | -150.2 | -176.3 | 93.7 | 39.3 | -21.5 | 0 | 0 | 0 | 115.8 | |||||
| 28 | A | 33.2 | Very low | 38.7 | Very low | 95 Ų | 95 | 148.5 Ų | 148.5 | 79% | 0.785 | 80% | 0.796 | S | S | * | * | trans | 87.3 | 94.1 | 167.5 | 0 | 0 | 0 | 0 | 0 | 118.5 | ||||
| 29 | S | 36.5 | Very low | 38 | Very low | 117 Ų | 117 | 148.4 Ų | 148.4 | 82% | 0.818 | 79% | 0.792 | S | S | * | * | trans | -92.9 | -179.3 | 148.1 | -130.1 | 0 | 0 | 0 | 0 | 108.7 | ||||
| 30 | P | 55 | Low | 37.7 | Very low | 101 Ų | 101 | 145.2 Ų | 145.2 | 66% | 0.656 | 79% | 0.79 | S | S | * | * | cis | -125.7 | -152.5 | -7.2 | 45.2 | -28.1 | 0 | 0 | 0 | 109.7 | ||||
| 31 | Y | 32.6 | Very low | 37.3 | Very low | 219 Ų | 219 | 149.7 Ų | 149.7 | 86% | 0.859 | 80% | 0.803 | S | S | * | * | cis | -142.9 | 142.5 | -4.6 | -129.2 | -51.9 | 0 | 0 | 0 | 110.8 | ||||
| 32 | R | 36.7 | Very low | 37.3 | Very low | 239 Ų | 239 | 152.7 Ų | 152.7 | 90% | 0.902 | 81% | 0.805 | S | S | * | * | trans | -83.9 | 145.4 | 165.7 | 173.9 | -161.6 | -149.5 | -176 | 8.4 | 110.6 | ||||
| 33 | G | 32.5 | Very low | 37.2 | Very low | 73 Ų | 73 | 153.8 Ų | 153.8 | 75% | 0.753 | 80% | 0.803 | S | S | * | * | trans | 153.6 | 122.8 | 156.8 | 0 | 0 | 0 | 0 | 0 | 117.9 | ||||
| 34 | H | 38.3 | Very low | 37 | Very low | 201 Ų | 201 | 152.1 Ų | 152.1 | 93% | 0.931 | 80% | 0.795 | S | S | * | * | trans | -80.9 | 141.8 | 154.4 | -78.3 | -111.1 | 0 | 0 | 0 | 109.2 | ||||
| 35 | Q | 31.6 | Very low | 36.4 | Very low | 191 Ų | 191 | 153.7 Ų | 153.7 | 89% | 0.893 | 80% | 0.801 | S | S | * | * | trans | -143 | 142.5 | 157.9 | -166.8 | 160 | -7.8 | 0 | 0 | 111 | ||||
| 36 | K | 35.6 | Very low | 35.9 | Very low | 183 Ų | 183 | 150.1 Ų | 150.1 | 80% | 0.796 | 79% | 0.79 | S | S | * | * | trans | -68 | 139 | 172.8 | -61.9 | 178.8 | 179.2 | 179.7 | 0 | 109.3 | ||||
| 37 | L | 35.3 | Very low | 35.3 | Very low | 177 Ų | 177 | 150.9 Ų | 150.9 | 93% | 0.927 | 79% | 0.794 | S | S | * | * | trans | -94.1 | 119 | 158.8 | -138.7 | 77.2 | 0 | 0 | 0 | 108.9 | ||||
| 38 | L | 38.3 | Very low | 34.4 | Very low | 132 Ų | 132 | 150.3 Ų | 150.3 | 69% | 0.691 | 79% | 0.792 | S | S | * | * | trans | -107.5 | 111.8 | 165.7 | -91.9 | 162.4 | 0 | 0 | 0 | 107.9 | ||||
| 39 | Q | 30.5 | Very low | 34.5 | Very low | 162 Ų | 162 | 153.6 Ų | 153.6 | 76% | 0.757 | 80% | 0.797 | S | S | * | * | 44.2 | 105.1 | 123 | -173.4 | 178 | 15.3 | 0 | 0 | 117.4 | |||||
| 40 | S | 31.2 | Very low | 34.3 | Very low | 110 Ų | 110 | 151.3 Ų | 151.3 | 77% | 0.769 | 79% | 0.791 | S | S | * | * | -179 | 85.6 | 119.9 | -76 | 0 | 0 | 0 | 0 | 111.8 | |||||
| 41 | D | 29.5 | Very low | 33.3 | Very low | 174 Ų | 174 | 155.2 Ų | 155.2 | 93% | 0.93 | 80% | 0.801 | S | S | * | * | trans | -73.5 | 126.5 | 149.8 | -88.1 | -82 | 0 | 0 | 0 | 107.9 | ||||
| 42 | Y | 32.9 | Very low | 34.5 | Very low | 197 Ų | 197 | 149.9 Ų | 149.9 | 77% | 0.773 | 79% | 0.793 | S | S | * | * | trans | -144.1 | 120.6 | 178.3 | -160 | -120.6 | 0 | 0 | 0 | 111.4 | ||||
| 43 | L | 35.6 | Very low | 34.5 | Very low | 120 Ų | 120 | 147 Ų | 147 | 63% | 0.628 | 79% | 0.794 | S | S | * | * | trans | 76.1 | 135.3 | 172.4 | -53.7 | -169.1 | 0 | 0 | 0 | 117.4 | ||||
| 44 | Q | 32.3 | Very low | 34.5 | Very low | 157 Ų | 157 | 146 Ų | 146 | 73% | 0.734 | 79% | 0.785 | S | S | * | * | cis | -163.1 | 154.2 | -12.7 | -171 | 160.5 | -5.3 | 0 | 0 | 112.5 | ||||
| 45 | S | 27.8 | Very low | 34.8 | Very low | 110 Ų | 110 | 145.6 Ų | 145.6 | 77% | 0.769 | 78% | 0.783 | S | S | * | * | trans | 73.2 | 146.2 | 171.3 | 83.1 | 0 | 0 | 0 | 0 | 115.5 | ||||
| 46 | V | 32.7 | Very low | 34.6 | Very low | 110 Ų | 110 | 145.5 Ų | 145.5 | 67% | 0.667 | 78% | 0.782 | S | S | * | * | cis | -134.7 | 142.7 | 12.7 | -175.1 | 0 | 0 | 0 | 0 | 110.5 | ||||
| 47 | Q | 33.5 | Very low | 34.8 | Very low | 179 Ų | 179 | 148.3 Ų | 148.3 | 84% | 0.836 | 79% | 0.788 | S | S | * | * | trans | 33.1 | 107.2 | 160.8 | -62.6 | 161.3 | 5.3 | 0 | 0 | 117.9 | ||||
| 48 | S | 30.3 | Very low | 34.6 | Very low | 109 Ų | 109 | 143.3 Ų | 143.3 | 76% | 0.762 | 77% | 0.772 | S | S | * | * | cis | 63.3 | 90.1 | 46.9 | -163 | 0 | 0 | 0 | 0 | 116.4 | ||||
| 49 | N | 35.9 | Very low | 34.4 | Very low | 165 Ų | 165 | 142.3 Ų | 142.3 | 88% | 0.882 | 78% | 0.776 | S | S | * | * | -167.3 | 144.4 | 108.8 | -105.8 | 17.2 | 0 | 0 | 0 | 112.1 | |||||
| 50 | G | 31.5 | Very low | 34.4 | Very low | 68 Ų | 68 | 140.1 Ų | 140.1 | 70% | 0.701 | 78% | 0.778 | S | S | * | * | trans | -180 | 164 | 173 | 0 | 0 | 0 | 0 | 0 | 112.1 | ||||
| 51 | H | 35.5 | Very low | 34.6 | Very low | 184 Ų | 184 | 143 Ų | 143 | 85% | 0.852 | 78% | 0.784 | S | S | * | * | trans | -155.1 | 135 | 166.2 | -132.3 | -85 | 0 | 0 | 0 | 111.3 | ||||
| 52 | P | 57.1 | Low | 34.7 | Very low | 107 Ų | 107 | 140.1 Ų | 140.1 | 70% | 0.695 | 78% | 0.778 | S | S | * | * | trans | -101.5 | 157.6 | 177.6 | 38.2 | -33.8 | 0 | 0 | 0 | 112.8 | ||||
| 53 | L | 36.1 | Very low | 34.6 | Very low | 177 Ų | 177 | 139.6 Ų | 139.6 | 93% | 0.927 | 78% | 0.782 | S | S | * | * | trans | 169.3 | 161.7 | 154.8 | -92.5 | 155.5 | 0 | 0 | 0 | 107 | ||||
| 54 | G | 32.9 | Very low | 34.3 | Very low | 54 Ų | 54 | 137.5 Ų | 137.5 | 56% | 0.557 | 79% | 0.79 | S | S | * | * | cis | 143.2 | 68.7 | -0.2 | 0 | 0 | 0 | 0 | 0 | 113.1 | ||||
| 55 | H | 43.9 | Very low | 34.5 | Very low | 192 Ų | 192 | 135.6 Ų | 135.6 | 89% | 0.889 | 79% | 0.794 | S | S | * | * | trans | 44.8 | 107.4 | 169 | -57 | -78.4 | 0 | 0 | 0 | 119.3 | ||||
| 56 | Q | 27.3 | Very low | 35.4 | Very low | 189 Ų | 189 | 135.4 Ų | 135.4 | 88% | 0.883 | 79% | 0.79 | S | S | * | * | trans | -151.7 | 132.3 | 148.1 | -109.3 | 172 | 18.2 | 0 | 0 | 110.5 | ||||
| 57 | W | 40.3 | Very low | 35.4 | Very low | 242 Ų | 242 | 140.9 Ų | 140.9 | 92% | 0.917 | 80% | 0.799 | S | S | * | * | trans | -116 | 82.8 | 162.7 | 58.6 | -85.4 | 0 | 0 | 0 | 107.7 | ||||
| 58 | A | 31.3 | Very low | 35.2 | Very low | 71 Ų | 71 | 137.1 Ų | 137.1 | 59% | 0.587 | 79% | 0.792 | S | S | * | * | trans | -96.8 | 107 | -175.6 | 0 | 0 | 0 | 0 | 0 | 110.8 | S60 | A58-S60 PolarHBondContact O-N 3.48Š| ||
| 59 | S | 34.8 | Very low | 35.1 | Very low | 111 Ų | 111 | 137.7 Ų | 137.7 | 78% | 0.776 | 80% | 0.796 | S | S | * | * | trans | -59.1 | 127.9 | 164.7 | -58.1 | 0 | 0 | 0 | 0 | 109.6 | ||||
| 60 | S | 29.8 | Very low | 34.6 | Very low | 116 Ų | 116 | 137.6 Ų | 137.6 | 81% | 0.811 | 79% | 0.793 | S | S | * | * | trans | -110.4 | 126.5 | 175.1 | -61.5 | 0 | 0 | 0 | 0 | 109.7 | A58 | A58-S60 PolarHBondContact O-N 3.48Š| ||
| 61 | L | 36.2 | Very low | 34.4 | Very low | 171 Ų | 171 | 141.5 Ų | 141.5 | 90% | 0.895 | 79% | 0.792 | S | S | * | * | trans | -102.7 | 131.6 | 176.1 | -70.7 | 170.1 | 0 | 0 | 0 | 110.3 | ||||
| 62 | S | 31.6 | Very low | 34.2 | Very low | 113 Ų | 113 | 140.6 Ų | 140.6 | 79% | 0.79 | 79% | 0.789 | S | S | * | * | trans | -164.9 | 120.1 | 153.9 | -154.1 | 0 | 0 | 0 | 0 | 104.4 | ||||
| 63 | E | 30.8 | Very low | 33.1 | Very low | 186 Ų | 186 | 143.8 Ų | 143.8 | 87% | 0.869 | 79% | 0.794 | S | S | * | * | cis | 66.8 | 117.8 | 38.5 | -155.8 | 170.7 | 173.2 | 0 | 0 | 112 | ||||
| 64 | G | 29.3 | Very low | 32.9 | Very low | 77 Ų | 77 | 142.2 Ų | 142.2 | 79% | 0.794 | 79% | 0.787 | S | S | * | * | trans | 114 | 83.8 | 176.7 | 0 | 0 | 0 | 0 | 0 | 117 | ||||
| 65 | S | 36.3 | Very low | 32.8 | Very low | 117 Ų | 117 | 145.5 Ų | 145.5 | 82% | 0.818 | 80% | 0.796 | S | S | * | * | trans | -77.1 | -173.2 | 154.9 | -47.5 | 0 | 0 | 0 | 0 | 109.7 | ||||
| 66 | P | 47 | Very low | 32.4 | Very low | 105 Ų | 105 | 145.8 Ų | 145.8 | 68% | 0.682 | 80% | 0.795 | S | S | * | * | cis | -144.1 | -166.1 | 6.2 | 27.2 | 1.1 | 0 | 0 | 0 | 117.2 | ||||
| 67 | W | 31.5 | Very low | 33 | Very low | 226 Ų | 226 | 142 Ų | 142 | 86% | 0.856 | 79% | 0.787 | S | S | * | * | trans | 99.5 | 94.2 | 161.2 | -60.9 | 94.7 | 0 | 0 | 0 | 121.6 | ||||
| 68 | S | 29.4 | Very low | 32.5 | Very low | 100 Ų | 100 | 133.9 Ų | 133.9 | 70% | 0.699 | 78% | 0.777 | S | S | * | * | 45.3 | 110.2 | 120 | -50.5 | 0 | 0 | 0 | 0 | 124.1 | |||||
| 69 | S | 29.6 | Very low | 32.4 | Very low | 121 Ų | 121 | 140.8 Ų | 140.8 | 85% | 0.846 | 79% | 0.788 | S | S | * | * | -175 | 129.6 | 127.5 | -75.8 | 0 | 0 | 0 | 0 | 107.6 | |||||
| 70 | M | 24.8 | Very low | 32.3 | Very low | 163 Ų | 163 | 142.4 Ų | 142.4 | 80% | 0.803 | 78% | 0.783 | S | S | * | * | 83.6 | 134.8 | 57 | -171.9 | 157.7 | 172.5 | 0 | 0 | 113.3 | |||||
| 71 | E | 27.8 | Very low | 32.2 | Very low | 149 Ų | 149 | 143.2 Ų | 143.2 | 70% | 0.696 | 78% | 0.779 | S | S | * | * | trans | 67.7 | 151.5 | -176.2 | -74.9 | 175.9 | 80.2 | 0 | 0 | 116.5 | ||||
| 72 | Q | 30.7 | Very low | 32.3 | Very low | 165 Ų | 165 | 142.9 Ų | 142.9 | 77% | 0.771 | 78% | 0.777 | S | S | * | * | cis | -145.3 | 172.9 | -1.1 | -142.2 | 171.5 | 52.9 | 0 | 0 | 111.3 | ||||
| 73 | Q | 33.7 | Very low | 32.5 | Very low | 175 Ų | 175 | 144.7 Ų | 144.7 | 82% | 0.818 | 77% | 0.773 | S | S | * | * | trans | -107.9 | 158.5 | 175.2 | -69.6 | -177.2 | -103.2 | 0 | 0 | 113.5 | ||||
| 74 | D | 31 | Very low | 32.7 | Very low | 144 Ų | 144 | 143.7 Ų | 143.7 | 77% | 0.77 | 77% | 0.773 | S | S | * | * | trans | 88 | 172.1 | 143.6 | -133.7 | -90 | 0 | 0 | 0 | 121.4 | ||||
| 75 | V | 31.4 | Very low | 32.8 | Very low | 123 Ų | 123 | 142.6 Ų | 142.6 | 75% | 0.745 | 76% | 0.762 | S | S | * | * | trans | 71.5 | 112.6 | 174 | -165 | 0 | 0 | 0 | 0 | 119.6 | ||||
| 76 | K | 35.4 | Very low | 32.5 | Very low | 198 Ų | 198 | 143.9 Ų | 143.9 | 86% | 0.861 | 76% | 0.758 | S | S | * | * | trans | -120.2 | 130.4 | 154.7 | 169 | -178.1 | -179.5 | -175.5 | 0 | 105 | ||||
| 77 | P | 41.1 | Very low | 32 | Very low | 110 Ų | 110 | 146.7 Ų | 146.7 | 71% | 0.714 | 77% | 0.766 | S | S | * | * | -160.4 | 160.6 | 83.7 | 41.2 | -20.9 | 0 | 0 | 0 | 119.8 | |||||
| 78 | G | 28.4 | Very low | 32 | Very low | 70 Ų | 70 | 142.5 Ų | 142.5 | 72% | 0.722 | 76% | 0.755 | S | S | * | * | 80.6 | 115.4 | 121.1 | 0 | 0 | 0 | 0 | 0 | 120.8 | |||||
| 79 | R | 30.6 | Very low | 32.1 | Very low | 217 Ų | 217 | 146 Ų | 146 | 82% | 0.819 | 76% | 0.76 | S | S | * | * | trans | 166.6 | 156.3 | 151.1 | -93.5 | 173.1 | 104.8 | 121.9 | 15.7 | 107.8 | ||||
| 80 | E | 31.1 | Very low | 32.2 | Very low | 144 Ų | 144 | 151.8 Ų | 151.8 | 67% | 0.673 | 76% | 0.764 | S | S | * | * | cis | -153.4 | 174.4 | -20.8 | 54.7 | -151.5 | 115.6 | 0 | 0 | 111.8 | ||||
| 81 | D | 29.6 | Very low | 32.6 | Very low | 133 Ų | 133 | 148.6 Ų | 148.6 | 71% | 0.711 | 76% | 0.757 | S | S | * | * | trans | -66 | 151.7 | -171.4 | -164.3 | -71.6 | 0 | 0 | 0 | 114.8 | Q83 | D81-Q83 PolarHBondContact OD1-N 2.97Š| ||
| 82 | L | 36.7 | Very low | 33.7 | Very low | 165 Ų | 165 | 147 Ų | 147 | 86% | 0.864 | 76% | 0.76 | S | S | * | * | trans | -154 | 80.9 | 155.9 | -125.7 | 168.5 | 0 | 0 | 0 | 113.5 | L84 | L82-L84 PolarHBondContact O-N 3.43Š| ||
| 83 | Q | 36.4 | Very low | 34.3 | Very low | 151 Ų | 151 | 147.1 Ų | 147.1 | 71% | 0.706 | 76% | 0.76 | S | S | * | * | trans | -71.8 | 109.7 | 177.9 | 171.5 | 65.7 | 18.3 | 0 | 0 | 115.2 | D81 | D81-Q83 PolarHBondContact OD1-N 2.97Š| ||
| 84 | L | 35.2 | Very low | 34.4 | Very low | 164 Ų | 164 | 145.9 Ų | 145.9 | 86% | 0.859 | 76% | 0.764 | S | S | * | * | trans | -155.2 | 133.6 | 158.2 | -69.8 | 179.8 | 0 | 0 | 0 | 109.8 | L82 | L82-L84 PolarHBondContact O-N 3.43Š| ||
| 85 | G | 30.8 | Very low | 34.6 | Very low | 55 Ų | 55 | 143 Ų | 143 | 57% | 0.567 | 76% | 0.76 | S | S | * | * | cis | 174.4 | 131.1 | -13 | 0 | 0 | 0 | 0 | 0 | 113.1 | ||||
| 86 | I | 31 | Very low | 34.8 | Very low | 143 Ų | 143 | 145 Ų | 145 | 73% | 0.733 | 76% | 0.761 | S | S | * | * | trans | 53.4 | 117.4 | 151 | -54.6 | 164.8 | 0 | 0 | 0 | 119.4 | ||||
| 87 | I | 35 | Very low | 34.9 | Very low | 165 Ų | 165 | 143.4 Ų | 143.4 | 85% | 0.846 | 76% | 0.756 | S | S | * | * | -147.5 | 145.5 | 112.6 | -64.4 | -158.9 | 0 | 0 | 0 | 109.3 | |||||
| 88 | H | 32.4 | Very low | 34.6 | Very low | 138 Ų | 138 | 143.3 Ų | 143.3 | 64% | 0.639 | 76% | 0.758 | S | S | * | * | trans | -74.4 | -178.8 | -179.8 | -55.3 | 163.3 | 0 | 0 | 0 | 112.6 | ||||
| 89 | H | 32.2 | Very low | 35.5 | Very low | 174 Ų | 174 | 146 Ų | 146 | 81% | 0.806 | 76% | 0.763 | S | S | * | * | cis | -150 | 156.6 | 29.7 | -73.3 | -95.6 | 0 | 0 | 0 | 116.3 | ||||
| 90 | R | 30 | Very low | 35.8 | Very low | 242 Ų | 242 | 143.9 Ų | 143.9 | 91% | 0.913 | 76% | 0.762 | S | S | * | * | trans | -51.9 | 153.5 | 175.3 | -166.8 | -172.8 | -174.8 | 169.3 | 0 | 117.2 | ||||
| 91 | S | 35.1 | Very low | 36.1 | Very low | 96 Ų | 96 | 145.7 Ų | 145.7 | 67% | 0.671 | 77% | 0.77 | S | S | * | * | trans | -65.5 | 175 | 165.6 | -38.9 | 0 | 0 | 0 | 0 | 113.7 | ||||
| 92 | P | 50.5 | Low | 36.4 | Very low | 116 Ų | 116 | 145.6 Ų | 145.6 | 75% | 0.753 | 77% | 0.769 | S | S | * | * | -148.3 | -179.7 | 95 | 40.3 | -23.4 | 0 | 0 | 0 | 116.5 | |||||
| 93 | H | 41.9 | Very low | 36.2 | Very low | 167 Ų | 167 | 145.6 Ų | 145.6 | 77% | 0.773 | 77% | 0.77 | S | S | * | * | trans | -97.2 | 146.9 | -176.2 | 25.3 | -103.6 | 0 | 0 | 0 | 112.9 | ||||
| 94 | V | 36.3 | Very low | 36.2 | Very low | 149 Ų | 149 | 146.7 Ų | 146.7 | 90% | 0.903 | 78% | 0.775 | S | S | * | * | trans | -145.7 | 144.3 | 159.5 | -178.4 | 0 | 0 | 0 | 0 | 108.4 | ||||
| 95 | A | 35.6 | Very low | 35.9 | Very low | 82 Ų | 82 | 141.8 Ų | 141.8 | 68% | 0.678 | 76% | 0.764 | S | S | * | * | trans | -126.6 | 154.4 | 167.4 | 0 | 0 | 0 | 0 | 0 | 108.9 | ||||
| 96 | H | 35.6 | Very low | 36 | Very low | 166 Ų | 166 | 145.1 Ų | 145.1 | 77% | 0.769 | 78% | 0.779 | S | S | * | * | trans | -178.3 | 157.3 | 147.1 | -117.5 | -105.9 | 0 | 0 | 0 | 114.6 | ||||
| 97 | H | 36.5 | Very low | 36.4 | Very low | 165 Ų | 165 | 147 Ų | 147 | 76% | 0.764 | 78% | 0.784 | S | S | * | * | trans | 65.3 | 117.8 | 158.9 | -63.8 | -58.6 | 0 | 0 | 0 | 122.8 | ||||
| 98 | S | 36.4 | Very low | 37 | Very low | 108 Ų | 108 | 145.1 Ų | 145.1 | 76% | 0.755 | 78% | 0.782 | S | S | * | * | trans | -81.4 | 171.4 | 144.2 | -46.2 | 0 | 0 | 0 | 0 | 111.1 | ||||
| 99 | P | 46.7 | Very low | 36.9 | Very low | 125 Ų | 125 | 141.9 Ų | 141.9 | 81% | 0.812 | 79% | 0.787 | S | S | * | * | -133.1 | 169.6 | 117.3 | 38.4 | -31.6 | 0 | 0 | 0 | 114.3 | |||||
| 100 | H | 36.3 | Very low | 36.9 | Very low | 174 Ų | 174 | 137.1 Ų | 137.1 | 81% | 0.806 | 78% | 0.777 | S | S | * | * | trans | -74.5 | 158.6 | 176.8 | -72.9 | -117.3 | 0 | 0 | 0 | 112.8 | ||||
| 101 | H | 38.7 | Very low | 37.2 | Very low | 182 Ų | 182 | 137.8 Ų | 137.8 | 84% | 0.843 | 78% | 0.78 | S | S | * | * | trans | -139.8 | 123 | 137.3 | -145.4 | -72.4 | 0 | 0 | 0 | 110.6 | ||||
| 102 | N | 35.6 | Very low | 36.9 | Very low | 130 Ų | 130 | 136 Ų | 136 | 70% | 0.695 | 78% | 0.777 | S | S | * | * | trans | -79.2 | 151.3 | 165.1 | -84.1 | -6 | 0 | 0 | 0 | 109.4 | ||||
| 103 | N | 31.6 | Very low | 36 | Very low | 166 Ų | 166 | 137.1 Ų | 137.1 | 89% | 0.888 | 78% | 0.782 | S | S | * | * | trans | -144.4 | 158.9 | 131.8 | -161.2 | 20.9 | 0 | 0 | 0 | 109.8 | ||||
| 104 | H | 36.4 | Very low | 36.5 | Very low | 174 Ų | 174 | 134.3 Ų | 134.3 | 81% | 0.806 | 78% | 0.778 | S | S | * | * | trans | -138.3 | 146.4 | -159.4 | -163.5 | -87.3 | 0 | 0 | 0 | 111.6 | ||||
| 105 | G | 29.6 | Very low | 36.8 | Very low | 61 Ų | 61 | 133.2 Ų | 133.2 | 63% | 0.629 | 77% | 0.771 | S | S | * | * | trans | 91.2 | 152.3 | 176.7 | 0 | 0 | 0 | 0 | 0 | 115.1 | ||||
| 106 | S | 32.1 | Very low | 36.6 | Very low | 125 Ų | 125 | 134.9 Ų | 134.9 | 87% | 0.874 | 78% | 0.778 | S | S | * | * | cis | -153.4 | 142.1 | -1.8 | -69.2 | 0 | 0 | 0 | 0 | 112.4 | ||||
| 107 | H | 38.8 | Very low | 36.7 | Very low | 182 Ų | 182 | 135 Ų | 135 | 84% | 0.843 | 78% | 0.778 | S | S | * | * | trans | -73.6 | 171.7 | 153.3 | -86.7 | -65.2 | 0 | 0 | 0 | 109.6 | ||||
| 108 | P | 48.3 | Very low | 36.5 | Very low | 125 Ų | 125 | 133.9 Ų | 133.9 | 81% | 0.812 | 78% | 0.778 | S | S | * | * | cis | -144.3 | 175.3 | 25 | 43.1 | -24.2 | 0 | 0 | 0 | 118.5 | ||||
| 109 | G | 31.1 | Very low | 36.2 | Very low | 71 Ų | 71 | 133.7 Ų | 133.7 | 73% | 0.732 | 78% | 0.777 | S | S | * | * | trans | 86.6 | 164 | 152.1 | 0 | 0 | 0 | 0 | 0 | 117.2 | ||||
| 110 | A | 31.8 | Very low | 35.5 | Very low | 73 Ų | 73 | 133.1 Ų | 133.1 | 60% | 0.603 | 78% | 0.776 | S | S | * | * | cis | -166.8 | 172.1 | -15 | 0 | 0 | 0 | 0 | 0 | 109.3 | ||||
| 111 | W | 37.1 | Very low | 35.4 | Very low | 257 Ų | 257 | 132.3 Ų | 132.3 | 97% | 0.973 | 78% | 0.776 | S | S | * | * | trans | 66.7 | 152.5 | 173.1 | -37.2 | 90.9 | 0 | 0 | 0 | 115.4 | ||||
| 112 | G | 27.8 | Very low | 35 | Very low | 58 Ų | 58 | 129.5 Ų | 129.5 | 60% | 0.598 | 77% | 0.771 | S | S | * | * | cis | 151.6 | 82.4 | -11 | 0 | 0 | 0 | 0 | 0 | 115.2 | ||||
| 113 | T | 31.7 | Very low | 34.9 | Very low | 140 Ų | 140 | 128.8 Ų | 128.8 | 86% | 0.859 | 78% | 0.777 | S | S | * | * | trans | 63 | -176 | 163.5 | 80 | 0 | 0 | 0 | 0 | 115 | ||||
| 114 | P | 53.3 | Low | 34.8 | Very low | 108 Ų | 108 | 124.3 Ų | 124.3 | 70% | 0.701 | 77% | 0.77 | S | S | * | * | cis | -127.1 | 169.8 | -16.1 | 32 | -13.2 | 0 | 0 | 0 | 115.1 | ||||
| 115 | V | 41.2 | Very low | 34.8 | Very low | 126 Ų | 126 | 125.7 Ų | 125.7 | 76% | 0.764 | 78% | 0.776 | S | S | * | * | trans | -78 | 141.6 | 153.3 | 155.2 | 0 | 0 | 0 | 0 | 108.8 | ||||
| 116 | S | 32.1 | Very low | 35 | Very low | 116 Ų | 116 | 131.8 Ų | 131.8 | 81% | 0.811 | 79% | 0.789 | S | S | * | * | trans | -152.3 | 156.4 | 163.6 | -99.3 | 0 | 0 | 0 | 0 | 112.6 | ||||
| 117 | H | 37 | Very low | 35 | Very low | 168 Ų | 168 | 133.6 Ų | 133.6 | 78% | 0.778 | 79% | 0.787 | S | S | * | * | trans | -116.5 | 154.9 | -168.1 | -88.8 | -120.5 | 0 | 0 | 0 | 112.8 | ||||
| 118 | N | 32.4 | Very low | 34.7 | Very low | 143 Ų | 143 | 132.2 Ų | 132.2 | 77% | 0.765 | 79% | 0.786 | S | S | * | * | trans | 65.5 | 146.1 | 151.2 | -135.9 | 37 | 0 | 0 | 0 | 116.6 | ||||
| 119 | S | 29.7 | Very low | 33.8 | Very low | 104 Ų | 104 | 133.8 Ų | 133.8 | 73% | 0.727 | 79% | 0.786 | S | S | * | * | cis | -162.4 | 162.4 | 46.9 | -55.7 | 0 | 0 | 0 | 0 | 113.6 | ||||
| 120 | S | 31.9 | Very low | 33.8 | Very low | 112 Ų | 112 | 141.1 Ų | 141.1 | 78% | 0.783 | 79% | 0.793 | S | S | * | * | trans | -74.7 | 159.9 | 177.4 | -34.1 | 0 | 0 | 0 | 0 | 114.3 | ||||
