| Site | Residue | pLDDT | pLDDT confidence | pLDDT10 | pLDDT10 confidence | SASA | SASA [Ų] | SASA10 | SASA10 [Ų] | RSA | RSA unformatted | RSA10 | RSA10 unformatted | Surface | Surface10 (not used) | Disorder (not used) | Disorder | Sec. str. | Secondary structure | Isomer | Phi (φ) | Psi (ψ) | Omega (ω) | Chi 1 (χ1) | Chi 2 (χ2) | Chi 3 (χ3) | Chi 4 (χ4) | Chi 5 (χ5) | Tau (τ) | Contacts (colored by PAE) | Contact details |
|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|
| 1 | M | 38.9 | Very low | 38.1 | Very low | 247 Ų | 247 | 138 Ų | 138 | 100% | 1.217 | 82% | 0.816 | S | S | * | * | 0 | 141.5 | 0 | -60.4 | 165.2 | 175.2 | 0 | 0 | 107.9 | |||||
| 2 | A | 37.7 | Very low | 37.7 | Very low | 86 Ų | 86 | 135.5 Ų | 135.5 | 71% | 0.711 | 81% | 0.811 | S | S | * | * | cis | -169.6 | 128.9 | -32.2 | 0 | 0 | 0 | 0 | 0 | 107 | ||||
| 3 | T | 36 | Very low | 37.3 | Very low | 131 Ų | 131 | 136.7 Ų | 136.7 | 80% | 0.804 | 81% | 0.811 | S | S | * | * | trans | 23.6 | 119.7 | 155.8 | 55.7 | 0 | 0 | 0 | 0 | 119.3 | ||||
| 4 | A | 36.1 | Very low | 37.2 | Very low | 99 Ų | 99 | 134 Ų | 134 | 82% | 0.818 | 80% | 0.802 | S | S | * | * | cis | 58.2 | 135.1 | 47.1 | 0 | 0 | 0 | 0 | 0 | 114 | ||||
| 5 | A | 33.7 | Very low | 37.1 | Very low | 87 Ų | 87 | 136.1 Ų | 136.1 | 72% | 0.719 | 81% | 0.805 | S | S | * | * | cis | -162.9 | 168.8 | -10.1 | 0 | 0 | 0 | 0 | 0 | 111.9 | ||||
| 6 | S | 34.6 | Very low | 37.2 | Very low | 107 Ų | 107 | 137.4 Ų | 137.4 | 75% | 0.748 | 81% | 0.807 | S | S | * | * | trans | 20.1 | 116.1 | 151.7 | 60.5 | 0 | 0 | 0 | 0 | 123.5 | ||||
| 7 | N | 29 | Very low | 36.7 | Very low | 155 Ų | 155 | 136.7 Ų | 136.7 | 83% | 0.829 | 81% | 0.811 | S | S | * | * | 62.6 | -169.6 | 114.4 | -136.8 | 21.5 | 0 | 0 | 0 | 119.1 | |||||
| 8 | P | 53.8 | Low | 36.7 | Very low | 96 Ų | 96 | 136.3 Ų | 136.3 | 62% | 0.623 | 82% | 0.816 | S | S | * | * | -122.3 | 176.3 | -117.2 | 41.2 | -24.1 | 0 | 0 | 0 | 115.8 | |||||
| 9 | Y | 31.7 | Very low | 36.4 | Very low | 230 Ų | 230 | 133.4 Ų | 133.4 | 90% | 0.902 | 82% | 0.817 | S | S | * | * | trans | -141.6 | 123.5 | 166.5 | -92.3 | -81.4 | 0 | 0 | 0 | 114.8 | ||||
| 10 | L | 39.2 | Very low | 36.3 | Very low | 167 Ų | 167 | 132.6 Ų | 132.6 | 87% | 0.874 | 82% | 0.817 | S | S | * | * | trans | -139.3 | 148.8 | 150.3 | -70.4 | 179.8 | 0 | 0 | 0 | 104.5 | ||||