| 121 | I | 34.3 | Very low | 33.8 | Very low | 158 Ų | 158 | 142 Ų | 142 | 81% | 0.81 | 80% | 0.795 | S | S | * | * | trans | -155.4 | 122.9 | 130.9 | -149.9 | 160.6 | 0 | 0 | 0 | 115.4 | ||||
| 122 | T | 32.3 | Very low | 33.8 | Very low | 122 Ų | 122 | 136.8 Ų | 136.8 | 75% | 0.748 | 78% | 0.781 | S | S | * | * | trans | 50.5 | 159.9 | 144.9 | -145.9 | 0 | 0 | 0 | 0 | 125.4 | ||||
| 123 | S | 32.2 | Very low | 34 | Very low | 115 Ų | 115 | 141 Ų | 141 | 80% | 0.804 | 80% | 0.796 | S | S | * | * | trans | 68 | 130.4 | 173.3 | 71.9 | 0 | 0 | 0 | 0 | 118.2 | ||||
| 124 | G | 30.9 | Very low | 34.1 | Very low | 72 Ų | 72 | 136.5 Ų | 136.5 | 74% | 0.742 | 78% | 0.777 | S | S | * | * | cis | 142.3 | 100.1 | -21 | 0 | 0 | 0 | 0 | 0 | 115.5 | ||||
| 125 | Q | 34.8 | Very low | 33.3 | Very low | 203 Ų | 203 | 141.8 Ų | 141.8 | 95% | 0.949 | 79% | 0.789 | S | S | * | * | trans | -165.3 | 158.1 | 157.4 | -111.1 | 164.1 | 19.8 | 0 | 0 | 111.1 | ||||
| 126 | Q | 33.5 | Very low | 33.2 | Very low | 189 Ų | 189 | 142 Ų | 142 | 88% | 0.883 | 79% | 0.791 | S | S | * | * | trans | -107.9 | 140.1 | -178.5 | -59.4 | 174.1 | -10.8 | 0 | 0 | 111 | ||||
| 127 | I | 33.8 | Very low | 33.5 | Very low | 164 Ų | 164 | 142.7 Ų | 142.7 | 84% | 0.841 | 79% | 0.79 | S | S | * | * | trans | -141.5 | 125.3 | 152.9 | -61.1 | -173.7 | 0 | 0 | 0 | 110.5 | ||||
| 128 | N | 30.9 | Very low | 33.3 | Very low | 153 Ų | 153 | 142.4 Ų | 142.4 | 82% | 0.818 | 80% | 0.795 | S | S | * | * | trans | 12 | 122.2 | 164.1 | -64.8 | -27.1 | 0 | 0 | 0 | 121.9 | ||||
| 129 | I | 30.8 | Very low | 33.3 | Very low | 158 Ų | 158 | 139.4 Ų | 139.4 | 81% | 0.81 | 80% | 0.797 | S | S | * | * | trans | -67.5 | 144.1 | 142.4 | -76.4 | 166.9 | 0 | 0 | 0 | 109.2 | ||||
| 130 | Y | 29.8 | Very low | 33.5 | Very low | 224 Ų | 224 | 142.5 Ų | 142.5 | 88% | 0.878 | 80% | 0.802 | S | S | * | * | trans | -113.9 | 123.7 | 165.6 | -164.5 | -91.2 | 0 | 0 | 0 | 110.1 | ||||
| 131 | S | 33 | Very low | 33.8 | Very low | 93 Ų | 93 | 144.1 Ų | 144.1 | 65% | 0.65 | 80% | 0.801 | S | S | * | * | trans | -143.4 | 135.7 | 170.3 | 61.7 | 0 | 0 | 0 | 0 | 109.6 | ||||
| 132 | Q | 36.1 | Very low | 33.7 | Very low | 147 Ų | 147 | 142.7 Ų | 142.7 | 69% | 0.687 | 80% | 0.795 | S | S | * | * | trans | 170.4 | 132.9 | 141.2 | -98.9 | -67.4 | 11.1 | 0 | 0 | 111.4 | ||||
| 133 | T | 33.3 | Very low | 34 | Very low | 146 Ų | 146 | 144.9 Ų | 144.9 | 90% | 0.896 | 80% | 0.797 | S | S | * | * | 174.9 | 118.3 | 129.3 | 33.8 | 0 | 0 | 0 | 0 | 106.7 | |||||
| 134 | G | 33 | Very low | 33.9 | Very low | 46 Ų | 46 | 143.4 Ų | 143.4 | 47% | 0.474 | 80% | 0.799 | S | S | . | * | cis | 134.6 | 103.3 | -10.4 | 0 | 0 | 0 | 0 | 0 | 112.4 | ||||
| 135 | F | 36.5 | Very low | 33.9 | Very low | 218 Ų | 218 | 143.7 Ų | 143.7 | 96% | 0.956 | 80% | 0.802 | S | S | * | * | trans | -152.5 | 147 | 156.8 | -93.1 | -66.8 | 0 | 0 | 0 | 109.3 | ||||
| 136 | T | 39.2 | Very low | 33.9 | Very low | 130 Ų | 130 | 142.4 Ų | 142.4 | 80% | 0.798 | 80% | 0.801 | S | S | * | * | trans | -140.9 | 158.7 | -172.6 | 52.8 | 0 | 0 | 0 | 0 | 110.8 | ||||
| 137 | V | 38.2 | Very low | 34.4 | Very low | 132 Ų | 132 | 139.6 Ų | 139.6 | 80% | 0.8 | 80% | 0.797 | S | S | * | * | trans | -157.4 | 141.6 | 144.6 | -99.8 | 0 | 0 | 0 | 0 | 109.3 | ||||
| 138 | N | 32.8 | Very low | 35.7 | Very low | 162 Ų | 162 | 137.4 Ų | 137.4 | 87% | 0.866 | 79% | 0.793 | S | S | * | * | trans | 18.1 | 131 | 156.6 | -50.7 | -2.4 | 0 | 0 | 0 | 118 | ||||
| 139 | G | 32.1 | Very low | 36.9 | Very low | 79 Ų | 79 | 136 Ų | 136 | 81% | 0.814 | 79% | 0.792 | S | S | * | * | cis | 137.3 | 164 | 36.4 | 0 | 0 | 0 | 0 | 0 | 106.1 | ||||
| 140 | M | 35.2 | Very low | 37 | Very low | 170 Ų | 170 | 133.3 Ų | 133.3 | 84% | 0.837 | 79% | 0.794 | S | S | * | * | cis | -163.7 | 157.4 | 14 | 171.9 | 177.6 | 69.3 | 0 | 0 | 106.6 | ||||
| 141 | L | 37.7 | Very low | 37.3 | Very low | 145 Ų | 145 | 129.6 Ų | 129.6 | 76% | 0.759 | 79% | 0.79 | S | S | * | * | trans | 17.4 | 141.3 | 160.1 | -52.8 | 168.9 | 0 | 0 | 0 | 119.7 | ||||
| 142 | D | 32.4 | Very low | 38.1 | Very low | 128 Ų | 128 | 129.6 Ų | 129.6 | 68% | 0.684 | 79% | 0.787 | S | S | * | * | cis | -165.3 | -159.4 | 37.4 | -159.6 | 48 | 0 | 0 | 0 | 114.3 | ||||
| 143 | H | 37.4 | Very low | 37.9 | Very low | 169 Ų | 169 | 131.4 Ų | 131.4 | 78% | 0.782 | 80% | 0.795 | S | S | * | * | trans | -62.6 | 154.6 | -166.3 | -75.5 | -78.2 | 0 | 0 | 0 | 118.3 | ||||
| 144 | G | 30.6 | Very low | 37.9 | Very low | 83 Ų | 83 | 128.3 Ų | 128.3 | 86% | 0.856 | 79% | 0.793 | S | S | * | * | trans | -69.8 | 177.9 | -177.8 | 0 | 0 | 0 | 0 | 0 | 118.3 | ||||
| 145 | G | 30.6 | Very low | 38 | Very low | 78 Ų | 78 | 135.6 Ų | 135.6 | 80% | 0.804 | 82% | 0.815 | S | S | * | * | trans | -155.6 | 170.5 | -178.6 | 0 | 0 | 0 | 0 | 0 | 112.2 | ||||
| 146 | L | 35.6 | Very low | 37.8 | Very low | 176 Ų | 176 | 128.7 Ų | 128.7 | 92% | 0.921 | 81% | 0.805 | S | S | * | * | trans | -103.9 | -178.3 | -171.4 | -70.2 | 169.6 | 0 | 0 | 0 | 113.5 | ||||
| 147 | T | 44.1 | Very low | 37.6 | Very low | 131 Ų | 131 | 130.7 Ų | 130.7 | 80% | 0.804 | 81% | 0.807 | S | S | * | * | trans | -64.3 | 163.9 | -174.9 | 42.2 | 0 | 0 | 0 | 0 | 115.5 | ||||
| 148 | P | 60.1 | Low | 37.7 | Very low | 117 Ų | 117 | 133 Ų | 133 | 76% | 0.76 | 81% | 0.809 | S | S | * | * | trans | -88.2 | 178.5 | -160.6 | 40.8 | -40.5 | 0 | 0 | 0 | 113.4 | ||||
| 149 | P | 56 | Low | 38.5 | Very low | 123 Ų | 123 | 130.4 Ų | 130.4 | 80% | 0.799 | 80% | 0.801 | S | S | * | * | -157.4 | -169 | 91.8 | 41.6 | -21.3 | 0 | 0 | 0 | 116.6 | |||||
| 150 | A | 32.6 | Very low | 38.4 | Very low | 103 Ų | 103 | 129.8 Ų | 129.8 | 85% | 0.851 | 79% | 0.794 | S | S | * | * | trans | 100.6 | 132.9 | 145.3 | 0 | 0 | 0 | 0 | 0 | 121.5 | ||||
| 151 | N | 36.9 | Very low | 38.6 | Very low | 146 Ų | 146 | 129.1 Ų | 129.1 | 78% | 0.781 | 79% | 0.793 | S | S | * | * | trans | -103.1 | 150.8 | 165.7 | -178.7 | 38 | 0 | 0 | 0 | 107.3 | ||||
| 152 | P | 50.4 | Low | 38.7 | Very low | 92 Ų | 92 | 132.4 Ų | 132.4 | 60% | 0.597 | 80% | 0.796 | S | S | * | * | -157.4 | 168.1 | 99.9 | 40.9 | -22.2 | 0 | 0 | 0 | 118.1 | |||||
| 153 | Q | 32.3 | Very low | 38.9 | Very low | 185 Ų | 185 | 133.5 Ų | 133.5 | 86% | 0.864 | 80% | 0.801 | S | S | * | * | trans | 64.2 | 128.1 | 150.7 | -71.7 | 160.6 | -75.6 | 0 | 0 | 121 | ||||
| 154 | G | 32.2 | Very low | 38.8 | Very low | 81 Ų | 81 | 132.4 Ų | 132.4 | 84% | 0.835 | 81% | 0.807 | S | S | * | * | trans | 172.9 | 99.6 | 166.8 | 0 | 0 | 0 | 0 | 0 | 116.2 | ||||
| 155 | Q | 34.8 | Very low | 39.4 | Very low | 200 Ų | 200 | 136.3 Ų | 136.3 | 94% | 0.935 | 81% | 0.808 | S | S | * | * | trans | -46.8 | 155.7 | 179.1 | -56.4 | 160.7 | 1.2 | 0 | 0 | 117.6 | ||||
| 156 | G | 31.7 | Very low | 39.6 | Very low | 73 Ų | 73 | 137.8 Ų | 137.8 | 75% | 0.753 | 81% | 0.806 | S | S | * | * | trans | 170.8 | 54.6 | 167.2 | 0 | 0 | 0 | 0 | 0 | 123.5 | ||||
| 157 | M | 36.2 | Very low | 40.4 | Very low | 172 Ų | 172 | 134.8 Ų | 134.8 | 85% | 0.847 | 80% | 0.797 | S | S | * | * | trans | 36.9 | 104.7 | 151.2 | -54.5 | -57.1 | 139.6 | 0 | 0 | 123.5 | ||||
| 158 | H | 39.4 | Very low | 40 | Very low | 180 Ų | 180 | 136.9 Ų | 136.9 | 83% | 0.833 | 80% | 0.797 | S | S | * | * | 27.4 | 163.6 | 112.6 | -100.1 | -142.2 | 0 | 0 | 0 | 123.1 | |||||
| 159 | P | 50.8 | Low | 38.9 | Very low | 107 Ų | 107 | 140.1 Ų | 140.1 | 70% | 0.695 | 80% | 0.802 | S | S | * | * | cis | -150.1 | -179 | -34.1 | 39.9 | -20.4 | 0 | 0 | 0 | 117.6 | ||||
| 160 | G | 30.3 | Very low | 38.3 | Very low | 66 Ų | 66 | 138.8 Ų | 138.8 | 68% | 0.68 | 80% | 0.795 | S | S | * | * | trans | 123.7 | 140.4 | 151.3 | 0 | 0 | 0 | 0 | 0 | 114.8 | ||||
| 161 | L | 39.2 | Very low | 38.4 | Very low | 157 Ų | 157 | 140.7 Ų | 140.7 | 82% | 0.822 | 79% | 0.791 | S | S | * | * | cis | -131.5 | 133.7 | 6.8 | -62.5 | 165.3 | 0 | 0 | 0 | 107 | ||||
| 162 | R | 39.4 | Very low | 38.7 | Very low | 213 Ų | 213 | 141.3 Ų | 141.3 | 80% | 0.804 | 79% | 0.794 | S | S | * | * | 77.9 | 126.9 | 54.4 | 93.9 | 164.4 | 62.4 | -156.3 | 0.1 | 115.8 | |||||
| 163 | D | 36.3 | Very low | 38.1 | Very low | 151 Ų | 151 | 141 Ų | 141 | 81% | 0.807 | 81% | 0.807 | S | S | * | * | trans | -76.4 | 168.8 | -163.4 | -51.2 | -116.2 | 0 | 0 | 0 | 117.1 | ||||
| 164 | T | 35 | Very low | 38.6 | Very low | 146 Ų | 146 | 135.1 Ų | 135.1 | 90% | 0.896 | 80% | 0.796 | S | S | * | * | trans | -157.4 | 162.5 | 142.4 | 2.5 | 0 | 0 | 0 | 0 | 110.9 | ||||
| 165 | L | 42.6 | Very low | 39.2 | Very low | 166 Ų | 166 | 140.6 Ų | 140.6 | 87% | 0.869 | 80% | 0.8 | S | S | * | * | trans | -113.5 | 166.2 | -168.5 | -68 | 161.9 | 0 | 0 | 0 | 113.3 | ||||
| 166 | S | 35.5 | Very low | 39.7 | Very low | 109 Ų | 109 | 138.4 Ų | 138.4 | 76% | 0.762 | 79% | 0.789 | S | S | * | * | trans | -20.6 | 163.4 | 164.6 | -52.7 | 0 | 0 | 0 | 0 | 119.3 | ||||
| 167 | P | 53.2 | Low | 40.1 | Very low | 113 Ų | 113 | 141 Ų | 141 | 73% | 0.734 | 79% | 0.794 | S | S | * | * | cis | -149.5 | -173.1 | 30.7 | 45.1 | -24.2 | 0 | 0 | 0 | 119.3 | ||||
| 168 | E | 34.2 | Very low | 40.5 | Very low | 175 Ų | 175 | 138.5 Ų | 138.5 | 82% | 0.818 | 78% | 0.78 | S | S | * | * | trans | 53.1 | 120.1 | 158.1 | -75.1 | -163.1 | 84.7 | 0 | 0 | 122.5 | ||||
| 169 | H | 38.6 | Very low | 40.3 | Very low | 185 Ų | 185 | 136.5 Ų | 136.5 | 86% | 0.856 | 78% | 0.776 | S | S | * | * | -156.7 | 154.9 | 106.1 | -143.4 | -88.3 | 0 | 0 | 0 | 111.6 | |||||
| 170 | S | 42.1 | Very low | 40.1 | Very low | 94 Ų | 94 | 139.4 Ų | 139.4 | 66% | 0.657 | 78% | 0.779 | S | S | * | * | trans | -98.8 | 147.3 | 169.5 | -60.5 | 0 | 0 | 0 | 0 | 110.9 | ||||
| 171 | D | 34.8 | Very low | 40.9 | Very low | 143 Ų | 143 | 140.7 Ų | 140.7 | 77% | 0.765 | 78% | 0.778 | S | S | * | * | 170.8 | 157.4 | 110.4 | -160.8 | -135.1 | 0 | 0 | 0 | 113.5 | |||||
| 172 | L | 44.7 | Very low | 41 | Very low | 160 Ų | 160 | 139.9 Ų | 139.9 | 84% | 0.838 | 78% | 0.775 | S | S | * | * | trans | 0.3 | 129.4 | 172 | -64.1 | 170.5 | 0 | 0 | 0 | 121.9 | ||||
| 173 | G | 36.5 | Very low | 41.6 | Very low | 84 Ų | 84 | 138.9 Ų | 138.9 | 87% | 0.866 | 78% | 0.779 | S | S | * | * | trans | -175.5 | 100.7 | 161.2 | 0 | 0 | 0 | 0 | 0 | 113.7 | ||||
| 174 | G | 42.7 | Very low | 42.9 | Very low | 63 Ų | 63 | 140.3 Ų | 140.3 | 65% | 0.649 | 78% | 0.781 | S | S | * | * | trans | -100.1 | 166.6 | -179.4 | 0 | 0 | 0 | 0 | 0 | 114.6 | ||||
| 175 | H | 45.8 | Very low | 44.4 | Very low | 196 Ų | 196 | 138.3 Ų | 138.3 | 91% | 0.907 | 77% | 0.769 | S | S | * | * | trans | 63.6 | 120.8 | -177.4 | -47.5 | -84.8 | 0 | 0 | 0 | 113.6 | ||||
| 176 | H | 45.8 | Very low | 45.8 | Very low | 154 Ų | 154 | 131.6 Ų | 131.6 | 71% | 0.713 | 74% | 0.735 | S | S | * | * | -168.6 | 119.2 | 50.8 | -176.8 | 111.8 | 0 | 0 | 0 | 108.3 | H178 | H176-H178 AromaticContact CD2-ND1 3.98Å; H176-H178 AromaticContact NE2-ND1 3.69Å; H176-H178 PolarHBondContact O-N 3.4Å | |||
| 177 | C | 39.1 | Very low | 48.2 | Very low | 127 Ų | 127 | 129.6 Ų | 129.6 | 86% | 0.858 | 72% | 0.719 | S | S | * | * | trans | -72.8 | 92.8 | 171.4 | 40.9 | 0 | 0 | 0 | 0 | 109.4 | D179 | C177-D179 PolarHBondContact O-N 3.27Å; C177-D179 VanDerWaalsContact O-N 3.09Å | ||
| 178 | H | 45 | Very low | 49.9 | Very low | 119 Ų | 119 | 128 Ų | 128 | 55% | 0.551 | 71% | 0.71 | S | S | * | * | trans | -77.2 | 97.9 | 177.5 | -160.7 | 90.7 | 0 | 0 | 0 | 110 | H176 H180 | H176-H178 AromaticContact CD2-ND1 3.98Å; H176-H178 AromaticContact NE2-ND1 3.69Å; H176-H178 PolarHBondContact O-N 3.4Å; H178-H180 VanDerWaalsContact C-N 3.3Å; H178-H180 AromaticContact CD2-CD2 3.52Å; H178-H180 AromaticContact CD2-CE1 3.36Å; H178-H180 PolarHBondContact CD2-CE1 2.93Å; H178-H180 AromaticContact CD2-CG 3.48Å; H178-H180 VanDerWaalsContact CD2-CG 3.48Å; H178-H180 AromaticContact CD2-ND1 3.39Å; H178-H180 PolarHBondContact CD2-ND1 3.46Å; H178-H180 AromaticContact CD2-NE2 3.46Å; H178-H180 PolarHBondContact CD2-NE2 3.03Å; H178-H180 AromaticContact NE2-CE1 3.14Å; H178-H180 PolarHBondContact NE2-CE1 3.46Å; H178-H180 AromaticContact NE2-CG 3.96Å; H178-H180 AromaticContact NE2-ND1 3.36Å; H178-H180 PolarHBondContact NE2-ND1 2.91Å; H178-H180 AromaticContact NE2-NE2 3.66Å; H178-H180 PolarHBondContact O-N 3.23Å | ||
| 179 | D | 35.9 | Very low | 52.6 | Low | 138 Ų | 138 | 124.8 Ų | 124.8 | 74% | 0.738 | 70% | 0.698 | S | S | * | * | trans | -75.8 | 74.1 | -175.1 | -166.9 | -138.9 | 0 | 0 | 0 | 112 | C177 S181 | C177-D179 PolarHBondContact O-N 3.27Å; C177-D179 VanDerWaalsContact O-N 3.09Å; D179-S181 PolarHBondContact O-N 3.05Å | ||
| 180 | H | 45.7 | Very low | 55.2 | Low | 168 Ų | 168 | 119.3 Ų | 119.3 | 78% | 0.778 | 67% | 0.673 | S | S | * | * | trans | -75.8 | 62.6 | 174.2 | -86.6 | -37.3 | 0 | 0 | 0 | 111.6 | H178 | H178-H180 VanDerWaalsContact C-N 3.3Å; H178-H180 AromaticContact CD2-CD2 3.52Å; H178-H180 AromaticContact CD2-CE1 3.36Å; H178-H180 PolarHBondContact CD2-CE1 2.93Å; H178-H180 AromaticContact CD2-CG 3.48Å; H178-H180 VanDerWaalsContact CD2-CG 3.48Å; H178-H180 AromaticContact CD2-ND1 3.39Å; H178-H180 PolarHBondContact CD2-ND1 3.46Å; H178-H180 AromaticContact CD2-NE2 3.46Å; H178-H180 PolarHBondContact CD2-NE2 3.03Å; H178-H180 AromaticContact NE2-CE1 3.14Å; H178-H180 PolarHBondContact NE2-CE1 3.46Å; H178-H180 AromaticContact NE2-CG 3.96Å; H178-H180 AromaticContact NE2-ND1 3.36Å; H178-H180 PolarHBondContact NE2-ND1 2.91Å; H178-H180 AromaticContact NE2-NE2 3.66Å; H178-H180 PolarHBondContact O-N 3.23Å | ||
| 181 | S | 47.3 | Very low | 57.6 | Low | 93 Ų | 93 | 115.1 Ų | 115.1 | 65% | 0.65 | 64% | 0.643 | S | S | * | * | trans | -145.7 | 25.3 | -171 | -162.4 | 0 | 0 | 0 | 0 | 118.6 | D179 | D179-S181 PolarHBondContact O-N 3.05Š| ||
| 182 | D | 40.6 | Very low | 60.5 | Low | 141 Ų | 141 | 111.9 Ų | 111.9 | 75% | 0.754 | 62% | 0.623 | S | S | * | * | trans | -148.7 | 26.4 | 170.9 | -135.5 | -29.6 | 0 | 0 | 0 | 115.6 | E184 | D182-E184 PolarHBondContact O-N 3.27Å; D182-E184 VanDerWaalsContact O-N 3.17Å | ||
| 183 | E | 52.3 | Low | 63 | Low | 191 Ų | 191 | 110.1 Ų | 110.1 | 89% | 0.893 | 61% | 0.611 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -90.1 | 68.8 | -174.1 | -141.7 | -85.8 | 98.4 | 0 | 0 | 113 | ||
| 184 | E | 64.3 | Low | 65.9 | Low | 181 Ų | 181 | 106.7 Ų | 106.7 | 85% | 0.846 | 57% | 0.572 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -138.9 | -27.5 | 164.7 | -154.2 | -172.8 | 111.4 | 0 | 0 | 114.3 | D182 P186 | D182-E184 PolarHBondContact O-N 3.27Å; D182-E184 VanDerWaalsContact O-N 3.17Å; E184-P186 WeakPolarHBondContact O-CD 3.48Å |
| 185 | T | 64.9 | Low | 68.5 | Low | 104 Ų | 104 | 103.8 Ų | 103.8 | 64% | 0.638 | 54% | 0.542 | S | S | * | . | S | Bend | trans | -98.9 | 111.3 | 177.8 | 57 | 0 | 0 | 0 | 0 | 112.5 | T187 | T185-T187 PolarHBondContact O-N 3.35Š|
| 186 | P | 73.6 | Confident | 70.9 | Confident | 25 Ų | 25 | 100 Ų | 100 | 16% | 0.162 | 52% | 0.523 | C | S | . | . | trans | -67.4 | 131.6 | -178.1 | 28.1 | -35.8 | 0 | 0 | 0 | 111.2 | E184 E190 F239 K246 | E184-P186 WeakPolarHBondContact O-CD 3.48Å; P186-E190 WeakPolarHBondContact CA-OE2 3.4Å; P186-E190 WeakPolarHBondContact CB-OE2 3.16Å; P186-F239 VanDerWaalsContact O-CZ 3.3Å; P186-F239 WeakPolarHBondContact O-CZ 3.34Å; P186-K246 HydrophobicContact CB-CD 3.91Å; P186-K246 VanDerWaalsContact CB-NZ 3.28Å; P186-K246 HydrophobicContact CG-CD 3.98Å | ||
| 187 | T | 85.9 | Confident | 73.4 | Confident | 68 Ų | 68 | 96.3 Ų | 96.3 | 42% | 0.417 | 51% | 0.506 | S | S | . | . | trans | -61.8 | 162.7 | -178.2 | 59.2 | 0 | 0 | 0 | 0 | 113 | T185 D189 E190 L191 | T185-T187 PolarHBondContact O-N 3.35Å; T187-D189 VanDerWaalsContact C-N 3.26Å; T187-D189 PolarHBondContact O-N 3.2Å; T187-E190 WeakPolarHBondContact CB-OE1 3.22Å; T187-E190 WeakPolarHBondContact CG2-OE1 3.38Å; T187-E190 PolarHBondContact N-OE1 3Å; T187-E190 PolarHBondContact O-N 3.2Å; T187-E190 WeakPolarHBondContact OG1-CB 3.46Å; T187-E190 VanDerWaalsContact OG1-CG 3.24Å; T187-E190 WeakPolarHBondContact OG1-CG 3.3Å; T187-E190 PolarHBondContact OG1-N 3.08Å; T187-E190 PolarHBondContact OG1-OE1 2.85Å; T187-L191 PolarHBondContact O-N 3.37Å | ||
| 188 | S | 88.1 | Confident | 76.1 | Confident | 79 Ų | 79 | 90.3 Ų | 90.3 | 55% | 0.552 | 47% | 0.465 | S | S | * | . | H | α-helix | trans | -59.7 | -40 | 175.2 | -168.7 | 0 | 0 | 0 | 0 | 111.5 | L191 E192 | S188-L191 PolarHBondContact O-N 3.48Å; S188-E192 PolarHBondContact O-N 3.41Å; S188-E192 VanDerWaalsContact O-N 3.12Å |
| 189 | D | 90.4 | Very high | 78.6 | Confident | 107 Ų | 107 | 88.9 Ų | 88.9 | 57% | 0.572 | 46% | 0.458 | S | S | * | . | H | α-helix | trans | -70.3 | -40.7 | -178.2 | -55.7 | -69.4 | 0 | 0 | 0 | 111.9 | T187 L191 E192 H193 | T187-D189 VanDerWaalsContact C-N 3.26Å; T187-D189 PolarHBondContact O-N 3.2Å; D189-L191 VanDerWaalsContact C-N 3.28Å; D189-L191 PolarHBondContact O-N 3.35Å; D189-E192 PolarHBondContact O-N 3.31Å; D189-H193 PolarHBondContact O-N 2.67Å; D189-H193 PolarHBondContact O-ND1 2.62Å |
| 190 | E | 93.1 | Very high | 81.5 | Confident | 71 Ų | 71 | 89 Ų | 89 | 33% | 0.332 | 45% | 0.454 | S | S | . | . | H | α-helix | trans | -57.6 | -39.6 | 170.1 | -80.5 | 166.4 | -106.2 | 0 | 0 | 112.9 | P186 T187 E192 H193 F194 K246 | P186-E190 WeakPolarHBondContact CA-OE2 3.4Å; P186-E190 WeakPolarHBondContact CB-OE2 3.16Å; T187-E190 WeakPolarHBondContact CB-OE1 3.22Å; T187-E190 WeakPolarHBondContact CG2-OE1 3.38Å; T187-E190 PolarHBondContact N-OE1 3Å; T187-E190 PolarHBondContact O-N 3.2Å; T187-E190 WeakPolarHBondContact OG1-CB 3.46Å; T187-E190 VanDerWaalsContact OG1-CG 3.24Å; T187-E190 WeakPolarHBondContact OG1-CG 3.3Å; T187-E190 PolarHBondContact OG1-N 3.08Å; T187-E190 PolarHBondContact OG1-OE1 2.85Å; E190-E192 VanDerWaalsContact C-N 3.31Å; E190-H193 PolarHBondContact O-N 3.43Å; E190-F194 WeakPolarHBondContact O-CB 3.18Å; E190-F194 PolarHBondContact O-N 2.82Å; E190-K246 IonicContact OE2-NZ 3.79Å; E190-K246 PolarHBondContact OE2-NZ 3.24Å |
| 191 | L | 94.4 | Very high | 83.8 | Confident | 5 Ų | 5 | 84.1 Ų | 84.1 | 3% | 0.026 | 43% | 0.428 | C | S | . | . | H | α-helix | trans | -67.1 | -35.2 | 178.8 | -79.9 | 170.1 | 0 | 0 | 0 | 111.5 | T187 S188 D189 A195 F239 M242 K246 | T187-L191 PolarHBondContact O-N 3.37Å; S188-L191 PolarHBondContact O-N 3.48Å; D189-L191 VanDerWaalsContact C-N 3.28Å; D189-L191 PolarHBondContact O-N 3.35Å; L191-A195 VanDerWaalsContact O-CB 3.23Å; L191-A195 WeakPolarHBondContact O-CB 3.32Å; L191-A195 PolarHBondContact O-N 3.06Å; L191-F239 HydrophobicContact CD1-CD2 3.78Å; L191-F239 HydrophobicContact CD1-CE2 3.6Å; L191-F239 HydrophobicContact CD1-CZ 4.4Å; L191-M242 HydrophobicContact CD1-CB 3.82Å; L191-M242 HydrophobicContact CD2-CB 4.07Å; L191-M242 HydrophobicContact CG-CB 4.5Å; L191-K246 HydrophobicContact CD2-CB 3.9Å; L191-K246 HydrophobicContact CD2-CD 3.86Å; L191-K246 HydrophobicContact CD2-CG 4.04Å |
| 192 | E | 95.4 | Very high | 86.1 | Confident | 75 Ų | 75 | 80.7 Ų | 80.7 | 35% | 0.35 | 40% | 0.401 | S | S | . | . | H | α-helix | trans | -66.6 | -47.4 | 171 | 176.2 | 158.1 | 163.1 | 0 | 0 | 112.2 | S188 D189 E190 F194 A195 K196 L235 | S188-E192 PolarHBondContact O-N 3.41Å; S188-E192 VanDerWaalsContact O-N 3.12Å; D189-E192 PolarHBondContact O-N 3.31Å; E190-E192 VanDerWaalsContact C-N 3.31Å; E192-F194 PolarHBondContact O-N 3.46Å; E192-A195 PolarHBondContact O-N 3.14Å; E192-K196 HydrophobicContact CG-CD 4.13Å; E192-K196 VanDerWaalsContact CG-CE 3.47Å; E192-K196 VanDerWaalsContact O-CG 3.31Å; E192-K196 WeakPolarHBondContact O-CG 3.27Å; E192-K196 PolarHBondContact O-N 2.93Å; E192-K196 WeakPolarHBondContact OE1-CE 3.4Å; E192-K196 IonicContact OE1-NZ 2.72Å; E192-K196 PolarHBondContact OE1-NZ 2.87Å; E192-L235 HydrophobicContact CB-CD1 3.83Å; E192-L235 HydrophobicContact CG-CD1 3.83Å |
| 193 | H | 96.1 | Very high | 88.6 | Confident | 124 Ų | 124 | 78.7 Ų | 78.7 | 57% | 0.574 | 39% | 0.389 | S | S | * | . | H | α-helix | trans | -60.8 | -44.8 | 176.4 | -73.5 | 89.3 | 0 | 0 | 0 | 111.8 | D189 E190 K196 Q197 | D189-H193 PolarHBondContact O-N 2.67Å; D189-H193 PolarHBondContact O-ND1 2.62Å; E190-H193 PolarHBondContact O-N 3.43Å; H193-K196 PolarHBondContact O-N 3.34Å; H193-Q197 WeakPolarHBondContact O-CB 3.3Å; H193-Q197 PolarHBondContact O-N 3.48Å |
| 194 | F | 97.1 | Very high | 90.5 | Very high | 12 Ų | 12 | 78.3 Ų | 78.3 | 5% | 0.053 | 39% | 0.385 | C | S | . | . | H | α-helix | trans | -63.9 | -45.5 | 176.4 | 177 | -97.7 | 0 | 0 | 0 | 111.9 | E190 E192 K196 Q197 F198 F232 K246 L249 N250 | E190-F194 WeakPolarHBondContact O-CB 3.18Å; E190-F194 PolarHBondContact O-N 2.82Å; E192-F194 PolarHBondContact O-N 3.46Å; F194-K196 VanDerWaalsContact C-N 3.32Å; F194-K196 PolarHBondContact O-N 2.92Å; F194-Q197 PolarHBondContact O-N 2.92Å; F194-F198 HydrophobicContact CE1-CB 4.18Å; F194-F198 HydrophobicContact CE2-CB 4.47Å; F194-F198 HydrophobicContact CZ-CB 4.1Å; F194-F198 HydrophobicContact CZ-CD2 4.3Å; F194-F198 HydrophobicContact CZ-CG 4.47Å; F194-F198 WeakPolarHBondContact O-CB 3.4Å; F194-F198 PolarHBondContact O-N 2.72Å; F194-F232 AromaticContact CD1-CE1 3.65Å; F194-F232 HydrophobicContact CD1-CE1 3.65Å; F194-F232 AromaticContact CD1-CZ 3.58Å; F194-F232 HydrophobicContact CD1-CZ 3.58Å; F194-F232 AromaticContact CE1-CE1 3.53Å; F194-F232 HydrophobicContact CE1-CE1 3.53Å; F194-F232 AromaticContact CE1-CZ 3.54Å; F194-F232 HydrophobicContact CE1-CZ 3.54Å; F194-K246 HydrophobicContact CD1-CG 3.91Å; F194-K246 HydrophobicContact CE1-CG 4.2Å; F194-K246 HydrophobicContact CG-CG 4.11Å; F194-L249 HydrophobicContact CE1-CB 3.95Å; F194-L249 HydrophobicContact CZ-CB 3.87Å; F194-N250 HydrophobicContact CE2-CB 3.79Å; F194-N250 VanDerWaalsContact CE2-OD1 3.23Å; F194-N250 WeakPolarHBondContact CE2-OD1 3.18Å; F194-N250 HydrophobicContact CZ-CB 3.96Å |
| 195 | A | 97.4 | Very high | 91.7 | Very high | 2 Ų | 2 | 71.5 Ų | 71.5 | 2% | 0.017 | 35% | 0.354 | C | S | . | . | H | α-helix | trans | -61.7 | -39.6 | 178.6 | 0 | 0 | 0 | 0 | 0 | 112.4 | L191 E192 K199 F232 L235 | L191-A195 VanDerWaalsContact O-CB 3.23Å; L191-A195 WeakPolarHBondContact O-CB 3.32Å; L191-A195 PolarHBondContact O-N 3.06Å; E192-A195 PolarHBondContact O-N 3.14Å; A195-K199 VanDerWaalsContact O-CB 3.26Å; A195-K199 WeakPolarHBondContact O-CB 3.29Å; A195-K199 PolarHBondContact O-N 3.39Å; A195-K199 VanDerWaalsContact O-N 3.09Å; A195-F232 HydrophobicContact CB-CD1 4.39Å; A195-F232 HydrophobicContact CB-CE1 4.11Å; A195-L235 HydrophobicContact CB-CD2 3.61Å |
| 196 | K | 97 | Very high | 92.9 | Very high | 116 Ų | 116 | 69.5 Ų | 69.5 | 50% | 0.504 | 35% | 0.354 | S | S | . | . | H | α-helix | trans | -62.9 | -50.8 | 172.7 | -71.2 | 169.2 | -177.4 | 170 | 0 | 111.6 | E192 H193 F194 K199 Q200 | E192-K196 HydrophobicContact CG-CD 4.13Å; E192-K196 VanDerWaalsContact CG-CE 3.47Å; E192-K196 VanDerWaalsContact O-CG 3.31Å; E192-K196 WeakPolarHBondContact O-CG 3.27Å; E192-K196 PolarHBondContact O-N 2.93Å; E192-K196 WeakPolarHBondContact OE1-CE 3.4Å; E192-K196 IonicContact OE1-NZ 2.72Å; E192-K196 PolarHBondContact OE1-NZ 2.87Å; H193-K196 PolarHBondContact O-N 3.34Å; F194-K196 VanDerWaalsContact C-N 3.32Å; F194-K196 PolarHBondContact O-N 2.92Å; K196-K199 PolarHBondContact O-N 3.06Å; K196-Q200 WeakPolarHBondContact O-CB 3.48Å; K196-Q200 PolarHBondContact O-N 3.24Å |
| 197 | Q | 96.9 | Very high | 93.7 | Very high | 77 Ų | 77 | 69.9 Ų | 69.9 | 36% | 0.36 | 35% | 0.353 | S | S | . | . | H | α-helix | trans | -62.5 | -48.2 | -178.8 | -174.3 | -174.6 | 99.1 | 0 | 0 | 112 | H193 F194 K199 Q200 R201 | H193-Q197 WeakPolarHBondContact O-CB 3.3Å; H193-Q197 PolarHBondContact O-N 3.48Å; F194-Q197 PolarHBondContact O-N 2.92Å; Q197-K199 VanDerWaalsContact C-N 3.35Å; Q197-K199 PolarHBondContact O-N 3.45Å; Q197-Q200 PolarHBondContact O-N 2.93Å; Q197-R201 VanDerWaalsContact CD-NH2 3.32Å; Q197-R201 PolarHBondContact O-N 2.98Å |
| 198 | F | 97.5 | Very high | 94.1 | Very high | 0 Ų | 0 | 70 Ų | 70 | 0% | 0 | 35% | 0.354 | C | S | . | . | H | α-helix | trans | -55.9 | -48 | 175.6 | 168.5 | -89.8 | 0 | 0 | 0 | 111.3 | F194 Q200 R201 R202 V212 I229 E233 L249 W252 L253 | F194-F198 HydrophobicContact CE1-CB 4.18Å; F194-F198 HydrophobicContact CE2-CB 4.47Å; F194-F198 HydrophobicContact CZ-CB 4.1Å; F194-F198 HydrophobicContact CZ-CD2 4.3Å; F194-F198 HydrophobicContact CZ-CG 4.47Å; F194-F198 WeakPolarHBondContact O-CB 3.4Å; F194-F198 PolarHBondContact O-N 2.72Å; F198-Q200 PolarHBondContact O-N 3.3Å; F198-R201 PolarHBondContact O-N 3.31Å; F198-R202 VanDerWaalsContact O-CB 3.27Å; F198-R202 WeakPolarHBondContact O-CB 3.26Å; F198-R202 PolarHBondContact O-N 3.43Å; F198-V212 HydrophobicContact CE2-CG1 4.43Å; F198-V212 HydrophobicContact CZ-CG1 4.09Å; F198-I229 HydrophobicContact CE1-CG2 3.84Å; F198-I229 HydrophobicContact CZ-CG2 4.1Å; F198-E233 HydrophobicContact CD1-CG 4.13Å; F198-E233 HydrophobicContact CE1-CG 4.1Å; F198-L249 HydrophobicContact CD2-CB 4.03Å; F198-L249 HydrophobicContact CD2-CD2 4.49Å; F198-L249 HydrophobicContact CE1-CD2 4.37Å; F198-L249 HydrophobicContact CE2-CB 3.93Å; F198-L249 HydrophobicContact CE2-CD2 3.66Å; F198-L249 HydrophobicContact CE2-CG 4.33Å; F198-L249 HydrophobicContact CZ-CD2 3.6Å; F198-W252 AromaticContact CE2-CE3 3.83Å; F198-W252 HydrophobicContact CE2-CE3 3.83Å; F198-W252 AromaticContact CE2-CZ3 3.89Å; F198-W252 HydrophobicContact CE2-CZ3 3.89Å; F198-W252 HydrophobicContact CZ-CZ3 4.42Å; F198-L253 HydrophobicContact CB-CD2 4.39Å; F198-L253 HydrophobicContact CD2-CD1 4.14Å; F198-L253 HydrophobicContact CD2-CD2 4.28Å |
| 199 | K | 97.3 | Very high | 94.3 | Very high | 90 Ų | 90 | 67.8 Ų | 67.8 | 39% | 0.391 | 34% | 0.335 | S | S | . | . | H | α-helix | trans | -60.1 | -45.8 | 177.2 | -176.3 | 179.7 | -171.4 | -179.2 | 0 | 111.7 | A195 K196 Q197 I203 E233 | A195-K199 VanDerWaalsContact O-CB 3.26Å; A195-K199 WeakPolarHBondContact O-CB 3.29Å; A195-K199 PolarHBondContact O-N 3.39Å; A195-K199 VanDerWaalsContact O-N 3.09Å; K196-K199 PolarHBondContact O-N 3.06Å; Q197-K199 VanDerWaalsContact C-N 3.35Å; Q197-K199 PolarHBondContact O-N 3.45Å; K199-I203 HydrophobicContact CG-CD1 3.97Å; K199-I203 WeakPolarHBondContact O-CD1 3.46Å; K199-I203 VanDerWaalsContact O-CG1 3.26Å; K199-I203 WeakPolarHBondContact O-CG1 3.2Å; K199-I203 PolarHBondContact O-N 2.99Å; K199-I203 VanDerWaalsContact O-N 3.11Å; K199-E233 HydrophobicContact CB-CG 4.01Å; K199-E233 HydrophobicContact CD-CB 4.22Å; K199-E233 HydrophobicContact CD-CG 4.41Å; K199-E233 HydrophobicContact CG-CG 4.17Å |
| 200 | Q | 96.4 | Very high | 94.3 | Very high | 140 Ų | 140 | 64.7 Ų | 64.7 | 65% | 0.654 | 32% | 0.324 | S | S | * | . | H | α-helix | trans | -63 | -49.3 | 179.9 | -173.2 | -176.1 | 14.5 | 0 | 0 | 111.5 | K196 Q197 F198 I203 K204 | K196-Q200 WeakPolarHBondContact O-CB 3.48Å; K196-Q200 PolarHBondContact O-N 3.24Å; Q197-Q200 PolarHBondContact O-N 2.93Å; F198-Q200 PolarHBondContact O-N 3.3Å; Q200-I203 PolarHBondContact O-N 2.92Å; Q200-K204 WeakPolarHBondContact O-CB 3.41Å; Q200-K204 PolarHBondContact O-N 3.11Å |
| 201 | R | 94.7 | Very high | 94.2 | Very high | 66 Ų | 66 | 63.6 Ų | 63.6 | 25% | 0.249 | 32% | 0.32 | C | S | . | . | H | α-helix | trans | -66 | -44.1 | 178.7 | -70 | -156.4 | -156.4 | 139 | 6.9 | 112.1 | Q197 F198 I203 K204 L205 L253 D257 | Q197-R201 VanDerWaalsContact CD-NH2 3.32Å; Q197-R201 PolarHBondContact O-N 2.98Å; F198-R201 PolarHBondContact O-N 3.31Å; R201-I203 VanDerWaalsContact C-N 3.28Å; R201-I203 PolarHBondContact O-N 2.9Å; R201-K204 WeakPolarHBondContact O-CB 3.46Å; R201-K204 PolarHBondContact O-N 3.22Å; R201-K204 VanDerWaalsContact O-N 3.09Å; R201-L205 WeakPolarHBondContact O-CB 3.32Å; R201-L205 WeakPolarHBondContact O-CG 3.29Å; R201-L205 PolarHBondContact O-N 2.88Å; R201-L253 HydrophobicContact CB-CD1 3.81Å; R201-L253 HydrophobicContact CB-CD2 4.27Å; R201-L253 HydrophobicContact CB-CG 4.38Å; R201-D257 WeakPolarHBondContact CD-OD2 3.49Å; R201-D257 IonicContact CZ-OD2 2.82Å; R201-D257 IonicContact NE-OD2 2.67Å; R201-D257 IonicContact NH1-OD2 3.53Å; R201-D257 PolarHBondContact NH1-OD2 2.79Å |
| 202 | R | 94.9 | Very high | 94.2 | Very high | 20 Ų | 20 | 63.3 Ų | 63.3 | 8% | 0.075 | 32% | 0.319 | C | S | . | . | H | α-helix | trans | -52.7 | -46.4 | 174.2 | -175.3 | -169 | 54.8 | 66.1 | -1 | 111.7 | F198 L205 G206 F207 V212 E233 W252 | F198-R202 VanDerWaalsContact O-CB 3.27Å; F198-R202 WeakPolarHBondContact O-CB 3.26Å; F198-R202 PolarHBondContact O-N 3.43Å; R202-L205 PolarHBondContact O-N 2.98Å; R202-G206 PolarHBondContact O-N 3.47Å; R202-F207 HydrophobicContact CG-CB 3.82Å; R202-F207 WeakPolarHBondContact CG-O 3.4Å; R202-F207 PolarHBondContact NH1-O 3.28Å; R202-F207 PolarHBondContact O-N 2.95Å; R202-V212 VanDerWaalsContact CD-CG2 3.49Å; R202-V212 HydrophobicContact CG-CG2 3.85Å; R202-E233 IonicContact CZ-OE1 2.69Å; R202-E233 IonicContact NE-OE1 3.51Å; R202-E233 PolarHBondContact NE-OE1 2.85Å; R202-E233 VanDerWaalsContact NH2-CD 3.34Å; R202-E233 IonicContact NH2-OE1 2.6Å; R202-E233 PolarHBondContact NH2-OE1 3.5Å; R202-E233 IonicContact NH2-OE2 2.81Å; R202-E233 PolarHBondContact NH2-OE2 3.49Å; R202-W252 HydrophobicContact CG-CH2 4.37Å |
| 203 | I | 93.3 | Very high | 94 | Very high | 99 Ų | 99 | 59.8 Ų | 59.8 | 51% | 0.508 | 30% | 0.302 | S | S | . | . | H | α-helix | trans | -67.7 | -42.1 | 178.5 | -66.9 | 167.6 | 0 | 0 | 0 | 111.1 | K199 Q200 R201 L205 G206 | K199-I203 HydrophobicContact CG-CD1 3.97Å; K199-I203 WeakPolarHBondContact O-CD1 3.46Å; K199-I203 VanDerWaalsContact O-CG1 3.26Å; K199-I203 WeakPolarHBondContact O-CG1 3.2Å; K199-I203 PolarHBondContact O-N 2.99Å; K199-I203 VanDerWaalsContact O-N 3.11Å; Q200-I203 PolarHBondContact O-N 2.92Å; R201-I203 VanDerWaalsContact C-N 3.28Å; R201-I203 PolarHBondContact O-N 2.9Å; I203-L205 VanDerWaalsContact C-N 3.26Å; I203-L205 PolarHBondContact O-N 3.35Å; I203-G206 PolarHBondContact O-N 2.87Å |
| 204 | K | 92.9 | Very high | 93.6 | Very high | 183 Ų | 183 | 56.5 Ų | 56.5 | 80% | 0.796 | 29% | 0.289 | S | S | * | . | H | α-helix | trans | -60.1 | -35 | 176 | -173.3 | -174.1 | 175.9 | -169.2 | 0 | 112.6 | Q200 R201 G206 | Q200-K204 WeakPolarHBondContact O-CB 3.41Å; Q200-K204 PolarHBondContact O-N 3.11Å; R201-K204 WeakPolarHBondContact O-CB 3.46Å; R201-K204 PolarHBondContact O-N 3.22Å; R201-K204 VanDerWaalsContact O-N 3.09Å; K204-G206 VanDerWaalsContact C-N 3.31Å |
| 205 | L | 88.9 | Confident | 93.1 | Very high | 39 Ų | 39 | 56.3 Ų | 56.3 | 20% | 0.204 | 29% | 0.29 | C | S | . | . | T | Hydrogen-bonded Turn | trans | -84.5 | 2.3 | 175.8 | -62.8 | -177.6 | 0 | 0 | 0 | 113.7 | R201 R202 I203 F207 A256 T260 | R201-L205 WeakPolarHBondContact O-CB 3.32Å; R201-L205 WeakPolarHBondContact O-CG 3.29Å; R201-L205 PolarHBondContact O-N 2.88Å; R202-L205 PolarHBondContact O-N 2.98Å; I203-L205 VanDerWaalsContact C-N 3.26Å; I203-L205 PolarHBondContact O-N 3.35Å; L205-F207 HydrophobicContact CB-CD2 3.66Å; L205-F207 HydrophobicContact CB-CE2 3.88Å; L205-F207 HydrophobicContact CD1-CD2 4.46Å; L205-F207 HydrophobicContact CD1-CE2 4.31Å; L205-F207 PolarHBondContact O-N 3.3Å; L205-A256 HydrophobicContact CD1-CB 3.8Å; L205-T260 HydrophobicContact CD2-CG2 4.09Å; L205-T260 VanDerWaalsContact CD2-OG1 3.24Å; L205-T260 WeakPolarHBondContact CD2-OG1 3.44Å |
| 206 | G | 88.9 | Confident | 92.7 | Very high | 62 Ų | 62 | 56.2 Ų | 56.2 | 64% | 0.639 | 29% | 0.289 | S | S | * | . | T | Hydrogen-bonded Turn | trans | 76.7 | -8 | 176.5 | 0 | 0 | 0 | 0 | 0 | 116.5 | R202 I203 K204 | R202-G206 PolarHBondContact O-N 3.47Å; I203-G206 PolarHBondContact O-N 2.87Å; K204-G206 VanDerWaalsContact C-N 3.31Å |
| 207 | F | 90.4 | Very high | 92.1 | Very high | 33 Ų | 33 | 50.7 Ų | 50.7 | 15% | 0.145 | 27% | 0.265 | C | S | . | . | trans | -65.8 | 137.1 | -178.2 | -69 | -69.1 | 0 | 0 | 0 | 112.9 | R202 L205 D211 V212 W252 A256 I266 | R202-F207 HydrophobicContact CG-CB 3.82Å; R202-F207 WeakPolarHBondContact CG-O 3.4Å; R202-F207 PolarHBondContact NH1-O 3.28Å; R202-F207 PolarHBondContact O-N 2.95Å; L205-F207 HydrophobicContact CB-CD2 3.66Å; L205-F207 HydrophobicContact CB-CE2 3.88Å; L205-F207 HydrophobicContact CD1-CD2 4.46Å; L205-F207 HydrophobicContact CD1-CE2 4.31Å; L205-F207 PolarHBondContact O-N 3.3Å; F207-D211 HydrophobicContact CD1-CB 4.15Å; F207-V212 HydrophobicContact CB-CG2 4.23Å; F207-W252 HydrophobicContact CB-CH2 4.25Å; F207-W252 HydrophobicContact CB-CZ2 4.49Å; F207-W252 HydrophobicContact CD1-CZ2 4.4Å; F207-W252 AromaticContact CD2-CH2 3.64Å; F207-W252 HydrophobicContact CD2-CH2 3.64Å; F207-W252 AromaticContact CD2-CZ2 3.73Å; F207-W252 HydrophobicContact CD2-CZ2 3.73Å; F207-W252 HydrophobicContact CE2-CH2 4.25Å; F207-W252 HydrophobicContact CE2-CZ2 4.03Å; F207-W252 HydrophobicContact CG-CH2 4.03Å; F207-W252 AromaticContact CG-CZ2 3.94Å; F207-W252 HydrophobicContact CG-CZ2 3.94Å; F207-W252 HydrophobicContact CZ-CZ2 4.49Å; F207-A256 HydrophobicContact CE2-CB 4.23Å; F207-I266 HydrophobicContact CE1-CD1 4.49Å; F207-I266 HydrophobicContact CE1-CG1 4.26Å; F207-I266 HydrophobicContact CE1-CG2 4.49Å; F207-I266 HydrophobicContact CE2-CD1 4.13Å; F207-I266 HydrophobicContact CZ-CB 4.45Å; F207-I266 HydrophobicContact CZ-CD1 3.58Å; F207-I266 HydrophobicContact CZ-CG1 3.75Å; F207-I266 HydrophobicContact CZ-CG2 3.89Å | ||
| 208 | T | 94.1 | Very high | 91.4 | Very high | 70 Ų | 70 | 48.9 Ų | 48.9 | 43% | 0.429 | 26% | 0.259 | S | S | . | . | trans | -79.7 | 162.6 | 167.7 | 79.7 | 0 | 0 | 0 | 0 | 111.3 | A210 D211 V212 | T208-A210 PolarHBondContact O-N 3.48Å; T208-A210 PolarHBondContact OG1-N 3.21Å; T208-A210 VanDerWaalsContact OG1-N 3.17Å; T208-D211 WeakPolarHBondContact CA-OD2 3.4Å; T208-D211 WeakPolarHBondContact CB-OD2 3.32Å; T208-D211 VanDerWaalsContact CG2-OD2 3.31Å; T208-D211 WeakPolarHBondContact CG2-OD2 3.46Å; T208-D211 PolarHBondContact N-OD2 3.3Å; T208-D211 PolarHBondContact O-N 3.4Å; T208-D211 PolarHBondContact OG1-N 3.32Å; T208-D211 PolarHBondContact OG1-OD1 3.2Å; T208-D211 PolarHBondContact OG1-OD2 3.05Å; T208-V212 PolarHBondContact O-N 3.49Å | ||
| 209 | Q | 93.6 | Very high | 90.2 | Very high | 33 Ų | 33 | 52.2 Ų | 52.2 | 15% | 0.154 | 28% | 0.276 | C | S | . | . | H | α-helix | trans | -61.1 | -19.2 | 171.2 | -70.2 | 172.9 | -14.9 | 0 | 0 | 113.4 | Q226 I229 E233 | Q209-Q226 HydrophobicContact CB-CB 4.43Å; Q209-Q226 HydrophobicContact CB-CG 3.88Å; Q209-I229 HydrophobicContact CB-CB 4.16Å; Q209-I229 HydrophobicContact CB-CG2 4.21Å; Q209-I229 HydrophobicContact CG-CB 4.38Å; Q209-I229 HydrophobicContact CG-CG2 4.06Å; Q209-I229 WeakPolarHBondContact O-CG1 3.42Å; Q209-E233 PolarHBondContact NE2-OE2 3.39Å |
| 210 | A | 90.6 | Very high | 89.4 | Confident | 42 Ų | 42 | 51.5 Ų | 51.5 | 35% | 0.347 | 27% | 0.272 | S | S | . | . | H | α-helix | trans | -78.7 | -41.9 | 174.9 | 0 | 0 | 0 | 0 | 0 | 111.1 | T208 V212 G213 L214 Q226 | T208-A210 PolarHBondContact O-N 3.48Å; T208-A210 PolarHBondContact OG1-N 3.21Å; T208-A210 VanDerWaalsContact OG1-N 3.17Å; A210-V212 PolarHBondContact O-N 2.81Å; A210-G213 WeakPolarHBondContact O-CA 3.32Å; A210-G213 PolarHBondContact O-N 3.08Å; A210-G213 VanDerWaalsContact O-N 3.08Å; A210-L214 WeakPolarHBondContact O-CG 3.39Å; A210-L214 PolarHBondContact O-N 3.17Å; A210-Q226 HydrophobicContact CB-CB 4.45Å |
| 211 | D | 90.9 | Very high | 88.6 | Confident | 47 Ų | 47 | 47.2 Ų | 47.2 | 25% | 0.251 | 27% | 0.266 | S | S | . | . | H | α-helix | trans | -65.2 | -41.3 | -176.8 | -48.1 | -43.8 | 0 | 0 | 0 | 111.4 | F207 T208 G213 L214 A215 | F207-D211 HydrophobicContact CD1-CB 4.15Å; T208-D211 WeakPolarHBondContact CA-OD2 3.4Å; T208-D211 WeakPolarHBondContact CB-OD2 3.32Å; T208-D211 VanDerWaalsContact CG2-OD2 3.31Å; T208-D211 WeakPolarHBondContact CG2-OD2 3.46Å; T208-D211 PolarHBondContact N-OD2 3.3Å; T208-D211 PolarHBondContact O-N 3.4Å; T208-D211 PolarHBondContact OG1-N 3.32Å; T208-D211 PolarHBondContact OG1-OD1 3.2Å; T208-D211 PolarHBondContact OG1-OD2 3.05Å; D211-G213 VanDerWaalsContact C-N 3.31Å; D211-G213 PolarHBondContact O-N 3.43Å; D211-L214 PolarHBondContact O-N 2.61Å; D211-A215 WeakPolarHBondContact O-CB 3.29Å; D211-A215 PolarHBondContact O-N 2.78Å |
| 212 | V | 92.9 | Very high | 88 | Confident | 0 Ų | 0 | 49.8 Ų | 49.8 | 0% | 0 | 28% | 0.284 | C | S | . | . | H | α-helix | trans | -62.3 | -40.7 | 172.5 | -171.9 | 0 | 0 | 0 | 0 | 111.3 | F198 R202 F207 T208 A210 L214 A215 L216 I229 L249 W252 | F198-V212 HydrophobicContact CE2-CG1 4.43Å; F198-V212 HydrophobicContact CZ-CG1 4.09Å; R202-V212 VanDerWaalsContact CD-CG2 3.49Å; R202-V212 HydrophobicContact CG-CG2 3.85Å; F207-V212 HydrophobicContact CB-CG2 4.23Å; T208-V212 PolarHBondContact O-N 3.49Å; A210-V212 PolarHBondContact O-N 2.81Å; V212-L214 VanDerWaalsContact C-N 3.27Å; V212-L214 PolarHBondContact O-N 3.12Å; V212-A215 PolarHBondContact O-N 3.24Å; V212-L216 HydrophobicContact CG1-CD1 3.87Å; V212-L216 HydrophobicContact CG1-CG 4.15Å; V212-L216 WeakPolarHBondContact O-CB 3.42Å; V212-L216 VanDerWaalsContact O-CG 3.22Å; V212-L216 WeakPolarHBondContact O-CG 3.5Å; V212-L216 PolarHBondContact O-N 3.46Å; V212-I229 HydrophobicContact CG1-CD1 4.44Å; V212-L249 HydrophobicContact CG1-CD2 4.29Å; V212-W252 HydrophobicContact CB-CH2 4.44Å; V212-W252 HydrophobicContact CB-CZ2 4.36Å; V212-W252 HydrophobicContact CG1-CD2 3.7Å; V212-W252 HydrophobicContact CG1-CE3 3.75Å; V212-W252 HydrophobicContact CG1-CG 4.28Å; V212-W252 HydrophobicContact CG1-CH2 4.33Å; V212-W252 HydrophobicContact CG1-CZ2 4.28Å; V212-W252 HydrophobicContact CG1-CZ3 4.06Å; V212-W252 HydrophobicContact CG2-CE3 4.33Å; V212-W252 HydrophobicContact CG2-CH2 3.42Å; V212-W252 VanDerWaalsContact CG2-CH2 3.42Å; V212-W252 HydrophobicContact CG2-CZ2 3.63Å; V212-W252 HydrophobicContact CG2-CZ3 3.79Å |
| 213 | G | 91.9 | Very high | 87.5 | Confident | 0 Ų | 0 | 50.1 Ų | 50.1 | 0% | 0 | 29% | 0.288 | C | S | . | . | H | α-helix | trans | -62.6 | -33.7 | 176.7 | 0 | 0 | 0 | 0 | 0 | 113.4 | A210 D211 G217 V223 F224 | A210-G213 WeakPolarHBondContact O-CA 3.32Å; A210-G213 PolarHBondContact O-N 3.08Å; A210-G213 VanDerWaalsContact O-N 3.08Å; D211-G213 VanDerWaalsContact C-N 3.31Å; D211-G213 PolarHBondContact O-N 3.43Å; G213-G217 PolarHBondContact O-N 3.38Å; G213-V223 WeakPolarHBondContact O-CG1 3.42Å; G213-F224 PolarHBondContact O-N 3.15Å |
| 214 | L | 87.6 | Confident | 87.3 | Confident | 56 Ų | 56 | 47.6 Ų | 47.6 | 29% | 0.293 | 27% | 0.274 | S | S | . | . | H | α-helix | trans | -73.9 | -50.9 | 173.6 | -70.7 | 166.2 | 0 | 0 | 0 | 112 | A210 D211 V212 L216 G217 T218 V223 | A210-L214 WeakPolarHBondContact O-CG 3.39Å; A210-L214 PolarHBondContact O-N 3.17Å; D211-L214 PolarHBondContact O-N 2.61Å; V212-L214 VanDerWaalsContact C-N 3.27Å; V212-L214 PolarHBondContact O-N 3.12Å; L214-L216 PolarHBondContact O-N 3.01Å; L214-G217 CarbonylContact O-C 3.47Å; L214-G217 VanDerWaalsContact O-CA 3.26Å; L214-G217 WeakPolarHBondContact O-CA 3.41Å; L214-G217 PolarHBondContact O-N 3.3Å; L214-T218 PolarHBondContact O-N 3.4Å; L214-V223 HydrophobicContact CD2-CG1 3.97Å |
| 215 | A | 87.3 | Confident | 87.1 | Confident | 8 Ų | 8 | 40 Ų | 40 | 7% | 0.066 | 24% | 0.243 | C | C | . | . | H | α-helix | trans | -60.2 | -43.8 | -178.7 | 0 | 0 | 0 | 0 | 0 | 112.4 | D211 V212 G217 T218 L219 I269 | D211-A215 WeakPolarHBondContact O-CB 3.29Å; D211-A215 PolarHBondContact O-N 2.78Å; V212-A215 PolarHBondContact O-N 3.24Å; A215-G217 PolarHBondContact O-N 2.9Å; A215-T218 WeakPolarHBondContact O-CA 3.22Å; A215-T218 WeakPolarHBondContact O-CB 3.23Å; A215-T218 PolarHBondContact O-N 2.94Å; A215-L219 PolarHBondContact O-N 3.26Å; A215-I269 HydrophobicContact CB-CG2 4.2Å |
| 216 | L | 88.9 | Confident | 87.3 | Confident | 0 Ų | 0 | 42.1 Ų | 42.1 | 0% | 0 | 25% | 0.252 | C | S | . | . | H | α-helix | trans | -59.8 | -32.6 | 170.7 | -70.3 | 171.9 | 0 | 0 | 0 | 112.5 | V212 L214 T218 L219 Y220 F224 I229 L248 L249 W252 | V212-L216 HydrophobicContact CG1-CD1 3.87Å; V212-L216 HydrophobicContact CG1-CG 4.15Å; V212-L216 WeakPolarHBondContact O-CB 3.42Å; V212-L216 VanDerWaalsContact O-CG 3.22Å; V212-L216 WeakPolarHBondContact O-CG 3.5Å; V212-L216 PolarHBondContact O-N 3.46Å; L214-L216 PolarHBondContact O-N 3.01Å; L216-T218 VanDerWaalsContact C-N 3.31Å; L216-L219 PolarHBondContact O-N 3.05Å; L216-Y220 HydrophobicContact CB-CD2 4.4Å; L216-Y220 HydrophobicContact CD2-CD2 3.8Å; L216-Y220 HydrophobicContact CD2-CE2 3.61Å; L216-Y220 WeakPolarHBondContact O-CB 3.28Å; L216-Y220 PolarHBondContact O-N 3.12Å; L216-F224 HydrophobicContact CB-CD2 3.73Å; L216-F224 HydrophobicContact CB-CE2 4.13Å; L216-F224 HydrophobicContact CD1-CD2 3.68Å; L216-F224 HydrophobicContact CD1-CE2 4.16Å; L216-F224 HydrophobicContact CG-CD2 4.35Å; L216-I229 HydrophobicContact CD1-CD1 4.16Å; L216-L248 HydrophobicContact CD2-CB 4.44Å; L216-L248 WeakPolarHBondContact CD2-O 3.43Å; L216-L249 HydrophobicContact CD1-CD2 3.73Å; L216-W252 HydrophobicContact CD2-CB 3.66Å; L216-W252 HydrophobicContact CD2-CG 4.19Å; L216-W252 HydrophobicContact CG-CB 4.46Å |
| 217 | G | 85.2 | Confident | 87.6 | Confident | 0 Ų | 0 | 42.4 Ų | 42.4 | 0% | 0 | 24% | 0.242 | C | C | . | . | H | α-helix | trans | -72.1 | -21.4 | 173.4 | 0 | 0 | 0 | 0 | 0 | 114.3 | G213 L214 A215 G221 N222 R274 | G213-G217 PolarHBondContact O-N 3.38Å; L214-G217 CarbonylContact O-C 3.47Å; L214-G217 VanDerWaalsContact O-CA 3.26Å; L214-G217 WeakPolarHBondContact O-CA 3.41Å; L214-G217 PolarHBondContact O-N 3.3Å; A215-G217 PolarHBondContact O-N 2.9Å; G217-G221 CarbonylContact O-C 3.49Å; G217-G221 WeakPolarHBondContact O-CA 3.14Å; G217-G221 PolarHBondContact O-N 2.91Å; G217-N222 WeakPolarHBondContact CA-O 3.43Å; G217-R274 PolarHBondContact O-NH2 2.93Å |
| 218 | T | 80.5 | Confident | 87.9 | Confident | 39 Ų | 39 | 42.4 Ų | 42.4 | 24% | 0.239 | 25% | 0.245 | C | C | . | . | H | α-helix | trans | -75.1 | -52.3 | 167.7 | -59.7 | 0 | 0 | 0 | 0 | 110.2 | L214 A215 L216 I269 R274 | L214-T218 PolarHBondContact O-N 3.4Å; A215-T218 WeakPolarHBondContact O-CA 3.22Å; A215-T218 WeakPolarHBondContact O-CB 3.23Å; A215-T218 PolarHBondContact O-N 2.94Å; L216-T218 VanDerWaalsContact C-N 3.31Å; T218-I269 HydrophobicContact CG2-CG2 4.11Å; T218-R274 PolarHBondContact O-NH2 2.97Å |
| 219 | L | 72.9 | Confident | 88 | Confident | 69 Ų | 69 | 39.1 Ų | 39.1 | 36% | 0.361 | 22% | 0.224 | S | C | . | . | H | α-helix | trans | -67.1 | -42.1 | -176.3 | -64.8 | 169.7 | 0 | 0 | 0 | 114.4 | A215 L216 E255 | A215-L219 PolarHBondContact O-N 3.26Å; L216-L219 PolarHBondContact O-N 3.05Å; L219-E255 VanDerWaalsContact CD1-OE2 3.28Å; L219-E255 WeakPolarHBondContact CD1-OE2 3.43Å; L219-E255 WeakPolarHBondContact CD2-OE2 3.48Å |
| 220 | Y | 81.4 | Confident | 88.1 | Confident | 75 Ų | 75 | 39.8 Ų | 39.8 | 29% | 0.294 | 23% | 0.232 | S | C | . | . | S | Bend | trans | -118.3 | 14.6 | -170.9 | -56 | -76.6 | 0 | 0 | 0 | 113.7 | L216 N222 L248 K251 | L216-Y220 HydrophobicContact CB-CD2 4.4Å; L216-Y220 HydrophobicContact CD2-CD2 3.8Å; L216-Y220 HydrophobicContact CD2-CE2 3.61Å; L216-Y220 WeakPolarHBondContact O-CB 3.28Å; L216-Y220 PolarHBondContact O-N 3.12Å; Y220-N222 PolarHBondContact O-N 3.26Å; Y220-L248 HydrophobicContact CD1-CD2 3.73Å; Y220-L248 HydrophobicContact CD2-CD2 4.17Å; Y220-L248 HydrophobicContact CE1-CD2 3.57Å; Y220-L248 HydrophobicContact CE2-CB 4.26Å; Y220-L248 HydrophobicContact CE2-CD2 4.04Å; Y220-L248 HydrophobicContact CG-CD2 4.01Å; Y220-K251 WeakPolarHBondContact OH-CB 3.34Å; Y220-K251 WeakPolarHBondContact OH-CD 3.26Å; Y220-K251 WeakPolarHBondContact OH-CG 3.45Å |
| 221 | G | 78.3 | Confident | 88.4 | Confident | 51 Ų | 51 | 43.7 Ų | 43.7 | 53% | 0.526 | 24% | 0.238 | S | C | . | . | S | Bend | trans | 70.8 | -17.3 | 176 | 0 | 0 | 0 | 0 | 0 | 116.6 | G217 | G217-G221 CarbonylContact O-C 3.49Å; G217-G221 WeakPolarHBondContact O-CA 3.14Å; G217-G221 PolarHBondContact O-N 2.91Å |
| 222 | N | 82.5 | Confident | 88.8 | Confident | 119 Ų | 119 | 41.5 Ų | 41.5 | 64% | 0.636 | 23% | 0.226 | S | C | * | . | trans | -115.1 | 108.7 | -176.8 | -80.7 | -61.3 | 0 | 0 | 0 | 112.2 | G217 Y220 F224 | G217-N222 WeakPolarHBondContact CA-O 3.43Å; Y220-N222 PolarHBondContact O-N 3.26Å; N222-F224 PolarHBondContact O-N 2.85Å | ||
| 223 | V | 84.3 | Confident | 89 | Confident | 27 Ų | 27 | 42.2 Ų | 42.2 | 16% | 0.164 | 23% | 0.23 | C | C | . | . | trans | -68.1 | 113.5 | 177.7 | -178 | 0 | 0 | 0 | 0 | 110.7 | G213 L214 R276 | G213-V223 WeakPolarHBondContact O-CG1 3.42Å; L214-V223 HydrophobicContact CD2-CG1 3.97Å; V223-R276 HydrophobicContact CB-CB 4.04Å; V223-R276 HydrophobicContact CB-CG 4.13Å; V223-R276 HydrophobicContact CG1-CB 4.05Å; V223-R276 HydrophobicContact CG1-CG 4.31Å; V223-R276 WeakPolarHBondContact O-CD 3.43Å; V223-R276 PolarHBondContact O-NE 2.8Å | ||
| 224 | F | 89.7 | Confident | 89.2 | Confident | 46 Ų | 46 | 44.5 Ų | 44.5 | 20% | 0.202 | 25% | 0.248 | C | C | . | . | trans | -75.1 | 158.8 | 172 | -66.1 | -72.8 | 0 | 0 | 0 | 110.9 | G213 L216 N222 T228 I229 L245 L248 | G213-F224 PolarHBondContact O-N 3.15Å; L216-F224 HydrophobicContact CB-CD2 3.73Å; L216-F224 HydrophobicContact CB-CE2 4.13Å; L216-F224 HydrophobicContact CD1-CD2 3.68Å; L216-F224 HydrophobicContact CD1-CE2 4.16Å; L216-F224 HydrophobicContact CG-CD2 4.35Å; N222-F224 PolarHBondContact O-N 2.85Å; F224-T228 HydrophobicContact CB-CG2 4.48Å; F224-T228 HydrophobicContact CD1-CG2 3.97Å; F224-I229 HydrophobicContact CB-CD1 4.36Å; F224-L245 HydrophobicContact CD1-CD2 4.35Å; F224-L245 HydrophobicContact CE1-CD2 3.75Å; F224-L245 HydrophobicContact CE2-CD2 4.47Å; F224-L245 HydrophobicContact CZ-CD2 3.81Å; F224-L248 HydrophobicContact CE2-CD1 4.09Å; F224-L248 HydrophobicContact CZ-CD1 3.84Å | ||
| 225 | S | 89 | Confident | 89.6 | Confident | 23 Ų | 23 | 45.1 Ų | 45.1 | 16% | 0.161 | 25% | 0.252 | C | S | . | . | trans | -91.1 | 153 | 175.3 | 62.8 | 0 | 0 | 0 | 0 | 111.5 | T227 T228 I229 | S225-T227 PolarHBondContact O-N 2.89Å; S225-T227 VanDerWaalsContact O-N 3.12Å; S225-T228 PolarHBondContact N-OG1 3.09Å; S225-T228 WeakPolarHBondContact O-CA 3.41Å; S225-T228 WeakPolarHBondContact O-CB 3.33Å; S225-T228 PolarHBondContact O-N 3.39Å; S225-T228 PolarHBondContact O-OG1 3.4Å; S225-T228 PolarHBondContact OG-N 2.85Å; S225-T228 PolarHBondContact OG-OG1 3Å; S225-I229 PolarHBondContact O-N 3.03Å; S225-I229 VanDerWaalsContact O-N 3.16Å | ||
| 226 | Q | 92.7 | Very high | 90 | Very high | 84 Ų | 84 | 51 Ų | 51 | 39% | 0.393 | 28% | 0.278 | S | S | . | . | H | α-helix | trans | -43.2 | -43.5 | 162.1 | 171.5 | -78.4 | -25.5 | 0 | 0 | 111 | Q209 A210 T228 I229 C230 | Q209-Q226 HydrophobicContact CB-CB 4.43Å; Q209-Q226 HydrophobicContact CB-CG 3.88Å; A210-Q226 HydrophobicContact CB-CB 4.45Å; Q226-T228 VanDerWaalsContact C-N 3.26Å; Q226-T228 PolarHBondContact O-N 3.22Å; Q226-I229 PolarHBondContact O-N 3.46Å; Q226-C230 VanDerWaalsContact O-CB 3.25Å; Q226-C230 WeakPolarHBondContact O-CB 2.84Å; Q226-C230 PolarHBondContact O-N 3.07Å |
| 227 | T | 95.6 | Very high | 90.3 | Very high | 69 Ų | 69 | 52.8 Ų | 52.8 | 42% | 0.423 | 29% | 0.287 | S | S | . | . | H | α-helix | trans | -68.5 | -23.5 | -179.7 | -40 | 0 | 0 | 0 | 0 | 113.1 | S225 R231 | S225-T227 PolarHBondContact O-N 2.89Å; S225-T227 VanDerWaalsContact O-N 3.12Å; T227-R231 WeakPolarHBondContact O-CB 3.24Å; T227-R231 WeakPolarHBondContact O-CD 3.38Å; T227-R231 WeakPolarHBondContact O-CG 3.22Å; T227-R231 PolarHBondContact O-N 3.13Å |
| 228 | T | 95.5 | Very high | 90.7 | Very high | 32 Ų | 32 | 56 Ų | 56 | 20% | 0.196 | 31% | 0.31 | C | S | . | . | H | α-helix | trans | -71.7 | -51.1 | 171.4 | -49.9 | 0 | 0 | 0 | 0 | 110 | F224 S225 Q226 R231 F232 L245 | F224-T228 HydrophobicContact CB-CG2 4.48Å; F224-T228 HydrophobicContact CD1-CG2 3.97Å; S225-T228 PolarHBondContact N-OG1 3.09Å; S225-T228 WeakPolarHBondContact O-CA 3.41Å; S225-T228 WeakPolarHBondContact O-CB 3.33Å; S225-T228 PolarHBondContact O-N 3.39Å; S225-T228 PolarHBondContact O-OG1 3.4Å; S225-T228 PolarHBondContact OG-N 2.85Å; S225-T228 PolarHBondContact OG-OG1 3Å; Q226-T228 VanDerWaalsContact C-N 3.26Å; Q226-T228 PolarHBondContact O-N 3.22Å; T228-R231 PolarHBondContact O-N 2.92Å; T228-F232 PolarHBondContact O-N 3.13Å; T228-L245 HydrophobicContact CG2-CD1 4.05Å |
| 229 | I | 95.8 | Very high | 91.3 | Very high | 1 Ų | 1 | 59.3 Ų | 59.3 | 1% | 0.005 | 32% | 0.321 | C | S | . | . | H | α-helix | trans | -62.8 | -45 | 179.3 | -49.7 | -55.7 | 0 | 0 | 0 | 110.2 | F198 Q209 V212 L216 F224 S225 Q226 R231 F232 E233 L249 | F198-I229 HydrophobicContact CE1-CG2 3.84Å; F198-I229 HydrophobicContact CZ-CG2 4.1Å; Q209-I229 HydrophobicContact CB-CB 4.16Å; Q209-I229 HydrophobicContact CB-CG2 4.21Å; Q209-I229 HydrophobicContact CG-CB 4.38Å; Q209-I229 HydrophobicContact CG-CG2 4.06Å; Q209-I229 WeakPolarHBondContact O-CG1 3.42Å; V212-I229 HydrophobicContact CG1-CD1 4.44Å; L216-I229 HydrophobicContact CD1-CD1 4.16Å; F224-I229 HydrophobicContact CB-CD1 4.36Å; S225-I229 PolarHBondContact O-N 3.03Å; S225-I229 VanDerWaalsContact O-N 3.16Å; Q226-I229 PolarHBondContact O-N 3.46Å; I229-R231 VanDerWaalsContact C-N 3.32Å; I229-R231 PolarHBondContact O-N 3.49Å; I229-F232 WeakPolarHBondContact O-CB 3.49Å; I229-F232 PolarHBondContact O-N 2.76Å; I229-F232 VanDerWaalsContact O-N 3.13Å; I229-E233 HydrophobicContact CG2-CG 4.47Å; I229-E233 WeakPolarHBondContact O-CG 3.36Å; I229-E233 PolarHBondContact O-N 2.7Å; I229-L249 HydrophobicContact CD1-CD2 3.89Å |
| 230 | C | 97.3 | Very high | 92.2 | Very high | 48 Ų | 48 | 63.4 Ų | 63.4 | 32% | 0.324 | 34% | 0.336 | S | S | . | . | H | α-helix | trans | -59.7 | -37.7 | 176.9 | -170.1 | 0 | 0 | 0 | 0 | 113.4 | Q226 A234 | Q226-C230 VanDerWaalsContact O-CB 3.25Å; Q226-C230 WeakPolarHBondContact O-CB 2.84Å; Q226-C230 PolarHBondContact O-N 3.07Å; C230-A234 VanDerWaalsContact O-CB 3.27Å; C230-A234 WeakPolarHBondContact O-CB 3.33Å; C230-A234 PolarHBondContact O-N 2.99Å |
| 231 | R | 97.3 | Very high | 92.8 | Very high | 124 Ų | 124 | 63.6 Ų | 63.6 | 47% | 0.468 | 34% | 0.342 | S | S | . | . | H | α-helix | trans | -74.4 | -32.2 | 176.1 | -75.4 | 174.7 | -180 | -139.3 | -2.4 | 112.3 | T227 T228 I229 A234 L235 Q236 L237 | T227-R231 WeakPolarHBondContact O-CB 3.24Å; T227-R231 WeakPolarHBondContact O-CD 3.38Å; T227-R231 WeakPolarHBondContact O-CG 3.22Å; T227-R231 PolarHBondContact O-N 3.13Å; T228-R231 PolarHBondContact O-N 2.92Å; I229-R231 VanDerWaalsContact C-N 3.32Å; I229-R231 PolarHBondContact O-N 3.49Å; R231-A234 PolarHBondContact O-N 2.96Å; R231-L235 PolarHBondContact O-N 3.45Å; R231-L235 VanDerWaalsContact O-N 3.15Å; R231-Q236 HydrophobicContact CB-CB 4.19Å; R231-Q236 HydrophobicContact CG-CB 4.21Å; R231-Q236 PolarHBondContact O-N 3.43Å; R231-L237 HydrophobicContact CB-CD1 4.43Å; R231-L237 HydrophobicContact CB-CD2 3.66Å; R231-L237 HydrophobicContact CB-CG 3.83Å; R231-L237 HydrophobicContact CG-CD2 4.47Å |
| 232 | F | 97.6 | Very high | 93.6 | Very high | 0 Ų | 0 | 61.5 Ų | 61.5 | 0% | 0 | 32% | 0.319 | C | S | . | . | H | α-helix | trans | -65.4 | -50.4 | 172.3 | -172.7 | -84 | 0 | 0 | 0 | 111 | F194 A195 T228 I229 A234 L235 L237 M242 L245 L249 | F194-F232 AromaticContact CD1-CE1 3.65Å; F194-F232 HydrophobicContact CD1-CE1 3.65Å; F194-F232 AromaticContact CD1-CZ 3.58Å; F194-F232 HydrophobicContact CD1-CZ 3.58Å; F194-F232 AromaticContact CE1-CE1 3.53Å; F194-F232 HydrophobicContact CE1-CE1 3.53Å; F194-F232 AromaticContact CE1-CZ 3.54Å; F194-F232 HydrophobicContact CE1-CZ 3.54Å; A195-F232 HydrophobicContact CB-CD1 4.39Å; A195-F232 HydrophobicContact CB-CE1 4.11Å; T228-F232 PolarHBondContact O-N 3.13Å; I229-F232 WeakPolarHBondContact O-CB 3.49Å; I229-F232 PolarHBondContact O-N 2.76Å; I229-F232 VanDerWaalsContact O-N 3.13Å; F232-A234 PolarHBondContact O-N 2.7Å; F232-A234 VanDerWaalsContact O-N 3.11Å; F232-L235 PolarHBondContact O-N 3.13Å; F232-L237 HydrophobicContact CB-CD1 4.11Å; F232-L237 HydrophobicContact CD2-CD1 4.34Å; F232-M242 HydrophobicContact CB-SD 4.47Å; F232-M242 HydrophobicContact CD1-CE 4.21Å; F232-M242 HydrophobicContact CD2-CE 3.53Å; F232-M242 HydrophobicContact CD2-SD 3.44Å; F232-M242 WeakPolarHBondContact CD2-SD 2.77Å; F232-M242 HydrophobicContact CE1-CE 4.09Å; F232-M242 HydrophobicContact CE2-CB 4.45Å; F232-M242 HydrophobicContact CE2-CE 3.4Å; F232-M242 HydrophobicContact CE2-SD 3.78Å; F232-M242 HydrophobicContact CG-CE 3.94Å; F232-M242 HydrophobicContact CG-SD 4.07Å; F232-M242 HydrophobicContact CZ-CE 3.7Å; F232-L245 HydrophobicContact CD2-CB 3.59Å; F232-L245 HydrophobicContact CD2-CD1 3.9Å; F232-L245 HydrophobicContact CD2-CG 4.41Å; F232-L245 HydrophobicContact CE2-CB 3.58Å; F232-L249 HydrophobicContact CB-CD1 4.35Å; F232-L249 HydrophobicContact CD1-CD1 3.43Å; F232-L249 VanDerWaalsContact CD1-CD1 3.43Å; F232-L249 HydrophobicContact CD2-CD1 3.63Å; F232-L249 HydrophobicContact CE1-CD1 3.5Å; F232-L249 VanDerWaalsContact CE1-CD1 3.5Å; F232-L249 HydrophobicContact CE2-CD1 3.68Å; F232-L249 HydrophobicContact CG-CD1 3.51Å; F232-L249 HydrophobicContact CZ-CD1 3.62Å |
| 233 | E | 97.4 | Very high | 94.1 | Very high | 16 Ų | 16 | 57.5 Ų | 57.5 | 8% | 0.075 | 30% | 0.299 | C | S | . | . | H | α-helix | trans | -59.4 | -20.6 | 175.5 | -73.7 | -176.9 | -170.4 | 0 | 0 | 114.5 | F198 K199 R202 Q209 I229 | F198-E233 HydrophobicContact CD1-CG 4.13Å; F198-E233 HydrophobicContact CE1-CG 4.1Å; K199-E233 HydrophobicContact CB-CG 4.01Å; K199-E233 HydrophobicContact CD-CB 4.22Å; K199-E233 HydrophobicContact CD-CG 4.41Å; K199-E233 HydrophobicContact CG-CG 4.17Å; R202-E233 IonicContact CZ-OE1 2.69Å; R202-E233 IonicContact NE-OE1 3.51Å; R202-E233 PolarHBondContact NE-OE1 2.85Å; R202-E233 VanDerWaalsContact NH2-CD 3.34Å; R202-E233 IonicContact NH2-OE1 2.6Å; R202-E233 PolarHBondContact NH2-OE1 3.5Å; R202-E233 IonicContact NH2-OE2 2.81Å; R202-E233 PolarHBondContact NH2-OE2 3.49Å; Q209-E233 PolarHBondContact NE2-OE2 3.39Å; I229-E233 HydrophobicContact CG2-CG 4.47Å; I229-E233 WeakPolarHBondContact O-CG 3.36Å; I229-E233 PolarHBondContact O-N 2.7Å |
| 234 | A | 96.8 | Very high | 94.5 | Very high | 47 Ų | 47 | 62.8 Ų | 62.8 | 39% | 0.388 | 32% | 0.32 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -105.5 | 4.3 | 179.4 | 0 | 0 | 0 | 0 | 0 | 113.5 | C230 R231 F232 Q236 | C230-A234 VanDerWaalsContact O-CB 3.27Å; C230-A234 WeakPolarHBondContact O-CB 3.33Å; C230-A234 PolarHBondContact O-N 2.99Å; R231-A234 PolarHBondContact O-N 2.96Å; F232-A234 PolarHBondContact O-N 2.7Å; F232-A234 VanDerWaalsContact O-N 3.11Å; A234-Q236 HydrophobicContact CB-CG 3.92Å; A234-Q236 WeakPolarHBondContact O-CG 3.24Å; A234-Q236 PolarHBondContact O-N 2.7Å |
| 235 | L | 96.3 | Very high | 94.7 | Very high | 70 Ų | 70 | 61.4 Ų | 61.4 | 37% | 0.366 | 32% | 0.315 | S | S | . | . | T | Hydrogen-bonded Turn | trans | 57.8 | 23.7 | -175.3 | -52.2 | 176.6 | 0 | 0 | 0 | 114.3 | E192 A195 R231 F232 L237 M242 | E192-L235 HydrophobicContact CB-CD1 3.83Å; E192-L235 HydrophobicContact CG-CD1 3.83Å; A195-L235 HydrophobicContact CB-CD2 3.61Å; R231-L235 PolarHBondContact O-N 3.45Å; R231-L235 VanDerWaalsContact O-N 3.15Å; F232-L235 PolarHBondContact O-N 3.13Å; L235-L237 VanDerWaalsContact C-N 3.3Å; L235-L237 PolarHBondContact O-N 3.16Å; L235-M242 HydrophobicContact CD2-CE 3.55Å |
| 236 | Q | 96.1 | Very high | 94.9 | Very high | 132 Ų | 132 | 62.3 Ų | 62.3 | 62% | 0.617 | 32% | 0.316 | S | S | * | . | trans | -92.5 | 32.8 | -177.2 | -65.6 | 178.2 | 6.7 | 0 | 0 | 113.3 | R231 A234 | R231-Q236 HydrophobicContact CB-CB 4.19Å; R231-Q236 HydrophobicContact CG-CB 4.21Å; R231-Q236 PolarHBondContact O-N 3.43Å; A234-Q236 HydrophobicContact CB-CG 3.92Å; A234-Q236 WeakPolarHBondContact O-CG 3.24Å; A234-Q236 PolarHBondContact O-N 2.7Å | ||
| 237 | L | 94 | Very high | 95 | Very high | 36 Ų | 36 | 62.1 Ų | 62.1 | 19% | 0.188 | 32% | 0.322 | C | S | . | . | S | Bend | trans | -123.7 | 153.6 | 172.1 | -58.8 | 175.2 | 0 | 0 | 0 | 108.7 | R231 F232 L235 N241 M242 L245 | R231-L237 HydrophobicContact CB-CD1 4.43Å; R231-L237 HydrophobicContact CB-CD2 3.66Å; R231-L237 HydrophobicContact CB-CG 3.83Å; R231-L237 HydrophobicContact CG-CD2 4.47Å; F232-L237 HydrophobicContact CB-CD1 4.11Å; F232-L237 HydrophobicContact CD2-CD1 4.34Å; L235-L237 VanDerWaalsContact C-N 3.3Å; L235-L237 PolarHBondContact O-N 3.16Å; L237-N241 HydrophobicContact CB-CB 4.16Å; L237-M242 HydrophobicContact CB-CG 4.04Å; L237-M242 HydrophobicContact CB-SD 3.79Å; L237-M242 HydrophobicContact CD1-SD 4.04Å; L237-M242 HydrophobicContact CG-SD 4.26Å; L237-L245 HydrophobicContact CD1-CD1 3.52Å |
| 238 | S | 94.3 | Very high | 94.9 | Very high | 69 Ų | 69 | 60.8 Ų | 60.8 | 48% | 0.483 | 31% | 0.312 | S | S | . | . | trans | -60.3 | 147.1 | 170.9 | 51.9 | 0 | 0 | 0 | 0 | 110.6 | K240 N241 M242 | S238-K240 VanDerWaalsContact C-N 3.27Å; S238-K240 PolarHBondContact O-N 3.04Å; S238-N241 WeakPolarHBondContact O-CA 3.48Å; S238-N241 WeakPolarHBondContact O-CB 3.24Å; S238-N241 PolarHBondContact O-N 3.04Å; S238-N241 PolarHBondContact OG-ND2 3.06Å; S238-M242 PolarHBondContact O-N 3.14Å | ||
| 239 | F | 92 | Very high | 94.8 | Very high | 108 Ų | 108 | 59.3 Ų | 59.3 | 47% | 0.474 | 30% | 0.303 | S | S | . | . | H | α-helix | trans | -46.7 | -49 | 178.9 | -175.5 | -101 | 0 | 0 | 0 | 112.4 | P186 L191 N241 M242 C243 | P186-F239 VanDerWaalsContact O-CZ 3.3Å; P186-F239 WeakPolarHBondContact O-CZ 3.34Å; L191-F239 HydrophobicContact CD1-CD2 3.78Å; L191-F239 HydrophobicContact CD1-CE2 3.6Å; L191-F239 HydrophobicContact CD1-CZ 4.4Å; F239-N241 PolarHBondContact O-N 2.61Å; F239-N241 VanDerWaalsContact O-N 3.09Å; F239-M242 WeakPolarHBondContact O-CA 3.44Å; F239-M242 WeakPolarHBondContact O-CB 3.2Å; F239-M242 PolarHBondContact O-N 3.33Å; F239-C243 VanDerWaalsContact CE1-SG 3.57Å; F239-C243 PolarHBondContact O-N 2.79Å; F239-C243 PolarHBondContact O-SG 2.9Å |
| 240 | K | 92.6 | Very high | 94.7 | Very high | 155 Ų | 155 | 61.9 Ų | 61.9 | 67% | 0.674 | 32% | 0.317 | S | S | * | . | H | α-helix | trans | -60.4 | -20.7 | 176.2 | -167.8 | 162.9 | -170.9 | 160 | 0 | 115.3 | S238 K244 | S238-K240 VanDerWaalsContact C-N 3.27Å; S238-K240 PolarHBondContact O-N 3.04Å; K240-K244 WeakPolarHBondContact O-CD 3.44Å; K240-K244 VanDerWaalsContact O-CG 3.29Å; K240-K244 WeakPolarHBondContact O-CG 3.25Å |
| 241 | N | 93.9 | Very high | 94.4 | Very high | 78 Ų | 78 | 64.9 Ų | 64.9 | 42% | 0.417 | 32% | 0.324 | S | S | . | . | H | α-helix | trans | -89.7 | -33 | 170.3 | -75.3 | -12.3 | 0 | 0 | 0 | 112.1 | L237 S238 F239 K244 L245 | L237-N241 HydrophobicContact CB-CB 4.16Å; S238-N241 WeakPolarHBondContact O-CA 3.48Å; S238-N241 WeakPolarHBondContact O-CB 3.24Å; S238-N241 PolarHBondContact O-N 3.04Å; S238-N241 PolarHBondContact OG-ND2 3.06Å; F239-N241 PolarHBondContact O-N 2.61Å; F239-N241 VanDerWaalsContact O-N 3.09Å; N241-K244 PolarHBondContact O-N 3.38Å; N241-L245 WeakPolarHBondContact O-CG 3.38Å; N241-L245 PolarHBondContact O-N 3.06Å |
| 242 | M | 94.5 | Very high | 94.2 | Very high | 7 Ų | 7 | 59.3 Ų | 59.3 | 3% | 0.034 | 30% | 0.303 | C | S | . | . | H | α-helix | trans | -62.2 | -51.2 | 172.1 | -67.4 | -63.6 | -65.3 | 0 | 0 | 111 | L191 F232 L235 L237 S238 F239 K244 L245 K246 | L191-M242 HydrophobicContact CD1-CB 3.82Å; L191-M242 HydrophobicContact CD2-CB 4.07Å; L191-M242 HydrophobicContact CG-CB 4.5Å; F232-M242 HydrophobicContact CB-SD 4.47Å; F232-M242 HydrophobicContact CD1-CE 4.21Å; F232-M242 HydrophobicContact CD2-CE 3.53Å; F232-M242 HydrophobicContact CD2-SD 3.44Å; F232-M242 WeakPolarHBondContact CD2-SD 2.77Å; F232-M242 HydrophobicContact CE1-CE 4.09Å; F232-M242 HydrophobicContact CE2-CB 4.45Å; F232-M242 HydrophobicContact CE2-CE 3.4Å; F232-M242 HydrophobicContact CE2-SD 3.78Å; F232-M242 HydrophobicContact CG-CE 3.94Å; F232-M242 HydrophobicContact CG-SD 4.07Å; F232-M242 HydrophobicContact CZ-CE 3.7Å; L235-M242 HydrophobicContact CD2-CE 3.55Å; L237-M242 HydrophobicContact CB-CG 4.04Å; L237-M242 HydrophobicContact CB-SD 3.79Å; L237-M242 HydrophobicContact CD1-SD 4.04Å; L237-M242 HydrophobicContact CG-SD 4.26Å; S238-M242 PolarHBondContact O-N 3.14Å; F239-M242 WeakPolarHBondContact O-CA 3.44Å; F239-M242 WeakPolarHBondContact O-CB 3.2Å; F239-M242 PolarHBondContact O-N 3.33Å; M242-K244 PolarHBondContact O-N 2.99Å; M242-L245 PolarHBondContact O-N 2.81Å; M242-K246 PolarHBondContact O-N 3.34Å |
| 243 | C | 93.8 | Very high | 94 | Very high | 35 Ų | 35 | 59.3 Ų | 59.3 | 24% | 0.236 | 30% | 0.303 | C | S | . | . | H | α-helix | trans | -57.5 | -35.7 | 177.1 | -50.3 | 0 | 0 | 0 | 0 | 112.4 | F239 L245 P247 | F239-C243 VanDerWaalsContact CE1-SG 3.57Å; F239-C243 PolarHBondContact O-N 2.79Å; F239-C243 PolarHBondContact O-SG 2.9Å; C243-L245 VanDerWaalsContact C-N 3.32Å; C243-L245 PolarHBondContact O-N 2.89Å; C243-P247 WeakPolarHBondContact O-CD 3.4Å |
| 244 | K | 92.3 | Very high | 93.7 | Very high | 138 Ų | 138 | 63 Ų | 63 | 60% | 0.6 | 32% | 0.32 | S | S | * | . | H | α-helix | trans | -71 | -23 | 176.3 | -77.8 | -177.5 | 175.4 | -162 | 0 | 114.4 | K240 N241 M242 | K240-K244 WeakPolarHBondContact O-CD 3.44Å; K240-K244 VanDerWaalsContact O-CG 3.29Å; K240-K244 WeakPolarHBondContact O-CG 3.25Å; N241-K244 PolarHBondContact O-N 3.38Å; M242-K244 PolarHBondContact O-N 2.99Å |
| 245 | L | 93.8 | Very high | 93.3 | Very high | 17 Ų | 17 | 63.9 Ų | 63.9 | 9% | 0.089 | 32% | 0.317 | C | S | . | . | H | α-helix | trans | -98.1 | -29.1 | -179.5 | -70.8 | 172.8 | 0 | 0 | 0 | 112.4 | F224 T228 F232 L237 N241 M242 C243 L248 L249 | F224-L245 HydrophobicContact CD1-CD2 4.35Å; F224-L245 HydrophobicContact CE1-CD2 3.75Å; F224-L245 HydrophobicContact CE2-CD2 4.47Å; F224-L245 HydrophobicContact CZ-CD2 3.81Å; T228-L245 HydrophobicContact CG2-CD1 4.05Å; F232-L245 HydrophobicContact CD2-CB 3.59Å; F232-L245 HydrophobicContact CD2-CD1 3.9Å; F232-L245 HydrophobicContact CD2-CG 4.41Å; F232-L245 HydrophobicContact CE2-CB 3.58Å; L237-L245 HydrophobicContact CD1-CD1 3.52Å; N241-L245 WeakPolarHBondContact O-CG 3.38Å; N241-L245 PolarHBondContact O-N 3.06Å; M242-L245 PolarHBondContact O-N 2.81Å; C243-L245 VanDerWaalsContact C-N 3.32Å; C243-L245 PolarHBondContact O-N 2.89Å; L245-L248 HydrophobicContact CD2-CD1 4.48Å; L245-L248 PolarHBondContact O-N 3.13Å; L245-L249 HydrophobicContact CB-CD1 3.9Å; L245-L249 WeakPolarHBondContact O-CB 3.45Å; L245-L249 WeakPolarHBondContact O-CG 3.2Å; L245-L249 PolarHBondContact O-N 3.16Å |
| 246 | K | 94.4 | Very high | 92.8 | Very high | 43 Ų | 43 | 60.6 Ų | 60.6 | 19% | 0.187 | 30% | 0.3 | C | S | . | . | H | α-helix | trans | -44.3 | -55.9 | 175.4 | -166.5 | -170.2 | -174.3 | -168.4 | 0 | 112.5 | P186 E190 L191 F194 M242 L248 L249 N250 | P186-K246 HydrophobicContact CB-CD 3.91Å; P186-K246 VanDerWaalsContact CB-NZ 3.28Å; P186-K246 HydrophobicContact CG-CD 3.98Å; E190-K246 IonicContact OE2-NZ 3.79Å; E190-K246 PolarHBondContact OE2-NZ 3.24Å; L191-K246 HydrophobicContact CD2-CB 3.9Å; L191-K246 HydrophobicContact CD2-CD 3.86Å; L191-K246 HydrophobicContact CD2-CG 4.04Å; F194-K246 HydrophobicContact CD1-CG 3.91Å; F194-K246 HydrophobicContact CE1-CG 4.2Å; F194-K246 HydrophobicContact CG-CG 4.11Å; M242-K246 PolarHBondContact O-N 3.34Å; K246-L248 PolarHBondContact O-N 3.32Å; K246-L249 PolarHBondContact O-N 2.78Å; K246-N250 VanDerWaalsContact O-CB 3.25Å; K246-N250 WeakPolarHBondContact O-CB 3.27Å; K246-N250 PolarHBondContact O-N 3.49Å |
| 247 | P | 93.2 | Very high | 92.3 | Very high | 79 Ų | 79 | 57 Ų | 57 | 51% | 0.513 | 28% | 0.284 | S | S | . | . | H | α-helix | trans | -69.3 | -35.4 | -176 | 27.4 | -35.4 | 0 | 0 | 0 | 113.8 | C243 K251 | C243-P247 WeakPolarHBondContact O-CD 3.4Å; P247-K251 PolarHBondContact O-N 3.06Å |
| 248 | L | 93.2 | Very high | 91.8 | Very high | 41 Ų | 41 | 59.7 Ų | 59.7 | 22% | 0.215 | 31% | 0.307 | C | S | . | . | H | α-helix | trans | -68.1 | -43.2 | 178.7 | -57.4 | 179.5 | 0 | 0 | 0 | 111.1 | L216 Y220 F224 L245 K246 W252 | L216-L248 HydrophobicContact CD2-CB 4.44Å; L216-L248 WeakPolarHBondContact CD2-O 3.43Å; Y220-L248 HydrophobicContact CD1-CD2 3.73Å; Y220-L248 HydrophobicContact CD2-CD2 4.17Å; Y220-L248 HydrophobicContact CE1-CD2 3.57Å; Y220-L248 HydrophobicContact CE2-CB 4.26Å; Y220-L248 HydrophobicContact CE2-CD2 4.04Å; Y220-L248 HydrophobicContact CG-CD2 4.01Å; F224-L248 HydrophobicContact CE2-CD1 4.09Å; F224-L248 HydrophobicContact CZ-CD1 3.84Å; L245-L248 HydrophobicContact CD2-CD1 4.48Å; L245-L248 PolarHBondContact O-N 3.13Å; K246-L248 PolarHBondContact O-N 3.32Å; L248-W252 PolarHBondContact O-N 2.82Å |
| 249 | L | 94.6 | Very high | 90.5 | Very high | 1 Ų | 1 | 58 Ų | 58 | 1% | 0.005 | 29% | 0.294 | C | S | . | . | H | α-helix | trans | -71.6 | -36.9 | 177.8 | -67.6 | 167 | 0 | 0 | 0 | 111.5 | F194 F198 V212 L216 I229 F232 L245 K246 L253 | F194-L249 HydrophobicContact CE1-CB 3.95Å; F194-L249 HydrophobicContact CZ-CB 3.87Å; F198-L249 HydrophobicContact CD2-CB 4.03Å; F198-L249 HydrophobicContact CD2-CD2 4.49Å; F198-L249 HydrophobicContact CE1-CD2 4.37Å; F198-L249 HydrophobicContact CE2-CB 3.93Å; F198-L249 HydrophobicContact CE2-CD2 3.66Å; F198-L249 HydrophobicContact CE2-CG 4.33Å; F198-L249 HydrophobicContact CZ-CD2 3.6Å; V212-L249 HydrophobicContact CG1-CD2 4.29Å; L216-L249 HydrophobicContact CD1-CD2 3.73Å; I229-L249 HydrophobicContact CD1-CD2 3.89Å; F232-L249 HydrophobicContact CB-CD1 4.35Å; F232-L249 HydrophobicContact CD1-CD1 3.43Å; F232-L249 VanDerWaalsContact CD1-CD1 3.43Å; F232-L249 HydrophobicContact CD2-CD1 3.63Å; F232-L249 HydrophobicContact CE1-CD1 3.5Å; F232-L249 VanDerWaalsContact CE1-CD1 3.5Å; F232-L249 HydrophobicContact CE2-CD1 3.68Å; F232-L249 HydrophobicContact CG-CD1 3.51Å; F232-L249 HydrophobicContact CZ-CD1 3.62Å; L245-L249 HydrophobicContact CB-CD1 3.9Å; L245-L249 WeakPolarHBondContact O-CB 3.45Å; L245-L249 WeakPolarHBondContact O-CG 3.2Å; L245-L249 PolarHBondContact O-N 3.16Å; K246-L249 PolarHBondContact O-N 2.78Å; L249-L253 WeakPolarHBondContact O-CB 3.45Å; L249-L253 PolarHBondContact O-N 3.46Å |
| 250 | N | 93.8 | Very high | 89 | Confident | 55 Ų | 55 | 57 Ų | 57 | 29% | 0.294 | 30% | 0.298 | S | S | . | . | H | α-helix | trans | -64.6 | -52.1 | 177.1 | -163 | 96.7 | 0 | 0 | 0 | 110.5 | F194 K246 W252 L253 E254 | F194-N250 HydrophobicContact CE2-CB 3.79Å; F194-N250 VanDerWaalsContact CE2-OD1 3.23Å; F194-N250 WeakPolarHBondContact CE2-OD1 3.18Å; F194-N250 HydrophobicContact CZ-CB 3.96Å; K246-N250 VanDerWaalsContact O-CB 3.25Å; K246-N250 WeakPolarHBondContact O-CB 3.27Å; K246-N250 PolarHBondContact O-N 3.49Å; N250-W252 VanDerWaalsContact C-N 3.33Å; N250-W252 PolarHBondContact O-N 3.22Å; N250-L253 WeakPolarHBondContact O-CA 3.38Å; N250-L253 WeakPolarHBondContact O-CB 3.47Å; N250-L253 PolarHBondContact O-N 3.2Å; N250-E254 WeakPolarHBondContact O-CG 3.31Å; N250-E254 PolarHBondContact O-N 2.81Å |
| 251 | K | 91.5 | Very high | 87 | Confident | 112 Ų | 112 | 53.4 Ų | 53.4 | 49% | 0.487 | 30% | 0.304 | S | S | . | . | H | α-helix | trans | -61.3 | -39.6 | -179.9 | 171.8 | 163.8 | 172 | 173.7 | 0 | 112.6 | Y220 P247 L253 E254 E255 | Y220-K251 WeakPolarHBondContact OH-CB 3.34Å; Y220-K251 WeakPolarHBondContact OH-CD 3.26Å; Y220-K251 WeakPolarHBondContact OH-CG 3.45Å; P247-K251 PolarHBondContact O-N 3.06Å; K251-L253 VanDerWaalsContact C-N 3.28Å; K251-L253 PolarHBondContact O-N 3.11Å; K251-E254 PolarHBondContact O-N 3.15Å; K251-E255 WeakPolarHBondContact CE-OE1 3.41Å; K251-E255 IonicContact NZ-OE1 3.67Å; K251-E255 WeakPolarHBondContact O-CG 3.37Å; K251-E255 PolarHBondContact O-N 3.18Å |
| 252 | W | 92 | Very high | 84.8 | Confident | 6 Ų | 6 | 53.1 Ų | 53.1 | 2% | 0.023 | 31% | 0.309 | C | S | . | . | H | α-helix | trans | -61.7 | -37 | 171.6 | 174.2 | 82.9 | 0 | 0 | 0 | 112.4 | F198 R202 F207 V212 L216 L248 N250 E255 A256 | F198-W252 AromaticContact CE2-CE3 3.83Å; F198-W252 HydrophobicContact CE2-CE3 3.83Å; F198-W252 AromaticContact CE2-CZ3 3.89Å; F198-W252 HydrophobicContact CE2-CZ3 3.89Å; F198-W252 HydrophobicContact CZ-CZ3 4.42Å; R202-W252 HydrophobicContact CG-CH2 4.37Å; F207-W252 HydrophobicContact CB-CH2 4.25Å; F207-W252 HydrophobicContact CB-CZ2 4.49Å; F207-W252 HydrophobicContact CD1-CZ2 4.4Å; F207-W252 AromaticContact CD2-CH2 3.64Å; F207-W252 HydrophobicContact CD2-CH2 3.64Å; F207-W252 AromaticContact CD2-CZ2 3.73Å; F207-W252 HydrophobicContact CD2-CZ2 3.73Å; F207-W252 HydrophobicContact CE2-CH2 4.25Å; F207-W252 HydrophobicContact CE2-CZ2 4.03Å; F207-W252 HydrophobicContact CG-CH2 4.03Å; F207-W252 AromaticContact CG-CZ2 3.94Å; F207-W252 HydrophobicContact CG-CZ2 3.94Å; F207-W252 HydrophobicContact CZ-CZ2 4.49Å; V212-W252 HydrophobicContact CB-CH2 4.44Å; V212-W252 HydrophobicContact CB-CZ2 4.36Å; V212-W252 HydrophobicContact CG1-CD2 3.7Å; V212-W252 HydrophobicContact CG1-CE3 3.75Å; V212-W252 HydrophobicContact CG1-CG 4.28Å; V212-W252 HydrophobicContact CG1-CH2 4.33Å; V212-W252 HydrophobicContact CG1-CZ2 4.28Å; V212-W252 HydrophobicContact CG1-CZ3 4.06Å; V212-W252 HydrophobicContact CG2-CE3 4.33Å; V212-W252 HydrophobicContact CG2-CH2 3.42Å; V212-W252 VanDerWaalsContact CG2-CH2 3.42Å; V212-W252 HydrophobicContact CG2-CZ2 3.63Å; V212-W252 HydrophobicContact CG2-CZ3 3.79Å; L216-W252 HydrophobicContact CD2-CB 3.66Å; L216-W252 HydrophobicContact CD2-CG 4.19Å; L216-W252 HydrophobicContact CG-CB 4.46Å; L248-W252 PolarHBondContact O-N 2.82Å; N250-W252 VanDerWaalsContact C-N 3.33Å; N250-W252 PolarHBondContact O-N 3.22Å; W252-E255 PolarHBondContact O-N 3.12Å; W252-A256 HydrophobicContact CH2-CB 4.14Å; W252-A256 HydrophobicContact CZ2-CB 4.02Å; W252-A256 HydrophobicContact CZ3-CB 4.49Å; W252-A256 WeakPolarHBondContact O-CB 3.46Å; W252-A256 PolarHBondContact O-N 3.31Å |
| 253 | L | 92.8 | Very high | 82.4 | Confident | 0 Ų | 0 | 56.9 Ų | 56.9 | 0% | 0 | 34% | 0.336 | C | S | . | . | H | α-helix | trans | -68.6 | -43.9 | 179.3 | -162.3 | 69.5 | 0 | 0 | 0 | 111.8 | F198 R201 L249 N250 K251 E255 A256 D257 | F198-L253 HydrophobicContact CB-CD2 4.39Å; F198-L253 HydrophobicContact CD2-CD1 4.14Å; F198-L253 HydrophobicContact CD2-CD2 4.28Å; R201-L253 HydrophobicContact CB-CD1 3.81Å; R201-L253 HydrophobicContact CB-CD2 4.27Å; R201-L253 HydrophobicContact CB-CG 4.38Å; L249-L253 WeakPolarHBondContact O-CB 3.45Å; L249-L253 PolarHBondContact O-N 3.46Å; N250-L253 WeakPolarHBondContact O-CA 3.38Å; N250-L253 WeakPolarHBondContact O-CB 3.47Å; N250-L253 PolarHBondContact O-N 3.2Å; K251-L253 VanDerWaalsContact C-N 3.28Å; K251-L253 PolarHBondContact O-N 3.11Å; L253-E255 VanDerWaalsContact C-N 3.34Å; L253-E255 PolarHBondContact O-N 3.02Å; L253-A256 PolarHBondContact O-N 3.33Å; L253-D257 WeakPolarHBondContact O-CB 3.47Å; L253-D257 PolarHBondContact O-N 3.1Å |
| 254 | E | 91.1 | Very high | 80.3 | Confident | 94 Ų | 94 | 58.7 Ų | 58.7 | 44% | 0.439 | 35% | 0.349 | S | S | . | . | H | α-helix | trans | -58.4 | -44.2 | 172.8 | -62.9 | -62.6 | 132.6 | 0 | 0 | 111.5 | N250 K251 A256 S258 | N250-E254 WeakPolarHBondContact O-CG 3.31Å; N250-E254 PolarHBondContact O-N 2.81Å; K251-E254 PolarHBondContact O-N 3.15Å; E254-A256 PolarHBondContact O-N 3.35Å; E254-S258 WeakPolarHBondContact O-CB 3.26Å; E254-S258 PolarHBondContact O-N 2.6Å; E254-S258 PolarHBondContact O-OG 3.28Å |
| 255 | E | 88.1 | Confident | 78.2 | Confident | 66 Ų | 66 | 54.3 Ų | 54.3 | 31% | 0.308 | 34% | 0.335 | S | S | . | . | H | α-helix | trans | -64.1 | -37.4 | 176 | -74.5 | 175.7 | -169.7 | 0 | 0 | 112.2 | L219 K251 W252 L253 S259 | L219-E255 VanDerWaalsContact CD1-OE2 3.28Å; L219-E255 WeakPolarHBondContact CD1-OE2 3.43Å; L219-E255 WeakPolarHBondContact CD2-OE2 3.48Å; K251-E255 WeakPolarHBondContact CE-OE1 3.41Å; K251-E255 IonicContact NZ-OE1 3.67Å; K251-E255 WeakPolarHBondContact O-CG 3.37Å; K251-E255 PolarHBondContact O-N 3.18Å; W252-E255 PolarHBondContact O-N 3.12Å; L253-E255 VanDerWaalsContact C-N 3.34Å; L253-E255 PolarHBondContact O-N 3.02Å; E255-S259 WeakPolarHBondContact O-CB 3.26Å; E255-S259 PolarHBondContact O-N 3.17Å; E255-S259 PolarHBondContact O-OG 3.3Å |
| 256 | A | 87.3 | Confident | 76.4 | Confident | 1 Ų | 1 | 54.8 Ų | 54.8 | 1% | 0.008 | 34% | 0.337 | C | S | . | . | H | α-helix | trans | -75.6 | -45.3 | 179.4 | 0 | 0 | 0 | 0 | 0 | 113.1 | L205 F207 W252 L253 E254 S258 S259 T260 I266 | L205-A256 HydrophobicContact CD1-CB 3.8Å; F207-A256 HydrophobicContact CE2-CB 4.23Å; W252-A256 HydrophobicContact CH2-CB 4.14Å; W252-A256 HydrophobicContact CZ2-CB 4.02Å; W252-A256 HydrophobicContact CZ3-CB 4.49Å; W252-A256 WeakPolarHBondContact O-CB 3.46Å; W252-A256 PolarHBondContact O-N 3.31Å; L253-A256 PolarHBondContact O-N 3.33Å; E254-A256 PolarHBondContact O-N 3.35Å; A256-S258 VanDerWaalsContact C-N 3.32Å; A256-S258 PolarHBondContact O-N 2.8Å; A256-S259 PolarHBondContact O-N 3.47Å; A256-T260 PolarHBondContact O-N 3.2Å; A256-T260 PolarHBondContact O-OG1 3.08Å; A256-I266 HydrophobicContact CB-CD1 3.91Å |
| 257 | D | 84.9 | Confident | 74.4 | Confident | 55 Ų | 55 | 57.9 Ų | 57.9 | 29% | 0.294 | 36% | 0.356 | S | S | . | . | H | α-helix | trans | -59.3 | -44.6 | 173.3 | -78.3 | -39.3 | 0 | 0 | 0 | 109.8 | R201 L253 T260 | R201-D257 WeakPolarHBondContact CD-OD2 3.49Å; R201-D257 IonicContact CZ-OD2 2.82Å; R201-D257 IonicContact NE-OD2 2.67Å; R201-D257 IonicContact NH1-OD2 3.53Å; R201-D257 PolarHBondContact NH1-OD2 2.79Å; L253-D257 WeakPolarHBondContact O-CB 3.47Å; L253-D257 PolarHBondContact O-N 3.1Å; D257-T260 WeakPolarHBondContact O-CB 3.4Å; D257-T260 PolarHBondContact O-N 3.48Å |
| 258 | S | 83 | Confident | 72.5 | Confident | 94 Ų | 94 | 60.6 Ų | 60.6 | 66% | 0.657 | 36% | 0.36 | S | S | * | . | H | α-helix | trans | -64.5 | -41.2 | 176 | -59 | 0 | 0 | 0 | 0 | 113.3 | E254 A256 T260 | E254-S258 WeakPolarHBondContact O-CB 3.26Å; E254-S258 PolarHBondContact O-N 2.6Å; E254-S258 PolarHBondContact O-OG 3.28Å; A256-S258 VanDerWaalsContact C-N 3.32Å; A256-S258 PolarHBondContact O-N 2.8Å; S258-T260 PolarHBondContact O-N 2.96Å |
| 259 | S | 68.4 | Low | 70.7 | Confident | 32 Ų | 32 | 61.5 Ų | 61.5 | 22% | 0.224 | 36% | 0.364 | C | S | . | . | H | α-helix | trans | -69.8 | -15.3 | -179.8 | -62.7 | 0 | 0 | 0 | 0 | 113.4 | E255 A256 G261 S262 | E255-S259 WeakPolarHBondContact O-CB 3.26Å; E255-S259 PolarHBondContact O-N 3.17Å; E255-S259 PolarHBondContact O-OG 3.3Å; A256-S259 PolarHBondContact O-N 3.47Å; S259-G261 PolarHBondContact O-N 2.74Å; S259-G261 VanDerWaalsContact O-N 3.12Å; S259-S262 CarbonylContact O-C 3.24Å; S259-S262 VanDerWaalsContact O-C 3.24Å; S259-S262 PolarHBondContact O-N 3.34Å; S259-S262 VanDerWaalsContact O-O 3.1Å |
| 260 | T | 58.8 | Low | 68.8 | Low | 89 Ų | 89 | 63 Ų | 63 | 55% | 0.546 | 38% | 0.377 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -64.7 | -17.7 | -177.8 | -61.4 | 0 | 0 | 0 | 0 | 112.9 | L205 A256 D257 S258 S262 | L205-T260 HydrophobicContact CD2-CG2 4.09Å; L205-T260 VanDerWaalsContact CD2-OG1 3.24Å; L205-T260 WeakPolarHBondContact CD2-OG1 3.44Å; A256-T260 PolarHBondContact O-N 3.2Å; A256-T260 PolarHBondContact O-OG1 3.08Å; D257-T260 WeakPolarHBondContact O-CB 3.4Å; D257-T260 PolarHBondContact O-N 3.48Å; S258-T260 PolarHBondContact O-N 2.96Å; T260-S262 VanDerWaalsContact C-N 3.33Å |
| 261 | G | 51.6 | Low | 66.8 | Low | 79 Ų | 79 | 64.2 Ų | 64.2 | 81% | 0.814 | 40% | 0.395 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -72.6 | -16.7 | 168.9 | 0 | 0 | 0 | 0 | 0 | 115.1 | S259 | S259-G261 PolarHBondContact O-N 2.74Å; S259-G261 VanDerWaalsContact O-N 3.12Å |
| 262 | S | 46.8 | Very low | 65 | Low | 72 Ų | 72 | 65.5 Ų | 65.5 | 50% | 0.503 | 40% | 0.402 | S | S | . | . | trans | -149 | 95.9 | 174.5 | 64.6 | 0 | 0 | 0 | 0 | 111.9 | S259 T260 S264 S265 | S259-S262 CarbonylContact O-C 3.24Å; S259-S262 VanDerWaalsContact O-C 3.24Å; S259-S262 PolarHBondContact O-N 3.34Å; S259-S262 VanDerWaalsContact O-O 3.1Å; T260-S262 VanDerWaalsContact C-N 3.33Å; S262-S264 PolarHBondContact O-N 3.45Å; S262-S265 PolarHBondContact O-OG 3.18Å | ||
| 263 | S | 44.5 | Very low | 63.2 | Low | 86 Ų | 86 | 67.7 Ų | 67.7 | 60% | 0.601 | 43% | 0.427 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -55.3 | -22.9 | -172.7 | 51.6 | 0 | 0 | 0 | 0 | 115.8 | S265 | S263-S265 PolarHBondContact O-N 3.37Å; S263-S265 VanDerWaalsContact O-N 3.08Å |
| 264 | S | 49.2 | Very low | 61.4 | Low | 73 Ų | 73 | 74.1 Ų | 74.1 | 51% | 0.51 | 45% | 0.451 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -72.8 | -1 | -168.6 | 70.7 | 0 | 0 | 0 | 0 | 116.4 | S262 K268 | S262-S264 PolarHBondContact O-N 3.45Å; S264-K268 WeakPolarHBondContact O-CD 3.31Å; S264-K268 WeakPolarHBondContact O-CE 3.23Å; S264-K268 PolarHBondContact O-NZ 3.11Å |
| 265 | S | 49.3 | Very low | 59.9 | Low | 45 Ų | 45 | 79.8 Ų | 79.8 | 32% | 0.315 | 47% | 0.474 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -94.1 | -46.8 | -179.9 | 56.6 | 0 | 0 | 0 | 0 | 113.1 | S262 S263 | S262-S265 PolarHBondContact O-OG 3.18Å; S263-S265 PolarHBondContact O-N 3.37Å; S263-S265 VanDerWaalsContact O-N 3.08Å |
| 266 | I | 54.8 | Low | 58.5 | Low | 27 Ų | 27 | 83.3 Ų | 83.3 | 14% | 0.138 | 49% | 0.485 | C | S | . | . | H | α-helix | trans | -84.2 | -32.6 | -161.1 | -154.8 | 153.2 | 0 | 0 | 0 | 113.5 | F207 A256 K268 I269 A270 | F207-I266 HydrophobicContact CE1-CD1 4.49Å; F207-I266 HydrophobicContact CE1-CG1 4.26Å; F207-I266 HydrophobicContact CE1-CG2 4.49Å; F207-I266 HydrophobicContact CE2-CD1 4.13Å; F207-I266 HydrophobicContact CZ-CB 4.45Å; F207-I266 HydrophobicContact CZ-CD1 3.58Å; F207-I266 HydrophobicContact CZ-CG1 3.75Å; F207-I266 HydrophobicContact CZ-CG2 3.89Å; A256-I266 HydrophobicContact CB-CD1 3.91Å; I266-K268 PolarHBondContact O-N 3.22Å; I266-I269 WeakPolarHBondContact O-CB 3.11Å; I266-I269 PolarHBondContact O-N 2.81Å; I266-A270 PolarHBondContact O-N 2.69Å |
| 267 | D | 53.6 | Low | 57.4 | Low | 109 Ų | 109 | 92.4 Ų | 92.4 | 58% | 0.583 | 52% | 0.524 | S | S | * | . | H | α-helix | trans | -55.8 | -36.9 | 172.8 | -68.5 | -38.2 | 0 | 0 | 0 | 112 | I269 A270 A271 | D267-I269 VanDerWaalsContact C-N 3.29Å; D267-I269 PolarHBondContact O-N 3.05Å; D267-A270 PolarHBondContact O-N 3.09Å; D267-A271 WeakPolarHBondContact O-CB 3.38Å; D267-A271 PolarHBondContact O-N 3.06Å |
| 268 | K | 52.4 | Low | 56.5 | Low | 136 Ų | 136 | 99 Ų | 99 | 59% | 0.591 | 55% | 0.55 | S | S | * | * | H | α-helix | trans | -68.5 | -28.6 | 179.8 | -62.4 | 172.2 | -178.1 | 152.6 | 0 | 112.2 | S264 I266 | S264-K268 WeakPolarHBondContact O-CD 3.31Å; S264-K268 WeakPolarHBondContact O-CE 3.23Å; S264-K268 PolarHBondContact O-NZ 3.11Å; I266-K268 PolarHBondContact O-N 3.22Å |
| 269 | I | 55.7 | Low | 56.2 | Low | 59 Ų | 59 | 105 Ų | 105 | 30% | 0.303 | 56% | 0.559 | S | S | . | * | H | α-helix | trans | -77.8 | -40.9 | 177.9 | -60.6 | 174.7 | 0 | 0 | 0 | 110.1 | A215 T218 I266 D267 Q272 | A215-I269 HydrophobicContact CB-CG2 4.2Å; T218-I269 HydrophobicContact CG2-CG2 4.11Å; I266-I269 WeakPolarHBondContact O-CB 3.11Å; I266-I269 PolarHBondContact O-N 2.81Å; D267-I269 VanDerWaalsContact C-N 3.29Å; D267-I269 PolarHBondContact O-N 3.05Å; I269-Q272 PolarHBondContact O-N 3.45Å |
| 270 | A | 54.5 | Low | 56.9 | Low | 33 Ų | 33 | 107 Ų | 107 | 27% | 0.273 | 57% | 0.569 | S | S | . | * | H | α-helix | trans | -65 | -37.3 | 174.7 | 0 | 0 | 0 | 0 | 0 | 112.4 | I266 D267 Q272 | I266-A270 PolarHBondContact O-N 2.69Å; D267-A270 PolarHBondContact O-N 3.09Å; A270-Q272 VanDerWaalsContact C-N 3.32Å; A270-Q272 PolarHBondContact O-N 3.37Å |
| 271 | A | 52.7 | Low | 58 | Low | 81 Ų | 81 | 107.9 Ų | 107.9 | 67% | 0.669 | 58% | 0.58 | S | S | * | * | H | α-helix | trans | -69.2 | -21.1 | -179.6 | 0 | 0 | 0 | 0 | 0 | 114.8 | D267 G273 | D267-A271 WeakPolarHBondContact O-CB 3.38Å; D267-A271 PolarHBondContact O-N 3.06Å; A271-G273 VanDerWaalsContact C-N 3.26Å; A271-G273 PolarHBondContact O-N 3.03Å |
| 272 | Q | 52.7 | Low | 59.7 | Low | 138 Ų | 138 | 106.3 Ų | 106.3 | 65% | 0.645 | 55% | 0.552 | S | S | * | * | trans | -80.2 | 68.6 | -179.5 | -75.3 | -167.5 | -7.2 | 0 | 0 | 112.7 | I269 A270 R274 | I269-Q272 PolarHBondContact O-N 3.45Å; A270-Q272 VanDerWaalsContact C-N 3.32Å; A270-Q272 PolarHBondContact O-N 3.37Å; Q272-R274 PolarHBondContact O-N 3.48Å | ||
| 273 | G | 54.7 | Low | 61.8 | Low | 53 Ų | 53 | 109.2 Ų | 109.2 | 55% | 0.546 | 56% | 0.558 | S | S | . | * | trans | -64.7 | 76.7 | -175.2 | 0 | 0 | 0 | 0 | 0 | 116 | A271 K275 | A271-G273 VanDerWaalsContact C-N 3.26Å; A271-G273 PolarHBondContact O-N 3.03Å; G273-K275 PolarHBondContact O-N 2.93Å; G273-K275 VanDerWaalsContact O-N 3.1Å | ||
| 274 | R | 55.7 | Low | 64 | Low | 135 Ų | 135 | 111.3 Ų | 111.3 | 51% | 0.509 | 57% | 0.566 | S | S | . | * | trans | -64.8 | 106.6 | 166.9 | -64.6 | -154 | -74.1 | -141.2 | 3.8 | 109.8 | G217 T218 Q272 R276 | G217-R274 PolarHBondContact O-NH2 2.93Å; T218-R274 PolarHBondContact O-NH2 2.97Å; Q272-R274 PolarHBondContact O-N 3.48Å; R274-R276 PolarHBondContact O-N 3.19Å | ||
| 275 | K | 59.8 | Low | 65.9 | Low | 212 Ų | 212 | 111.2 Ų | 111.2 | 92% | 0.922 | 57% | 0.566 | S | S | * | * | trans | -60.5 | 109.6 | -177.6 | -77.5 | 178.6 | 177 | 171.7 | 0 | 111.8 | G273 | G273-K275 PolarHBondContact O-N 2.93Å; G273-K275 VanDerWaalsContact O-N 3.1Å | ||
| 276 | R | 57.9 | Low | 68 | Low | 141 Ų | 141 | 110.2 Ų | 110.2 | 53% | 0.532 | 56% | 0.558 | S | S | . | * | P | Polyproline II helix | trans | -57 | 137.3 | 173.5 | -174.6 | 176.3 | -177.6 | -113 | -0.6 | 111.7 | V223 R274 K278 | V223-R276 HydrophobicContact CB-CB 4.04Å; V223-R276 HydrophobicContact CB-CG 4.13Å; V223-R276 HydrophobicContact CG1-CB 4.05Å; V223-R276 HydrophobicContact CG1-CG 4.31Å; V223-R276 WeakPolarHBondContact O-CD 3.43Å; V223-R276 PolarHBondContact O-NE 2.8Å; R274-R276 PolarHBondContact O-N 3.19Å; R276-K278 PolarHBondContact O-N 3.44Å; R276-K278 VanDerWaalsContact O-N 3.14Å |
| 277 | K | 63.3 | Low | 69.8 | Low | 191 Ų | 191 | 112.9 Ų | 112.9 | 83% | 0.83 | 57% | 0.568 | S | S | * | * | P | Polyproline II helix | trans | -56.1 | 118.7 | 175.5 | -171.7 | 169.6 | -178.6 | 175.9 | 0 | 109.9 | ||
| 278 | K | 66.4 | Low | 71.7 | Confident | 193 Ų | 193 | 109 Ų | 109 | 84% | 0.839 | 56% | 0.555 | S | S | * | * | P | Polyproline II helix | trans | -68.1 | 138.3 | -178.8 | -166 | 173.5 | -178 | -179.4 | 0 | 109.4 | R276 | R276-K278 PolarHBondContact O-N 3.44Å; R276-K278 VanDerWaalsContact O-N 3.14Å |
| 279 | R | 77.1 | Confident | 73.7 | Confident | 221 Ų | 221 | 106 Ų | 106 | 83% | 0.834 | 55% | 0.548 | S | S | * | . | P | Polyproline II helix | trans | -72.2 | 131.8 | 173.8 | -171.5 | -174.2 | -170.7 | -179.2 | 4.7 | 109.1 | S281 | R279-S281 PolarHBondContact O-N 3.09Š|
| 280 | T | 82.5 | Confident | 75.6 | Confident | 73 Ų | 73 | 103.2 Ų | 103.2 | 45% | 0.448 | 53% | 0.533 | S | S | . | . | P | Polyproline II helix | trans | -58.9 | 122.4 | 169.5 | -41.4 | 0 | 0 | 0 | 0 | 109.3 | V318 | T280-V318 HydrophobicContact CG2-CG1 4.21Å; T280-V318 HydrophobicContact CG2-CG2 4.11Å |
| 281 | S | 83.4 | Confident | 77.6 | Confident | 109 Ų | 109 | 104.5 Ų | 104.5 | 76% | 0.762 | 53% | 0.533 | S | S | * | . | P | Polyproline II helix | trans | -87.2 | 135 | 167.7 | -164.6 | 0 | 0 | 0 | 0 | 107.9 | R279 | R279-S281 PolarHBondContact O-N 3.09Š|
| 282 | I | 86 | Confident | 79.6 | Confident | 46 Ų | 46 | 104.6 Ų | 104.6 | 24% | 0.236 | 53% | 0.526 | C | S | . | . | trans | -104.5 | 127.4 | 174.7 | -60.8 | 167.1 | 0 | 0 | 0 | 106.4 | V286 K287 L290 L314 V318 W322 | I282-V286 HydrophobicContact CG2-CB 3.99Å; I282-V286 HydrophobicContact CG2-CG1 3.76Å; I282-K287 HydrophobicContact CG2-CB 4.35Å; I282-L290 HydrophobicContact CG2-CD1 4.26Å; I282-L314 HydrophobicContact CG1-CD1 4.42Å; I282-L314 HydrophobicContact CG2-CD1 4.47Å; I282-V318 HydrophobicContact CD1-CG1 3.74Å; I282-V318 HydrophobicContact CG1-CG1 3.98Å; I282-W322 HydrophobicContact CD1-CB 4.35Å; I282-W322 HydrophobicContact CD1-CG 4.28Å | ||
| 283 | E | 90.6 | Very high | 81.6 | Confident | 133 Ų | 133 | 100.4 Ų | 100.4 | 62% | 0.621 | 51% | 0.506 | S | S | * | . | trans | -66.3 | 158.6 | -179 | -61.1 | -168.1 | 167.8 | 0 | 0 | 112.5 | S285 V286 K287 | E283-S285 VanDerWaalsContact C-N 3.3Å; E283-S285 VanDerWaalsContact CB-OG 3.3Å; E283-S285 WeakPolarHBondContact CB-OG 3.39Å; E283-S285 PolarHBondContact O-N 3.19Å; E283-S285 PolarHBondContact OE2-OG 3.2Å; E283-V286 HydrophobicContact CB-CB 4.44Å; E283-V286 HydrophobicContact CB-CG2 4.23Å; E283-V286 PolarHBondContact O-N 2.6Å; E283-K287 VanDerWaalsContact O-CB 3.22Å; E283-K287 WeakPolarHBondContact O-CB 3.38Å; E283-K287 PolarHBondContact O-N 3.12Å | ||
| 284 | V | 90.8 | Very high | 83.5 | Confident | 129 Ų | 129 | 98 Ų | 98 | 78% | 0.782 | 48% | 0.481 | S | S | * | . | H | α-helix | trans | -64.2 | -38 | -179.6 | -175.7 | 0 | 0 | 0 | 0 | 111.3 | G288 | V284-G288 PolarHBondContact O-N 3.27Å |
| 285 | S | 89.8 | Confident | 85.3 | Confident | 72 Ų | 72 | 98.3 Ų | 98.3 | 50% | 0.503 | 49% | 0.492 | S | S | . | . | H | α-helix | trans | -53.7 | -61 | 170.5 | 46.1 | 0 | 0 | 0 | 0 | 111.8 | E283 K287 G288 V289 | E283-S285 VanDerWaalsContact C-N 3.3Å; E283-S285 VanDerWaalsContact CB-OG 3.3Å; E283-S285 WeakPolarHBondContact CB-OG 3.39Å; E283-S285 PolarHBondContact O-N 3.19Å; E283-S285 PolarHBondContact OE2-OG 3.2Å; S285-K287 VanDerWaalsContact C-N 3.33Å; S285-K287 PolarHBondContact O-N 2.91Å; S285-G288 WeakPolarHBondContact O-CA 3.29Å; S285-G288 PolarHBondContact O-N 3.01Å; S285-V289 PolarHBondContact O-N 3.4Å |
| 286 | V | 93.3 | Very high | 87 | Confident | 24 Ų | 24 | 96.5 Ų | 96.5 | 15% | 0.145 | 48% | 0.484 | C | S | . | . | H | α-helix | trans | -60.8 | -40.8 | -179.3 | 177.9 | 0 | 0 | 0 | 0 | 111.5 | I282 E283 G288 V289 L290 L312 L314 | I282-V286 HydrophobicContact CG2-CB 3.99Å; I282-V286 HydrophobicContact CG2-CG1 3.76Å; E283-V286 HydrophobicContact CB-CB 4.44Å; E283-V286 HydrophobicContact CB-CG2 4.23Å; E283-V286 PolarHBondContact O-N 2.6Å; V286-G288 VanDerWaalsContact C-N 3.3Å; V286-G288 PolarHBondContact O-N 3.19Å; V286-V289 PolarHBondContact O-N 3.41Å; V286-L290 HydrophobicContact CG1-CD1 4.15Å; V286-L290 WeakPolarHBondContact O-CG 3.48Å; V286-L290 PolarHBondContact O-N 3.38Å; V286-L312 HydrophobicContact CG1-CB 4.05Å; V286-L312 HydrophobicContact CG1-CD1 4.07Å; V286-L312 HydrophobicContact CG1-CD2 4.24Å; V286-L312 HydrophobicContact CG1-CG 4.35Å; V286-L314 HydrophobicContact CG1-CD1 3.71Å; V286-L314 HydrophobicContact CG1-CG 4.3Å |
| 287 | K | 93.3 | Very high | 88.5 | Confident | 82 Ų | 82 | 91.3 Ų | 91.3 | 36% | 0.357 | 47% | 0.469 | S | S | . | . | H | α-helix | trans | -59.7 | -39.1 | 173.4 | 177.6 | -176.2 | 169.7 | -69.7 | 0 | 111.9 | I282 E283 S285 L290 E291 | I282-K287 HydrophobicContact CG2-CB 4.35Å; E283-K287 VanDerWaalsContact O-CB 3.22Å; E283-K287 WeakPolarHBondContact O-CB 3.38Å; E283-K287 PolarHBondContact O-N 3.12Å; S285-K287 VanDerWaalsContact C-N 3.33Å; S285-K287 PolarHBondContact O-N 2.91Å; K287-L290 PolarHBondContact O-N 3.03Å; K287-E291 VanDerWaalsContact CE-OE1 3.27Å; K287-E291 WeakPolarHBondContact CE-OE1 3.41Å; K287-E291 IonicContact NZ-OE1 2.82Å; K287-E291 PolarHBondContact NZ-OE1 3.5Å; K287-E291 IonicContact NZ-OE2 2.62Å; K287-E291 PolarHBondContact NZ-OE2 3.19Å; K287-E291 WeakPolarHBondContact O-CG 3.38Å; K287-E291 PolarHBondContact O-N 2.77Å |
| 288 | G | 93.6 | Very high | 89.8 | Confident | 29 Ų | 29 | 84.9 Ų | 84.9 | 30% | 0.299 | 45% | 0.447 | S | S | . | . | H | α-helix | trans | -60.4 | -47.2 | 176.1 | 0 | 0 | 0 | 0 | 0 | 112.3 | V284 S285 V286 L290 E291 T292 | V284-G288 PolarHBondContact O-N 3.27Å; S285-G288 WeakPolarHBondContact O-CA 3.29Å; S285-G288 PolarHBondContact O-N 3.01Å; V286-G288 VanDerWaalsContact C-N 3.3Å; V286-G288 PolarHBondContact O-N 3.19Å; G288-L290 PolarHBondContact O-N 3.21Å; G288-E291 PolarHBondContact O-N 3.44Å; G288-T292 PolarHBondContact O-N 2.83Å; G288-T292 PolarHBondContact O-OG1 3.41Å; G288-T292 VanDerWaalsContact O-OG1 3.05Å |
| 289 | V | 94.3 | Very high | 91.1 | Very high | 73 Ų | 73 | 83.6 Ų | 83.6 | 44% | 0.442 | 44% | 0.441 | S | S | . | . | H | α-helix | trans | -61.9 | -43.4 | 176.7 | -175.1 | 0 | 0 | 0 | 0 | 111.4 | S285 V286 E291 T292 H293 L312 | S285-V289 PolarHBondContact O-N 3.4Å; V286-V289 PolarHBondContact O-N 3.41Å; V289-E291 VanDerWaalsContact C-N 3.35Å; V289-E291 PolarHBondContact O-N 3.42Å; V289-T292 PolarHBondContact O-N 3.43Å; V289-H293 PolarHBondContact O-N 2.89Å; V289-L312 HydrophobicContact CB-CD2 4.08Å; V289-L312 HydrophobicContact CG1-CD2 4.04Å; V289-L312 HydrophobicContact CG2-CD2 4.36Å |
| 290 | L | 95.7 | Very high | 91.9 | Very high | 0 Ų | 0 | 73.7 Ų | 73.7 | 0% | 0 | 41% | 0.405 | C | S | . | . | H | α-helix | trans | -62.3 | -38.8 | 176.1 | -70.7 | 169.1 | 0 | 0 | 0 | 112.3 | I282 V286 K287 G288 H293 F294 L312 L314 V319 W322 F323 | I282-L290 HydrophobicContact CG2-CD1 4.26Å; V286-L290 HydrophobicContact CG1-CD1 4.15Å; V286-L290 WeakPolarHBondContact O-CG 3.48Å; V286-L290 PolarHBondContact O-N 3.38Å; K287-L290 PolarHBondContact O-N 3.03Å; G288-L290 PolarHBondContact O-N 3.21Å; L290-H293 PolarHBondContact O-N 3.03Å; L290-F294 VanDerWaalsContact O-CB 3.29Å; L290-F294 WeakPolarHBondContact O-CB 3.4Å; L290-F294 PolarHBondContact O-N 3.44Å; L290-L312 HydrophobicContact CD1-CD1 4.43Å; L290-L312 HydrophobicContact CD2-CD1 3.63Å; L290-L312 HydrophobicContact CG-CD1 3.78Å; L290-L314 HydrophobicContact CD1-CD1 4.42Å; L290-V319 HydrophobicContact CD2-CG1 4.11Å; L290-W322 VanDerWaalsContact C-CH2 3.45Å; L290-W322 HydrophobicContact CB-CD2 4.02Å; L290-W322 HydrophobicContact CB-CE3 3.89Å; L290-W322 HydrophobicContact CB-CH2 3.7Å; L290-W322 HydrophobicContact CB-CZ2 3.8Å; L290-W322 HydrophobicContact CB-CZ3 3.74Å; L290-W322 HydrophobicContact CD1-CD2 3.96Å; L290-W322 HydrophobicContact CD1-CE3 4.4Å; L290-W322 HydrophobicContact CD1-CG 4.03Å; L290-W322 HydrophobicContact CD2-CE3 4.37Å; L290-W322 HydrophobicContact CG-CD2 4.46Å; L290-W322 HydrophobicContact CG-CE3 4.46Å; L290-W322 WeakPolarHBondContact O-CH2 3.25Å; L290-W322 WeakPolarHBondContact O-CZ3 3.26Å; L290-F323 HydrophobicContact CD2-CE2 3.79Å; L290-F323 HydrophobicContact CD2-CZ 4.39Å |
| 291 | E | 95.3 | Very high | 92.6 | Very high | 59 Ų | 59 | 72.6 Ų | 72.6 | 28% | 0.276 | 40% | 0.4 | S | S | . | . | H | α-helix | trans | -69.6 | -37.8 | 174.9 | -72.5 | 176.3 | 155.7 | 0 | 0 | 112.3 | K287 G288 V289 F294 L295 W322 | K287-E291 VanDerWaalsContact CE-OE1 3.27Å; K287-E291 WeakPolarHBondContact CE-OE1 3.41Å; K287-E291 IonicContact NZ-OE1 2.82Å; K287-E291 PolarHBondContact NZ-OE1 3.5Å; K287-E291 IonicContact NZ-OE2 2.62Å; K287-E291 PolarHBondContact NZ-OE2 3.19Å; K287-E291 WeakPolarHBondContact O-CG 3.38Å; K287-E291 PolarHBondContact O-N 2.77Å; G288-E291 PolarHBondContact O-N 3.44Å; V289-E291 VanDerWaalsContact C-N 3.35Å; V289-E291 PolarHBondContact O-N 3.42Å; E291-F294 PolarHBondContact O-N 3Å; E291-L295 WeakPolarHBondContact O-CG 3.46Å; E291-L295 PolarHBondContact O-N 2.98Å; E291-W322 HydrophobicContact CG-CH2 3.75Å; E291-W322 HydrophobicContact CG-CZ2 3.59Å |
| 292 | T | 95.1 | Very high | 93.2 | Very high | 84 Ų | 84 | 70.8 Ų | 70.8 | 52% | 0.515 | 39% | 0.392 | S | S | . | . | H | α-helix | trans | -63.4 | -40.4 | 172.4 | -55.8 | 0 | 0 | 0 | 0 | 112.4 | G288 V289 | G288-T292 PolarHBondContact O-N 2.83Å; G288-T292 PolarHBondContact O-OG1 3.41Å; G288-T292 VanDerWaalsContact O-OG1 3.05Å; V289-T292 PolarHBondContact O-N 3.43Å |
| 293 | H | 94.6 | Very high | 93.7 | Very high | 49 Ų | 49 | 76.1 Ų | 76.1 | 23% | 0.227 | 42% | 0.416 | C | S | . | . | H | α-helix | trans | -70 | -38.6 | 175.3 | -163.2 | -68.6 | 0 | 0 | 0 | 111.9 | V289 L290 L295 K296 C297 E304 F323 | V289-H293 PolarHBondContact O-N 2.89Å; L290-H293 PolarHBondContact O-N 3.03Å; H293-L295 VanDerWaalsContact C-N 3.29Å; H293-L295 PolarHBondContact O-N 3.26Å; H293-K296 PolarHBondContact O-N 3.36Å; H293-C297 PolarHBondContact O-N 2.87Å; H293-E304 IonicContact CE1-OE1 3.61Å; H293-F323 HydrophobicContact CB-CZ 4.31Å |
| 294 | F | 95.6 | Very high | 93.9 | Very high | 3 Ų | 3 | 72.8 Ų | 72.8 | 1% | 0.013 | 40% | 0.401 | C | S | . | . | H | α-helix | trans | -58.6 | -39.2 | 178.5 | -177.2 | -83.9 | 0 | 0 | 0 | 112.7 | L290 E291 K296 C297 P298 W322 F323 R326 R327 E330 | L290-F294 VanDerWaalsContact O-CB 3.29Å; L290-F294 WeakPolarHBondContact O-CB 3.4Å; L290-F294 PolarHBondContact O-N 3.44Å; E291-F294 PolarHBondContact O-N 3Å; F294-K296 PolarHBondContact O-N 2.93Å; F294-C297 CarbonylContact O-C 3.33Å; F294-C297 PolarHBondContact O-N 3.09Å; F294-P298 HydrophobicContact CE1-CB 4.26Å; F294-P298 HydrophobicContact CE2-CB 4.01Å; F294-P298 HydrophobicContact CZ-CB 3.86Å; F294-P298 WeakPolarHBondContact O-CD 3.46Å; F294-P298 WeakPolarHBondContact O-CG 3.35Å; F294-W322 HydrophobicContact CB-CH2 4.11Å; F294-W322 HydrophobicContact CB-CZ3 4.09Å; F294-W322 HydrophobicContact CD2-CZ3 4.21Å; F294-W322 HydrophobicContact CG-CZ3 4.48Å; F294-F323 HydrophobicContact CB-CE1 4.04Å; F294-F323 AromaticContact CD2-CD1 3.77Å; F294-F323 HydrophobicContact CD2-CD1 3.77Å; F294-F323 AromaticContact CD2-CE1 4Å; F294-F323 HydrophobicContact CD2-CE1 4Å; F294-R326 HydrophobicContact CD1-CG 4.02Å; F294-R326 HydrophobicContact CD2-CB 4.03Å; F294-R326 HydrophobicContact CD2-CG 3.46Å; F294-R326 VanDerWaalsContact CD2-CG 3.46Å; F294-R326 HydrophobicContact CE1-CG 4.13Å; F294-R326 HydrophobicContact CE2-CB 4Å; F294-R326 HydrophobicContact CE2-CG 3.56Å; F294-R326 HydrophobicContact CG-CG 3.72Å; F294-R326 HydrophobicContact CZ-CG 3.9Å; F294-R327 HydrophobicContact CE2-CB 4.17Å; F294-R327 HydrophobicContact CZ-CB 4.4Å; F294-E330 VanDerWaalsContact CE1-OE1 3.26Å; F294-E330 WeakPolarHBondContact CE1-OE1 3.14Å; F294-E330 WeakPolarHBondContact CE1-OE2 3.48Å; F294-E330 WeakPolarHBondContact CZ-OE2 3.22Å |
| 295 | L | 93.8 | Very high | 94.1 | Very high | 141 Ų | 141 | 67.5 Ų | 67.5 | 74% | 0.738 | 37% | 0.368 | S | S | * | . | H | α-helix | trans | -65.2 | -25.5 | 176.6 | -68.8 | 172 | 0 | 0 | 0 | 113.6 | E291 H293 | E291-L295 WeakPolarHBondContact O-CG 3.46Å; E291-L295 PolarHBondContact O-N 2.98Å; H293-L295 VanDerWaalsContact C-N 3.29Å; H293-L295 PolarHBondContact O-N 3.26Å |
| 296 | K | 93.7 | Very high | 94.4 | Very high | 175 Ų | 175 | 66 Ų | 66 | 76% | 0.761 | 36% | 0.355 | S | S | * | . | H | α-helix | trans | -88.2 | -41.1 | 175.3 | -60.9 | -177.6 | -178 | -176.6 | 0 | 112.1 | H293 F294 | H293-K296 PolarHBondContact O-N 3.36Å; F294-K296 PolarHBondContact O-N 2.93Å |
| 297 | C | 89.7 | Confident | 94.6 | Very high | 32 Ų | 32 | 68.4 Ų | 68.4 | 22% | 0.216 | 37% | 0.374 | C | S | . | . | trans | -142.1 | 96.9 | -177.4 | -172.3 | 0 | 0 | 0 | 0 | 110.3 | H293 F294 K299 P300 E304 | H293-C297 PolarHBondContact O-N 2.87Å; F294-C297 CarbonylContact O-C 3.33Å; F294-C297 PolarHBondContact O-N 3.09Å; C297-K299 PolarHBondContact O-N 3.21Å; C297-P300 WeakPolarHBondContact O-CD 3.48Å; C297-P300 VanDerWaalsContact SG-CA 3.58Å; C297-E304 PolarHBondContact SG-OE1 3.48Å | ||
| 298 | P | 92.1 | Very high | 94.7 | Very high | 56 Ų | 56 | 65.3 Ų | 65.3 | 36% | 0.364 | 36% | 0.361 | S | S | . | . | S | Bend | trans | -72.9 | -7.7 | 178.3 | -21 | 33.2 | 0 | 0 | 0 | 115.1 | F294 R327 | F294-P298 HydrophobicContact CE1-CB 4.26Å; F294-P298 HydrophobicContact CE2-CB 4.01Å; F294-P298 HydrophobicContact CZ-CB 3.86Å; F294-P298 WeakPolarHBondContact O-CD 3.46Å; F294-P298 WeakPolarHBondContact O-CG 3.35Å; P298-R327 PolarHBondContact O-NH1 2.99Å; P298-R327 VanDerWaalsContact O-NH1 3.15Å |
| 299 | K | 93.9 | Very high | 94.8 | Very high | 165 Ų | 165 | 64 Ų | 64 | 72% | 0.717 | 35% | 0.348 | S | S | * | . | S | Bend | trans | -138.8 | 63.7 | -178.9 | -65 | 179.2 | -177.7 | 172.9 | 0 | 110.2 | C297 | C297-K299 PolarHBondContact O-N 3.21Š|
| 300 | P | 94 | Very high | 94.9 | Very high | 13 Ų | 13 | 65.9 Ų | 65.9 | 8% | 0.084 | 36% | 0.355 | C | S | . | . | trans | -61.2 | 144.8 | 179.3 | 28.1 | -35.7 | 0 | 0 | 0 | 111.2 | C297 E304 I305 F323 | C297-P300 WeakPolarHBondContact O-CD 3.48Å; C297-P300 VanDerWaalsContact SG-CA 3.58Å; P300-E304 HydrophobicContact CB-CB 3.77Å; P300-I305 HydrophobicContact CB-CG1 4.04Å; P300-I305 HydrophobicContact CG-CD1 4.16Å; P300-I305 HydrophobicContact CG-CG1 3.75Å; P300-I305 WeakPolarHBondContact O-CD1 3.42Å; P300-F323 VanDerWaalsContact CD-CD1 3.46Å; P300-F323 HydrophobicContact CG-CD1 3.58Å; P300-F323 HydrophobicContact CG-CD2 3.94Å; P300-F323 HydrophobicContact CG-CE1 3.63Å; P300-F323 HydrophobicContact CG-CE2 4Å; P300-F323 HydrophobicContact CG-CG 3.75Å; P300-F323 HydrophobicContact CG-CZ 3.86Å | ||
| 301 | S | 96.5 | Very high | 94.9 | Very high | 50 Ų | 50 | 70.1 Ų | 70.1 | 35% | 0.35 | 38% | 0.384 | S | S | . | . | trans | -65.2 | 166.9 | 175.9 | 66.2 | 0 | 0 | 0 | 0 | 112.5 | Q303 E304 I305 | S301-Q303 PolarHBondContact O-N 3.02Å; S301-E304 WeakPolarHBondContact CB-OE2 3.27Å; S301-E304 PolarHBondContact N-OE2 2.92Å; S301-E304 PolarHBondContact O-N 3.3Å; S301-E304 WeakPolarHBondContact OG-CG 3.41Å; S301-E304 PolarHBondContact OG-N 2.84Å; S301-E304 PolarHBondContact OG-OE2 3.27Å; S301-I305 WeakPolarHBondContact O-CB 3.36Å; S301-I305 VanDerWaalsContact O-CG1 3.28Å; S301-I305 WeakPolarHBondContact O-CG1 3.46Å; S301-I305 PolarHBondContact O-N 3.39Å | ||
| 302 | A | 95.5 | Very high | 94.8 | Very high | 71 Ų | 71 | 68.6 Ų | 68.6 | 59% | 0.587 | 38% | 0.378 | S | S | * | . | H | α-helix | trans | -62 | -23.3 | 175.3 | 0 | 0 | 0 | 0 | 0 | 113.4 | T306 | A302-T306 PolarHBondContact O-N 3.48Å; A302-T306 PolarHBondContact O-OG1 2.97Å |
| 303 | Q | 95.9 | Very high | 94.7 | Very high | 159 Ų | 159 | 73.3 Ų | 73.3 | 74% | 0.743 | 39% | 0.394 | S | S | * | . | H | α-helix | trans | -76.8 | -53.4 | 173.4 | -74.7 | 177.7 | -33.3 | 0 | 0 | 110.9 | S301 I305 T306 S307 | S301-Q303 PolarHBondContact O-N 3.02Å; Q303-I305 VanDerWaalsContact C-N 3.29Å; Q303-I305 PolarHBondContact O-N 2.88Å; Q303-T306 WeakPolarHBondContact O-CA 3.18Å; Q303-T306 WeakPolarHBondContact O-CB 3.34Å; Q303-T306 PolarHBondContact O-N 2.87Å; Q303-S307 PolarHBondContact O-N 3.22Å; Q303-S307 PolarHBondContact O-OG 3.44Å |
| 304 | E | 95.1 | Very high | 94.7 | Very high | 63 Ų | 63 | 72.6 Ų | 72.6 | 29% | 0.294 | 39% | 0.392 | S | S | . | . | H | α-helix | trans | -54.4 | -42.9 | 175.7 | -73.2 | 159.1 | 87.3 | 0 | 0 | 112.2 | H293 C297 P300 S301 T306 S307 L308 | H293-E304 IonicContact CE1-OE1 3.61Å; C297-E304 PolarHBondContact SG-OE1 3.48Å; P300-E304 HydrophobicContact CB-CB 3.77Å; S301-E304 WeakPolarHBondContact CB-OE2 3.27Å; S301-E304 PolarHBondContact N-OE2 2.92Å; S301-E304 PolarHBondContact O-N 3.3Å; S301-E304 WeakPolarHBondContact OG-CG 3.41Å; S301-E304 PolarHBondContact OG-N 2.84Å; S301-E304 PolarHBondContact OG-OE2 3.27Å; E304-T306 PolarHBondContact O-N 3.47Å; E304-S307 PolarHBondContact O-N 3.37Å; E304-L308 VanDerWaalsContact O-CB 3.32Å; E304-L308 WeakPolarHBondContact O-CB 3.39Å; E304-L308 VanDerWaalsContact O-CG 3.3Å; E304-L308 WeakPolarHBondContact O-CG 3.33Å; E304-L308 PolarHBondContact O-N 2.8Å |
| 305 | I | 95.9 | Very high | 94.6 | Very high | 18 Ų | 18 | 78.1 Ų | 78.1 | 9% | 0.092 | 42% | 0.418 | C | S | . | . | H | α-helix | trans | -61.7 | -30.9 | 175.9 | -68.8 | 170.2 | 0 | 0 | 0 | 111.8 | P300 S301 Q303 A309 K316 V319 R320 | P300-I305 HydrophobicContact CB-CG1 4.04Å; P300-I305 HydrophobicContact CG-CD1 4.16Å; P300-I305 HydrophobicContact CG-CG1 3.75Å; P300-I305 WeakPolarHBondContact O-CD1 3.42Å; S301-I305 WeakPolarHBondContact O-CB 3.36Å; S301-I305 VanDerWaalsContact O-CG1 3.28Å; S301-I305 WeakPolarHBondContact O-CG1 3.46Å; S301-I305 PolarHBondContact O-N 3.39Å; Q303-I305 VanDerWaalsContact C-N 3.29Å; Q303-I305 PolarHBondContact O-N 2.88Å; I305-A309 VanDerWaalsContact O-CB 3.29Å; I305-A309 WeakPolarHBondContact O-CB 3.47Å; I305-A309 PolarHBondContact O-N 2.93Å; I305-A309 VanDerWaalsContact O-N 3.11Å; I305-K316 HydrophobicContact CG2-CG 4.14Å; I305-V319 HydrophobicContact CG2-CB 4.26Å; I305-V319 HydrophobicContact CG2-CG1 4.1Å; I305-R320 HydrophobicContact CD1-CG 4.31Å; I305-R320 HydrophobicContact CG2-CB 4.13Å |
| 306 | T | 96.6 | Very high | 94.6 | Very high | 39 Ų | 39 | 76.3 Ų | 76.3 | 24% | 0.239 | 40% | 0.404 | C | S | . | . | H | α-helix | trans | -74.5 | -52 | 176.1 | -48.5 | 0 | 0 | 0 | 0 | 110.1 | A302 Q303 E304 L308 A309 D310 K316 | A302-T306 PolarHBondContact O-N 3.48Å; A302-T306 PolarHBondContact O-OG1 2.97Å; Q303-T306 WeakPolarHBondContact O-CA 3.18Å; Q303-T306 WeakPolarHBondContact O-CB 3.34Å; Q303-T306 PolarHBondContact O-N 2.87Å; E304-T306 PolarHBondContact O-N 3.47Å; T306-L308 PolarHBondContact O-N 3.27Å; T306-A309 WeakPolarHBondContact O-CA 3.21Å; T306-A309 WeakPolarHBondContact O-CB 3.3Å; T306-A309 PolarHBondContact O-N 3.39Å; T306-D310 VanDerWaalsContact O-CG 3.25Å; T306-D310 PolarHBondContact O-N 2.94Å; T306-K316 HydrophobicContact CG2-CD 4.45Å; T306-K316 WeakPolarHBondContact OG1-CE 3.28Å; T306-K316 PolarHBondContact OG1-NZ 3.39Å |
| 307 | S | 96.3 | Very high | 94.7 | Very high | 76 Ų | 76 | 71.9 Ų | 71.9 | 53% | 0.531 | 39% | 0.386 | S | S | . | . | H | α-helix | trans | -59.6 | -33.8 | 178 | -52.6 | 0 | 0 | 0 | 0 | 113.2 | Q303 E304 S311 | Q303-S307 PolarHBondContact O-N 3.22Å; Q303-S307 PolarHBondContact O-OG 3.44Å; E304-S307 PolarHBondContact O-N 3.37Å; S307-S311 WeakPolarHBondContact O-CB 3.37Å; S307-S311 PolarHBondContact O-N 2.9Å; S307-S311 VanDerWaalsContact O-N 3.08Å; S307-S311 PolarHBondContact O-OG 3.23Å |
| 308 | L | 95.4 | Very high | 95 | Very high | 16 Ų | 16 | 71.3 Ų | 71.3 | 8% | 0.084 | 38% | 0.382 | C | S | . | . | H | α-helix | trans | -70.4 | -35.3 | 171.1 | -75.3 | 170.6 | 0 | 0 | 0 | 112.9 | E304 T306 L312 V319 F323 | E304-L308 VanDerWaalsContact O-CB 3.32Å; E304-L308 WeakPolarHBondContact O-CB 3.39Å; E304-L308 VanDerWaalsContact O-CG 3.3Å; E304-L308 WeakPolarHBondContact O-CG 3.33Å; E304-L308 PolarHBondContact O-N 2.8Å; T306-L308 PolarHBondContact O-N 3.27Å; L308-L312 HydrophobicContact CD2-CD1 4.49Å; L308-L312 WeakPolarHBondContact O-CB 3.24Å; L308-L312 WeakPolarHBondContact O-CD1 3.32Å; L308-L312 WeakPolarHBondContact O-CG 3.35Å; L308-L312 PolarHBondContact O-N 2.96Å; L308-L312 VanDerWaalsContact O-N 3.14Å; L308-V319 HydrophobicContact CB-CG1 4.16Å; L308-F323 HydrophobicContact CD1-CE2 3.87Å; L308-F323 HydrophobicContact CD1-CZ 3.96Å |
| 309 | A | 96.3 | Very high | 95.2 | Very high | 3 Ų | 3 | 68.7 Ų | 68.7 | 3% | 0.025 | 36% | 0.364 | C | S | . | . | H | α-helix | trans | -66.6 | -47 | 175.5 | 0 | 0 | 0 | 0 | 0 | 111.1 | I305 T306 L312 Q313 L314 K316 V319 | I305-A309 VanDerWaalsContact O-CB 3.29Å; I305-A309 WeakPolarHBondContact O-CB 3.47Å; I305-A309 PolarHBondContact O-N 2.93Å; I305-A309 VanDerWaalsContact O-N 3.11Å; T306-A309 WeakPolarHBondContact O-CA 3.21Å; T306-A309 WeakPolarHBondContact O-CB 3.3Å; T306-A309 PolarHBondContact O-N 3.39Å; A309-L312 PolarHBondContact O-N 3.47Å; A309-Q313 WeakPolarHBondContact O-CA 3.48Å; A309-Q313 PolarHBondContact O-N 3.21Å; A309-L314 WeakPolarHBondContact CB-O 3.47Å; A309-L314 PolarHBondContact O-N 2.89Å; A309-K316 HydrophobicContact CB-CB 4.21Å; A309-V319 HydrophobicContact CB-CG2 3.97Å |
| 310 | D | 96.1 | Very high | 95.3 | Very high | 112 Ų | 112 | 66.2 Ų | 66.2 | 60% | 0.599 | 35% | 0.35 | S | S | * | . | H | α-helix | trans | -64.6 | -47.7 | -179.5 | -55.4 | -33.6 | 0 | 0 | 0 | 111.5 | T306 L312 Q313 | T306-D310 VanDerWaalsContact O-CG 3.25Å; T306-D310 PolarHBondContact O-N 2.94Å; D310-L312 VanDerWaalsContact C-N 3.34Å; D310-L312 PolarHBondContact O-N 3.47Å; D310-Q313 PolarHBondContact O-N 2.79Å |
| 311 | S | 94.9 | Very high | 95.4 | Very high | 88 Ų | 88 | 68 Ų | 68 | 62% | 0.615 | 36% | 0.361 | S | S | * | . | H | α-helix | trans | -71.1 | -23.7 | -179.5 | 56.6 | 0 | 0 | 0 | 0 | 114.6 | S307 | S307-S311 WeakPolarHBondContact O-CB 3.37Å; S307-S311 PolarHBondContact O-N 2.9Å; S307-S311 VanDerWaalsContact O-N 3.08Å; S307-S311 PolarHBondContact O-OG 3.23Å |
| 312 | L | 93.8 | Very high | 95.4 | Very high | 28 Ų | 28 | 67.1 Ų | 67.1 | 15% | 0.147 | 35% | 0.35 | C | S | . | . | T | Hydrogen-bonded Turn | trans | -99.9 | 3.1 | 175.8 | -59.5 | 172.8 | 0 | 0 | 0 | 113.3 | V286 V289 L290 L308 A309 D310 L314 | V286-L312 HydrophobicContact CG1-CB 4.05Å; V286-L312 HydrophobicContact CG1-CD1 4.07Å; V286-L312 HydrophobicContact CG1-CD2 4.24Å; V286-L312 HydrophobicContact CG1-CG 4.35Å; V289-L312 HydrophobicContact CB-CD2 4.08Å; V289-L312 HydrophobicContact CG1-CD2 4.04Å; V289-L312 HydrophobicContact CG2-CD2 4.36Å; L290-L312 HydrophobicContact CD1-CD1 4.43Å; L290-L312 HydrophobicContact CD2-CD1 3.63Å; L290-L312 HydrophobicContact CG-CD1 3.78Å; L308-L312 HydrophobicContact CD2-CD1 4.49Å; L308-L312 WeakPolarHBondContact O-CB 3.24Å; L308-L312 WeakPolarHBondContact O-CD1 3.32Å; L308-L312 WeakPolarHBondContact O-CG 3.35Å; L308-L312 PolarHBondContact O-N 2.96Å; L308-L312 VanDerWaalsContact O-N 3.14Å; A309-L312 PolarHBondContact O-N 3.47Å; D310-L312 VanDerWaalsContact C-N 3.34Å; D310-L312 PolarHBondContact O-N 3.47Å; L312-L314 HydrophobicContact CB-CD1 4.48Å; L312-L314 HydrophobicContact CB-CG 4.28Å; L312-L314 PolarHBondContact O-N 3.21Å |
| 313 | Q | 93.5 | Very high | 95.4 | Very high | 183 Ų | 183 | 63.9 Ų | 63.9 | 86% | 0.855 | 32% | 0.323 | S | S | * | . | T | Hydrogen-bonded Turn | trans | 50.6 | 39 | -175.5 | -56.7 | -174.9 | 7.1 | 0 | 0 | 113.4 | A309 D310 | A309-Q313 WeakPolarHBondContact O-CA 3.48Å; A309-Q313 PolarHBondContact O-N 3.21Å; D310-Q313 PolarHBondContact O-N 2.79Å |
| 314 | L | 93.9 | Very high | 95.3 | Very high | 34 Ų | 34 | 58 Ų | 58 | 18% | 0.178 | 30% | 0.299 | C | S | . | . | trans | -107.5 | 155.1 | 177.2 | -70.8 | -175 | 0 | 0 | 0 | 111.5 | I282 V286 L290 A309 L312 K316 V318 V319 | I282-L314 HydrophobicContact CG1-CD1 4.42Å; I282-L314 HydrophobicContact CG2-CD1 4.47Å; V286-L314 HydrophobicContact CG1-CD1 3.71Å; V286-L314 HydrophobicContact CG1-CG 4.3Å; L290-L314 HydrophobicContact CD1-CD1 4.42Å; A309-L314 WeakPolarHBondContact CB-O 3.47Å; A309-L314 PolarHBondContact O-N 2.89Å; L312-L314 HydrophobicContact CB-CD1 4.48Å; L312-L314 HydrophobicContact CB-CG 4.28Å; L312-L314 PolarHBondContact O-N 3.21Å; L314-K316 PolarHBondContact O-N 2.75Å; L314-V318 HydrophobicContact CD1-CG1 4.34Å; L314-V319 HydrophobicContact CB-CG2 3.86Å; L314-V319 HydrophobicContact CD1-CG2 4.01Å | ||
| 315 | E | 93.6 | Very high | 95.3 | Very high | 118 Ų | 118 | 58.6 Ų | 58.6 | 55% | 0.551 | 30% | 0.304 | S | S | * | . | trans | -63.5 | 133 | 166.8 | -177.2 | -177.3 | -166.3 | 0 | 0 | 110.2 | E317 V318 V319 | E315-E317 HydrophobicContact CG-CB 4.2Å; E315-E317 PolarHBondContact O-N 3.37Å; E315-E317 VanDerWaalsContact O-N 3.09Å; E315-V318 HydrophobicContact CB-CB 4.36Å; E315-V318 HydrophobicContact CB-CG2 3.94Å; E315-V318 WeakPolarHBondContact O-CA 3.42Å; E315-V318 WeakPolarHBondContact O-CB 3.35Å; E315-V318 PolarHBondContact O-N 3.25Å; E315-V319 PolarHBondContact O-N 2.9Å | ||
| 316 | K | 94.9 | Very high | 95.3 | Very high | 103 Ų | 103 | 59.9 Ų | 59.9 | 45% | 0.448 | 31% | 0.308 | S | S | . | . | H | α-helix | trans | -49.2 | -38 | 178.2 | -179.1 | 171 | 176.5 | 162.2 | 0 | 113.5 | I305 T306 A309 L314 V319 R320 | I305-K316 HydrophobicContact CG2-CG 4.14Å; T306-K316 HydrophobicContact CG2-CD 4.45Å; T306-K316 WeakPolarHBondContact OG1-CE 3.28Å; T306-K316 PolarHBondContact OG1-NZ 3.39Å; A309-K316 HydrophobicContact CB-CB 4.21Å; L314-K316 PolarHBondContact O-N 2.75Å; K316-V319 PolarHBondContact O-N 3.4Å; K316-R320 WeakPolarHBondContact O-CB 3.43Å; K316-R320 PolarHBondContact O-N 3.08Å |
| 317 | E | 94.6 | Very high | 95.2 | Very high | 82 Ų | 82 | 62.2 Ų | 62.2 | 38% | 0.383 | 31% | 0.312 | S | S | . | . | H | α-helix | trans | -67.8 | -36.6 | 176.5 | 179.5 | 58.9 | -171.4 | 0 | 0 | 112.6 | E315 R320 V321 | E315-E317 HydrophobicContact CG-CB 4.2Å; E315-E317 PolarHBondContact O-N 3.37Å; E315-E317 VanDerWaalsContact O-N 3.09Å; E317-R320 VanDerWaalsContact CD-NH2 3.34Å; E317-R320 PolarHBondContact O-N 3.02Å; E317-R320 IonicContact OE1-CZ 3.06Å; E317-R320 IonicContact OE1-NE 2.92Å; E317-R320 IonicContact OE1-NH2 3.18Å; E317-R320 PolarHBondContact OE1-NH2 3.19Å; E317-R320 IonicContact OE2-CZ 3.63Å; E317-R320 IonicContact OE2-NE 3.28Å; E317-R320 PolarHBondContact OE2-NE 3.23Å; E317-R320 IonicContact OE2-NH2 2.7Å; E317-R320 PolarHBondContact OE2-NH2 3.46Å; E317-R320 VanDerWaalsContact OE2-NH2 3.16Å; E317-V321 HydrophobicContact CG-CG2 4.29Å; E317-V321 VanDerWaalsContact O-CB 3.26Å; E317-V321 WeakPolarHBondContact O-CB 3.42Å; E317-V321 VanDerWaalsContact O-CG2 3.24Å; E317-V321 WeakPolarHBondContact O-CG2 2.97Å; E317-V321 PolarHBondContact O-N 2.81Å; E317-V321 VanDerWaalsContact OE1-CG2 3.24Å; E317-V321 WeakPolarHBondContact OE1-CG2 3.43Å |
| 318 | V | 95.4 | Very high | 94.9 | Very high | 21 Ų | 21 | 64 Ų | 64 | 13% | 0.127 | 31% | 0.312 | C | S | . | . | H | α-helix | trans | -64.5 | -42.9 | 176.3 | 174.1 | 0 | 0 | 0 | 0 | 110.6 | T280 I282 L314 E315 W322 | T280-V318 HydrophobicContact CG2-CG1 4.21Å; T280-V318 HydrophobicContact CG2-CG2 4.11Å; I282-V318 HydrophobicContact CD1-CG1 3.74Å; I282-V318 HydrophobicContact CG1-CG1 3.98Å; L314-V318 HydrophobicContact CD1-CG1 4.34Å; E315-V318 HydrophobicContact CB-CB 4.36Å; E315-V318 HydrophobicContact CB-CG2 3.94Å; E315-V318 WeakPolarHBondContact O-CA 3.42Å; E315-V318 WeakPolarHBondContact O-CB 3.35Å; E315-V318 PolarHBondContact O-N 3.25Å; V318-W322 VanDerWaalsContact O-CB 3.29Å; V318-W322 WeakPolarHBondContact O-CB 3.41Å; V318-W322 PolarHBondContact O-N 3.2Å |
| 319 | V | 96.3 | Very high | 94.6 | Very high | 0 Ų | 0 | 68.5 Ų | 68.5 | 0% | 0 | 33% | 0.331 | C | S | . | . | H | α-helix | trans | -64.3 | -48.8 | 174.8 | -179.2 | 0 | 0 | 0 | 0 | 110.8 | L290 I305 L308 A309 L314 E315 K316 V321 W322 F323 | L290-V319 HydrophobicContact CD2-CG1 4.11Å; I305-V319 HydrophobicContact CG2-CB 4.26Å; I305-V319 HydrophobicContact CG2-CG1 4.1Å; L308-V319 HydrophobicContact CB-CG1 4.16Å; A309-V319 HydrophobicContact CB-CG2 3.97Å; L314-V319 HydrophobicContact CB-CG2 3.86Å; L314-V319 HydrophobicContact CD1-CG2 4.01Å; E315-V319 PolarHBondContact O-N 2.9Å; K316-V319 PolarHBondContact O-N 3.4Å; V319-V321 PolarHBondContact O-N 2.94Å; V319-W322 WeakPolarHBondContact O-CB 3.23Å; V319-W322 PolarHBondContact O-N 3.45Å; V319-W322 VanDerWaalsContact O-N 3.13Å; V319-F323 HydrophobicContact CG1-CD2 3.93Å; V319-F323 HydrophobicContact CG1-CE2 3.88Å; V319-F323 WeakPolarHBondContact O-CD2 3.33Å; V319-F323 PolarHBondContact O-N 3.41Å |
| 320 | R | 96.5 | Very high | 94.4 | Very high | 113 Ų | 113 | 70.9 Ų | 70.9 | 43% | 0.426 | 34% | 0.342 | S | S | . | . | H | α-helix | trans | -56.8 | -47 | 177.8 | -168.1 | -167.9 | 71 | 86.7 | 2.5 | 112.2 | I305 K316 E317 W322 F323 C324 | I305-R320 HydrophobicContact CD1-CG 4.31Å; I305-R320 HydrophobicContact CG2-CB 4.13Å; K316-R320 WeakPolarHBondContact O-CB 3.43Å; K316-R320 PolarHBondContact O-N 3.08Å; E317-R320 VanDerWaalsContact CD-NH2 3.34Å; E317-R320 PolarHBondContact O-N 3.02Å; E317-R320 IonicContact OE1-CZ 3.06Å; E317-R320 IonicContact OE1-NE 2.92Å; E317-R320 IonicContact OE1-NH2 3.18Å; E317-R320 PolarHBondContact OE1-NH2 3.19Å; E317-R320 IonicContact OE2-CZ 3.63Å; E317-R320 IonicContact OE2-NE 3.28Å; E317-R320 PolarHBondContact OE2-NE 3.23Å; E317-R320 IonicContact OE2-NH2 2.7Å; E317-R320 PolarHBondContact OE2-NH2 3.46Å; E317-R320 VanDerWaalsContact OE2-NH2 3.16Å; R320-W322 VanDerWaalsContact C-N 3.34Å; R320-F323 PolarHBondContact O-N 2.9Å; R320-C324 PolarHBondContact O-N 2.96Å; R320-C324 VanDerWaalsContact O-N 3.13Å; R320-C324 PolarHBondContact O-SG 3.01Å |
| 321 | V | 96.2 | Very high | 94 | Very high | 52 Ų | 52 | 71.5 Ų | 71.5 | 32% | 0.315 | 34% | 0.339 | S | S | . | . | H | α-helix | trans | -66.8 | -35.6 | 177.6 | 168.1 | 0 | 0 | 0 | 0 | 111.3 | E317 V319 C324 N325 | E317-V321 HydrophobicContact CG-CG2 4.29Å; E317-V321 VanDerWaalsContact O-CB 3.26Å; E317-V321 WeakPolarHBondContact O-CB 3.42Å; E317-V321 VanDerWaalsContact O-CG2 3.24Å; E317-V321 WeakPolarHBondContact O-CG2 2.97Å; E317-V321 PolarHBondContact O-N 2.81Å; E317-V321 VanDerWaalsContact OE1-CG2 3.24Å; E317-V321 WeakPolarHBondContact OE1-CG2 3.43Å; V319-V321 PolarHBondContact O-N 2.94Å; V321-C324 PolarHBondContact O-N 3.5Å; V321-N325 VanDerWaalsContact CG1-ND2 3.33Å; V321-N325 WeakPolarHBondContact CG1-ND2 3.41Å; V321-N325 WeakPolarHBondContact O-CB 3.15Å; V321-N325 PolarHBondContact O-N 3.42Å; V321-N325 PolarHBondContact O-ND2 3.22Å |
| 322 | W | 96.2 | Very high | 93.6 | Very high | 31 Ų | 31 | 74.9 Ų | 74.9 | 12% | 0.117 | 34% | 0.338 | C | S | . | . | H | α-helix | trans | -60.8 | -49.7 | 173.8 | -174.4 | 96.8 | 0 | 0 | 0 | 111.8 | I282 L290 E291 F294 V318 V319 R320 C324 N325 R326 | I282-W322 HydrophobicContact CD1-CB 4.35Å; I282-W322 HydrophobicContact CD1-CG 4.28Å; L290-W322 VanDerWaalsContact C-CH2 3.45Å; L290-W322 HydrophobicContact CB-CD2 4.02Å; L290-W322 HydrophobicContact CB-CE3 3.89Å; L290-W322 HydrophobicContact CB-CH2 3.7Å; L290-W322 HydrophobicContact CB-CZ2 3.8Å; L290-W322 HydrophobicContact CB-CZ3 3.74Å; L290-W322 HydrophobicContact CD1-CD2 3.96Å; L290-W322 HydrophobicContact CD1-CE3 4.4Å; L290-W322 HydrophobicContact CD1-CG 4.03Å; L290-W322 HydrophobicContact CD2-CE3 4.37Å; L290-W322 HydrophobicContact CG-CD2 4.46Å; L290-W322 HydrophobicContact CG-CE3 4.46Å; L290-W322 WeakPolarHBondContact O-CH2 3.25Å; L290-W322 WeakPolarHBondContact O-CZ3 3.26Å; E291-W322 HydrophobicContact CG-CH2 3.75Å; E291-W322 HydrophobicContact CG-CZ2 3.59Å; F294-W322 HydrophobicContact CB-CH2 4.11Å; F294-W322 HydrophobicContact CB-CZ3 4.09Å; F294-W322 HydrophobicContact CD2-CZ3 4.21Å; F294-W322 HydrophobicContact CG-CZ3 4.48Å; V318-W322 VanDerWaalsContact O-CB 3.29Å; V318-W322 WeakPolarHBondContact O-CB 3.41Å; V318-W322 PolarHBondContact O-N 3.2Å; V319-W322 WeakPolarHBondContact O-CB 3.23Å; V319-W322 PolarHBondContact O-N 3.45Å; V319-W322 VanDerWaalsContact O-N 3.13Å; R320-W322 VanDerWaalsContact C-N 3.34Å; W322-C324 VanDerWaalsContact C-N 3.34Å; W322-C324 PolarHBondContact O-N 2.82Å; W322-N325 PolarHBondContact O-N 3.47Å; W322-R326 HydrophobicContact CD2-CB 4.45Å; W322-R326 HydrophobicContact CE3-CB 4.17Å; W322-R326 HydrophobicContact CH2-CB 3.84Å; W322-R326 HydrophobicContact CH2-CG 3.59Å; W322-R326 HydrophobicContact CZ2-CB 4.14Å; W322-R326 HydrophobicContact CZ2-CG 4.1Å; W322-R326 HydrophobicContact CZ3-CB 3.86Å; W322-R326 HydrophobicContact CZ3-CG 3.97Å; W322-R326 WeakPolarHBondContact O-CB 3.43Å; W322-R326 PolarHBondContact O-N 3.03Å |
| 323 | F | 96.4 | Very high | 92.7 | Very high | 3 Ų | 3 | 79.6 Ų | 79.6 | 1% | 0.013 | 36% | 0.361 | C | S | . | . | H | α-helix | trans | -62.4 | -39.5 | 178.4 | -86.3 | -86.1 | 0 | 0 | 0 | 112.4 | L290 H293 F294 P300 L308 V319 R320 R326 R327 | L290-F323 HydrophobicContact CD2-CE2 3.79Å; L290-F323 HydrophobicContact CD2-CZ 4.39Å; H293-F323 HydrophobicContact CB-CZ 4.31Å; F294-F323 HydrophobicContact CB-CE1 4.04Å; F294-F323 AromaticContact CD2-CD1 3.77Å; F294-F323 HydrophobicContact CD2-CD1 3.77Å; F294-F323 AromaticContact CD2-CE1 4Å; F294-F323 HydrophobicContact CD2-CE1 4Å; P300-F323 VanDerWaalsContact CD-CD1 3.46Å; P300-F323 HydrophobicContact CG-CD1 3.58Å; P300-F323 HydrophobicContact CG-CD2 3.94Å; P300-F323 HydrophobicContact CG-CE1 3.63Å; P300-F323 HydrophobicContact CG-CE2 4Å; P300-F323 HydrophobicContact CG-CG 3.75Å; P300-F323 HydrophobicContact CG-CZ 3.86Å; L308-F323 HydrophobicContact CD1-CE2 3.87Å; L308-F323 HydrophobicContact CD1-CZ 3.96Å; V319-F323 HydrophobicContact CG1-CD2 3.93Å; V319-F323 HydrophobicContact CG1-CE2 3.88Å; V319-F323 WeakPolarHBondContact O-CD2 3.33Å; V319-F323 PolarHBondContact O-N 3.41Å; R320-F323 PolarHBondContact O-N 2.9Å; F323-R326 PolarHBondContact O-N 2.86Å; F323-R327 WeakPolarHBondContact O-CB 3.08Å; F323-R327 PolarHBondContact O-N 3.47Å; F323-R327 VanDerWaalsContact O-N 3.08Å |
| 324 | C | 94.5 | Very high | 91.7 | Very high | 35 Ų | 35 | 78.2 Ų | 78.2 | 24% | 0.236 | 35% | 0.354 | C | S | . | . | H | α-helix | trans | -60.1 | -48.4 | 172.3 | -73.3 | 0 | 0 | 0 | 0 | 112.1 | R320 V321 W322 R327 Q328 | R320-C324 PolarHBondContact O-N 2.96Å; R320-C324 VanDerWaalsContact O-N 3.13Å; R320-C324 PolarHBondContact O-SG 3.01Å; V321-C324 PolarHBondContact O-N 3.5Å; W322-C324 VanDerWaalsContact C-N 3.34Å; W322-C324 PolarHBondContact O-N 2.82Å; C324-R327 PolarHBondContact O-N 2.67Å; C324-Q328 WeakPolarHBondContact O-CB 3.46Å; C324-Q328 WeakPolarHBondContact O-CG 3.24Å; C324-Q328 PolarHBondContact O-N 2.72Å |
| 325 | N | 94.9 | Very high | 90.1 | Very high | 76 Ų | 76 | 82.2 Ų | 82.2 | 41% | 0.406 | 37% | 0.372 | S | S | . | . | H | α-helix | trans | -65.6 | -38.3 | 178.4 | -71.6 | -33 | 0 | 0 | 0 | 112.6 | V321 W322 Q328 K329 | V321-N325 VanDerWaalsContact CG1-ND2 3.33Å; V321-N325 WeakPolarHBondContact CG1-ND2 3.41Å; V321-N325 WeakPolarHBondContact O-CB 3.15Å; V321-N325 PolarHBondContact O-N 3.42Å; V321-N325 PolarHBondContact O-ND2 3.22Å; W322-N325 PolarHBondContact O-N 3.47Å; N325-Q328 PolarHBondContact O-N 3.36Å; N325-K329 PolarHBondContact O-N 3.17Å |
| 326 | R | 95.1 | Very high | 87.9 | Confident | 45 Ų | 45 | 78.3 Ų | 78.3 | 17% | 0.17 | 36% | 0.364 | C | S | . | . | H | α-helix | trans | -67.1 | -39.5 | 179.4 | 179.6 | 61.5 | -171.6 | 70.3 | 6.9 | 111.8 | F294 W322 F323 K329 E330 | F294-R326 HydrophobicContact CD1-CG 4.02Å; F294-R326 HydrophobicContact CD2-CB 4.03Å; F294-R326 HydrophobicContact CD2-CG 3.46Å; F294-R326 VanDerWaalsContact CD2-CG 3.46Å; F294-R326 HydrophobicContact CE1-CG 4.13Å; F294-R326 HydrophobicContact CE2-CB 4Å; F294-R326 HydrophobicContact CE2-CG 3.56Å; F294-R326 HydrophobicContact CG-CG 3.72Å; F294-R326 HydrophobicContact CZ-CG 3.9Å; W322-R326 HydrophobicContact CD2-CB 4.45Å; W322-R326 HydrophobicContact CE3-CB 4.17Å; W322-R326 HydrophobicContact CH2-CB 3.84Å; W322-R326 HydrophobicContact CH2-CG 3.59Å; W322-R326 HydrophobicContact CZ2-CB 4.14Å; W322-R326 HydrophobicContact CZ2-CG 4.1Å; W322-R326 HydrophobicContact CZ3-CB 3.86Å; W322-R326 HydrophobicContact CZ3-CG 3.97Å; W322-R326 WeakPolarHBondContact O-CB 3.43Å; W322-R326 PolarHBondContact O-N 3.03Å; F323-R326 PolarHBondContact O-N 2.86Å; R326-K329 PolarHBondContact O-N 3.47Å; R326-E330 IonicContact CZ-OE1 2.96Å; R326-E330 VanDerWaalsContact CZ-OE1 3.28Å; R326-E330 IonicContact NH1-OE1 3.75Å; R326-E330 PolarHBondContact NH1-OE1 3.35Å; R326-E330 IonicContact NH2-OE1 2.7Å; R326-E330 PolarHBondContact NH2-OE1 2.67Å; R326-E330 PolarHBondContact O-N 2.97Å |
| 327 | R | 94.4 | Very high | 86.1 | Confident | 87 Ų | 87 | 79.4 Ų | 79.4 | 33% | 0.328 | 38% | 0.381 | S | S | . | . | H | α-helix | trans | -69.2 | -39.1 | 173.3 | -172.2 | 170.4 | 59.8 | -103.4 | -4.5 | 112.4 | F294 P298 F323 C324 K329 E330 K331 | F294-R327 HydrophobicContact CE2-CB 4.17Å; F294-R327 HydrophobicContact CZ-CB 4.4Å; P298-R327 PolarHBondContact O-NH1 2.99Å; P298-R327 VanDerWaalsContact O-NH1 3.15Å; F323-R327 WeakPolarHBondContact O-CB 3.08Å; F323-R327 PolarHBondContact O-N 3.47Å; F323-R327 VanDerWaalsContact O-N 3.08Å; C324-R327 PolarHBondContact O-N 2.67Å; R327-K329 VanDerWaalsContact C-N 3.33Å; R327-K329 PolarHBondContact O-N 2.82Å; R327-E330 WeakPolarHBondContact O-CB 3.45Å; R327-E330 PolarHBondContact O-N 2.9Å; R327-K331 PolarHBondContact O-N 3.26Å |
| 328 | Q | 89.6 | Confident | 83.9 | Confident | 114 Ų | 114 | 85.5 Ų | 85.5 | 53% | 0.533 | 40% | 0.402 | S | S | . | . | H | α-helix | trans | -66.3 | -31.2 | 171.7 | -74.2 | 177.7 | 11.7 | 0 | 0 | 113.3 | C324 N325 R332 | C324-Q328 WeakPolarHBondContact O-CB 3.46Å; C324-Q328 WeakPolarHBondContact O-CG 3.24Å; C324-Q328 PolarHBondContact O-N 2.72Å; N325-Q328 PolarHBondContact O-N 3.36Å; Q328-R332 WeakPolarHBondContact O-CG 3.4Å; Q328-R332 PolarHBondContact O-N 2.78Å; Q328-R332 PolarHBondContact O-NE 2.97Å; Q328-R332 VanDerWaalsContact O-NE 3.13Å |
| 329 | K | 90.6 | Very high | 81.6 | Confident | 111 Ų | 111 | 88.9 Ų | 88.9 | 48% | 0.483 | 43% | 0.426 | S | S | . | . | H | α-helix | trans | -66 | -48.2 | 170.7 | -172.5 | -171.4 | 175 | -168.9 | 0 | 109.9 | N325 R326 R327 K331 R332 M333 | N325-K329 PolarHBondContact O-N 3.17Å; R326-K329 PolarHBondContact O-N 3.47Å; R327-K329 VanDerWaalsContact C-N 3.33Å; R327-K329 PolarHBondContact O-N 2.82Å; K329-K331 PolarHBondContact O-N 3.33Å; K329-R332 PolarHBondContact O-N 2.95Å; K329-M333 HydrophobicContact CG-CG 4.46Å; K329-M333 VanDerWaalsContact O-CG 3.23Å; K329-M333 WeakPolarHBondContact O-CG 3.37Å; K329-M333 PolarHBondContact O-N 2.82Å |
| 330 | E | 90.6 | Very high | 79.3 | Confident | 53 Ų | 53 | 98.5 Ų | 98.5 | 25% | 0.248 | 47% | 0.471 | C | S | . | . | H | α-helix | trans | -58.5 | -46.8 | -178 | -164 | 147.5 | -86 | 0 | 0 | 113.7 | F294 R326 R327 R332 M333 H334 | F294-E330 VanDerWaalsContact CE1-OE1 3.26Å; F294-E330 WeakPolarHBondContact CE1-OE1 3.14Å; F294-E330 WeakPolarHBondContact CE1-OE2 3.48Å; F294-E330 WeakPolarHBondContact CZ-OE2 3.22Å; R326-E330 IonicContact CZ-OE1 2.96Å; R326-E330 VanDerWaalsContact CZ-OE1 3.28Å; R326-E330 IonicContact NH1-OE1 3.75Å; R326-E330 PolarHBondContact NH1-OE1 3.35Å; R326-E330 IonicContact NH2-OE1 2.7Å; R326-E330 PolarHBondContact NH2-OE1 2.67Å; R326-E330 PolarHBondContact O-N 2.97Å; R327-E330 WeakPolarHBondContact O-CB 3.45Å; R327-E330 PolarHBondContact O-N 2.9Å; E330-R332 VanDerWaalsContact C-N 3.31Å; E330-R332 PolarHBondContact O-N 3.48Å; E330-M333 PolarHBondContact O-N 2.71Å; E330-H334 PolarHBondContact O-N 3.12Å; E330-H334 VanDerWaalsContact O-N 3.12Å; E330-H334 PolarHBondContact O-ND1 2.96Å |
| 331 | K | 88.3 | Confident | 76.6 | Confident | 124 Ų | 124 | 98.2 Ų | 98.2 | 54% | 0.539 | 49% | 0.487 | S | S | . | . | H | α-helix | trans | -55.3 | -47.9 | 176.9 | 178.8 | 166.7 | 174.6 | 161.8 | 0 | 110.8 | R327 K329 M333 H334 E335 | R327-K331 PolarHBondContact O-N 3.26Å; K329-K331 PolarHBondContact O-N 3.33Å; K331-M333 PolarHBondContact O-N 3.04Å; K331-M333 VanDerWaalsContact O-N 3.12Å; K331-H334 PolarHBondContact O-N 3.18Å; K331-E335 WeakPolarHBondContact CE-OE1 3.19Å; K331-E335 WeakPolarHBondContact CE-OE2 3.38Å; K331-E335 HydrophobicContact CG-CG 4.39Å; K331-E335 WeakPolarHBondContact CG-OE2 3.21Å; K331-E335 IonicContact NZ-OE1 3.16Å; K331-E335 PolarHBondContact NZ-OE1 3.14Å; K331-E335 IonicContact NZ-OE2 3.35Å; K331-E335 WeakPolarHBondContact O-CB 3.38Å; K331-E335 PolarHBondContact O-N 3.31Å |
| 332 | R | 85.9 | Confident | 74.1 | Confident | 160 Ų | 160 | 99.7 Ų | 99.7 | 60% | 0.604 | 51% | 0.512 | S | S | * | . | H | α-helix | trans | -70.8 | 1.9 | 176.7 | -66.5 | -176.8 | -61.2 | 114.5 | -4.1 | 115.8 | Q328 K329 E330 | Q328-R332 WeakPolarHBondContact O-CG 3.4Å; Q328-R332 PolarHBondContact O-N 2.78Å; Q328-R332 PolarHBondContact O-NE 2.97Å; Q328-R332 VanDerWaalsContact O-NE 3.13Å; K329-R332 PolarHBondContact O-N 2.95Å; E330-R332 VanDerWaalsContact C-N 3.31Å; E330-R332 PolarHBondContact O-N 3.48Å |
| 333 | M | 76.3 | Confident | 71.3 | Confident | 127 Ų | 127 | 104 Ų | 104 | 63% | 0.626 | 55% | 0.547 | S | S | * | . | H | α-helix | trans | -110.5 | -25.6 | 172.8 | -54.3 | -85.3 | 77.9 | 0 | 0 | 111.7 | K329 E330 K331 | K329-M333 HydrophobicContact CG-CG 4.46Å; K329-M333 VanDerWaalsContact O-CG 3.23Å; K329-M333 WeakPolarHBondContact O-CG 3.37Å; K329-M333 PolarHBondContact O-N 2.82Å; E330-M333 PolarHBondContact O-N 2.71Å; K331-M333 PolarHBondContact O-N 3.04Å; K331-M333 VanDerWaalsContact O-N 3.12Å |
| 334 | H | 71.3 | Confident | 69 | Low | 153 Ų | 153 | 109 Ų | 109 | 71% | 0.708 | 59% | 0.588 | S | S | * | * | H | α-helix | trans | -88.1 | -32.3 | 173.4 | -68.3 | 83.5 | 0 | 0 | 0 | 112.4 | E330 K331 G336 | E330-H334 PolarHBondContact O-N 3.12Å; E330-H334 VanDerWaalsContact O-N 3.12Å; E330-H334 PolarHBondContact O-ND1 2.96Å; K331-H334 PolarHBondContact O-N 3.18Å; H334-G336 PolarHBondContact O-N 3.36Å |
| 335 | E | 60.9 | Low | 66.4 | Low | 119 Ų | 119 | 110.2 Ų | 110.2 | 56% | 0.556 | 61% | 0.608 | S | S | * | * | S | Bend | trans | -74.7 | 71.9 | 164.7 | -68.5 | 179 | 152.4 | 0 | 0 | 109.6 | K331 | K331-E335 WeakPolarHBondContact CE-OE1 3.19Å; K331-E335 WeakPolarHBondContact CE-OE2 3.38Å; K331-E335 HydrophobicContact CG-CG 4.39Å; K331-E335 WeakPolarHBondContact CG-OE2 3.21Å; K331-E335 IonicContact NZ-OE1 3.16Å; K331-E335 PolarHBondContact NZ-OE1 3.14Å; K331-E335 IonicContact NZ-OE2 3.35Å; K331-E335 WeakPolarHBondContact O-CB 3.38Å; K331-E335 PolarHBondContact O-N 3.31Å |
| 336 | G | 48.1 | Very low | 63.6 | Low | 36 Ų | 36 | 112.7 Ų | 112.7 | 37% | 0.371 | 62% | 0.621 | S | S | . | * | trans | -70.2 | 166.3 | 170.4 | 0 | 0 | 0 | 0 | 0 | 112.1 | H334 Y338 | H334-G336 PolarHBondContact O-N 3.36Å; G336-Y338 PolarHBondContact O-N 3.36Å | ||
| 337 | P | 55.4 | Low | 61.2 | Low | 125 Ų | 125 | 117.2 Ų | 117.2 | 81% | 0.812 | 65% | 0.654 | S | S | * | * | S | Bend | trans | -69.8 | 5.9 | -173.8 | 29 | -36 | 0 | 0 | 0 | 115.5 | ||
| 338 | Y | 49.3 | Very low | 58.7 | Low | 211 Ų | 211 | 117.6 Ų | 117.6 | 83% | 0.827 | 67% | 0.669 | S | S | * | * | trans | -112.6 | 48.2 | -175.1 | -69.1 | -76.3 | 0 | 0 | 0 | 112.4 | G336 | G336-Y338 PolarHBondContact O-N 3.36Š| ||
| 339 | S | 46.5 | Very low | 56.2 | Low | 91 Ų | 91 | 116.9 Ų | 116.9 | 64% | 0.636 | 68% | 0.677 | S | S | * | * | trans | -147.5 | 40.7 | 178.7 | -60.6 | 0 | 0 | 0 | 0 | 113.1 | ||||
| 340 | H | 47.7 | Very low | 53.9 | Low | 202 Ų | 202 | 118 Ų | 118 | 94% | 0.935 | 70% | 0.697 | S | S | * | * | trans | -134.5 | 59.5 | 169.6 | -91.5 | 49.4 | 0 | 0 | 0 | 109.9 | ||||
| 341 | S | 41.2 | Very low | 51.6 | Low | 108 Ų | 108 | 123.6 Ų | 123.6 | 76% | 0.755 | 72% | 0.723 | S | S | * | * | S | Bend | trans | -140.5 | 110 | 177.6 | 57.4 | 0 | 0 | 0 | 0 | 111.1 | ||
| 342 | G | 42.6 | Very low | 49.3 | Very low | 82 Ų | 82 | 125.1 Ų | 125.1 | 85% | 0.845 | 74% | 0.737 | S | S | * | * | trans | 69.2 | 90.5 | 159.1 | 0 | 0 | 0 | 0 | 0 | 117.6 | ||||
| 343 | S | 38.1 | Very low | 47 | Very low | 122 Ų | 122 | 128.7 Ų | 128.7 | 85% | 0.853 | 77% | 0.767 | S | S | * | * | trans | -143.2 | 65.2 | 147.8 | -166.9 | 0 | 0 | 0 | 0 | 109.8 | G345 | S343-G345 PolarHBondContact O-N 3.39Š| ||
| 344 | A | 47.8 | Very low | 45.6 | Very low | 107 Ų | 107 | 128.8 Ų | 128.8 | 88% | 0.884 | 77% | 0.774 | S | S | * | * | trans | -75.7 | 83.4 | 166.7 | 0 | 0 | 0 | 0 | 0 | 108 | D346 | A344-D346 PolarHBondContact O-N 3.46Š| ||
| 345 | G | 40.1 | Very low | 44.2 | Very low | 62 Ų | 62 | 127.5 Ų | 127.5 | 64% | 0.639 | 78% | 0.778 | S | S | * | * | trans | -75.1 | 87.9 | -179 | 0 | 0 | 0 | 0 | 0 | 112.1 | S343 | S343-G345 PolarHBondContact O-N 3.39Š| ||
| 346 | D | 37.1 | Very low | 43.3 | Very low | 128 Ų | 128 | 128 Ų | 128 | 68% | 0.684 | 79% | 0.79 | S | S | * | * | trans | 8.7 | 108.7 | 153.2 | -155.6 | -38.5 | 0 | 0 | 0 | 117 | A344 S348 | A344-D346 PolarHBondContact O-N 3.46Å; D346-S348 VanDerWaalsContact OD1-CB 3.24Å; D346-S348 WeakPolarHBondContact OD1-CB 2.76Å; D346-S348 PolarHBondContact OD1-N 3Å; D346-S348 PolarHBondContact OD1-OG 2.92Å | ||
| 347 | T | 42.6 | Very low | 43 | Very low | 140 Ų | 140 | 133.4 Ų | 133.4 | 86% | 0.859 | 82% | 0.815 | S | S | * | * | trans | -100.7 | 53.8 | 168.7 | 60.3 | 0 | 0 | 0 | 0 | 111.3 | S349 | T347-S349 PolarHBondContact O-N 3.09Š| ||
| 348 | S | 42.8 | Very low | 42.2 | Very low | 94 Ų | 94 | 133.9 Ų | 133.9 | 66% | 0.657 | 82% | 0.815 | S | S | * | * | trans | -59.1 | 126 | 171.7 | -77.8 | 0 | 0 | 0 | 0 | 111.1 | D346 | D346-S348 VanDerWaalsContact OD1-CB 3.24Å; D346-S348 WeakPolarHBondContact OD1-CB 2.76Å; D346-S348 PolarHBondContact OD1-N 3Å; D346-S348 PolarHBondContact OD1-OG 2.92Å | ||
| 349 | S | 37.1 | Very low | 41.7 | Very low | 99 Ų | 99 | 128.8 Ų | 128.8 | 69% | 0.692 | 81% | 0.814 | S | S | * | * | trans | -79.1 | 127.5 | -176.7 | -177.6 | 0 | 0 | 0 | 0 | 111.4 | T347 | T347-S349 PolarHBondContact O-N 3.09Š| ||
| 350 | C | 43.1 | Very low | 41.4 | Very low | 134 Ų | 134 | 131.5 Ų | 131.5 | 91% | 0.905 | 83% | 0.827 | S | S | * | * | trans | -91.1 | 107.6 | 160.1 | -66.2 | 0 | 0 | 0 | 0 | 108.7 | ||||
| 351 | H | 41.8 | Very low | 40.9 | Very low | 171 Ų | 171 | 126.1 Ų | 126.1 | 79% | 0.792 | 82% | 0.818 | S | S | * | * | trans | -118.5 | 108.6 | 167.3 | -118.1 | -72.5 | 0 | 0 | 0 | 107.9 | ||||
| 352 | D | 39.5 | Very low | 40.9 | Very low | 156 Ų | 156 | 127.6 Ų | 127.6 | 83% | 0.834 | 82% | 0.823 | S | S | * | * | trans | -152.8 | 137.8 | 169.2 | -151.3 | -49.2 | 0 | 0 | 0 | 107.9 | ||||
| 353 | L | 38.4 | Very low | 40.8 | Very low | 236 Ų | 236 | 131.7 Ų | 131.7 | 100% | 1.236 | 82% | 0.822 | S | S | * | * | trans | 90.7 | 0 | -158.8 | -58.1 | 173.4 | 0 | 0 | 0 | 116.6 |
Retrieved 353 of 353 residues in 336.3 ms
(Link to these results)