| 11 | P | 48.9 | Very low | 36.3 | Very low | 113 Ų | 113 | 133.7 Ų | 133.7 | 73% | 0.734 | 82% | 0.817 | S | S | * | * | -155.6 | -165.8 | 83.5 | 40.5 | -19.3 | 0 | 0 | 0 | 115.2 | |||||
| 12 | S | 33.2 | Very low | 36.2 | Very low | 108 Ų | 108 | 128 Ų | 128 | 76% | 0.755 | 80% | 0.795 | S | S | * | * | trans | 85.8 | 136.8 | 159.6 | -57.1 | 0 | 0 | 0 | 0 | 118.3 | ||||
| 13 | N | 31.8 | Very low | 35.8 | Very low | 151 Ų | 151 | 132.1 Ų | 132.1 | 81% | 0.807 | 80% | 0.8 | S | S | * | * | cis | -157.2 | 161.6 | -26.1 | -154.8 | 14.3 | 0 | 0 | 0 | 110.1 | ||||
| 14 | S | 35.5 | Very low | 35.9 | Very low | 99 Ų | 99 | 130.9 Ų | 130.9 | 69% | 0.692 | 80% | 0.796 | S | S | * | * | trans | -110.7 | 145.9 | 177.7 | 56.3 | 0 | 0 | 0 | 0 | 113 | ||||
| 15 | I | 36.3 | Very low | 35.7 | Very low | 165 Ų | 165 | 133 Ų | 133 | 85% | 0.846 | 79% | 0.794 | S | S | * | * | trans | -141.2 | 137.9 | 166.1 | -50.5 | -178.6 | 0 | 0 | 0 | 109.2 | ||||
| 16 | L | 38.7 | Very low | 35.8 | Very low | 158 Ų | 158 | 134 Ų | 134 | 83% | 0.827 | 80% | 0.796 | S | S | * | * | trans | -107.1 | 157.6 | 175.6 | -62.2 | 161 | 0 | 0 | 0 | 109.8 | ||||
| 17 | S | 29.5 | Very low | 35.6 | Very low | 125 Ų | 125 | 132.7 Ų | 132.7 | 87% | 0.874 | 80% | 0.799 | S | S | * | * | 171.8 | 153.8 | 125.6 | -80.2 | 0 | 0 | 0 | 0 | 114.4 | |||||
| 18 | S | 35.7 | Very low | 35.7 | Very low | 129 Ų | 129 | 129.5 Ų | 129.5 | 90% | 0.902 | 80% | 0.803 | S | S | * | * | trans | -86.4 | 160.5 | 166.7 | -48.4 | 0 | 0 | 0 | 0 | 111.3 | ||||
| 19 | G | 31.1 | Very low | 34.7 | Very low | 82 Ų | 82 | 128.8 Ų | 128.8 | 85% | 0.845 | 81% | 0.813 | S | S | * | * | trans | -174.4 | 133.4 | 168.9 | 0 | 0 | 0 | 0 | 0 | 114.4 | ||||
| 20 | S | 33.8 | Very low | 34.8 | Very low | 117 Ų | 117 | 121.4 Ų | 121.4 | 82% | 0.818 | 81% | 0.806 | S | S | * | * | trans | -148.6 | 127.1 | 172.9 | 169.7 | 0 | 0 | 0 | 0 | 108.7 | ||||
| 21 | I | 38 | Very low | 34.8 | Very low | 156 Ų | 156 | 122.9 Ų | 122.9 | 80% | 0.8 | 81% | 0.811 | S | S | * | * | trans | -171.4 | 141.5 | 166.7 | -114.9 | 160.7 | 0 | 0 | 0 | 114.4 | ||||
| 22 | V | 35.1 | Very low | 34.2 | Very low | 127 Ų | 127 | 126.5 Ų | 126.5 | 77% | 0.77 | 82% | 0.818 | S | S | * | * | trans | 43.9 | 128.5 | 163.5 | -52.6 | 0 | 0 | 0 | 0 | 121.4 | ||||
| 23 | H | 31.2 | Very low | 35.2 | Very low | 173 Ų | 173 | 126.6 Ų | 126.6 | 80% | 0.801 | 82% | 0.817 | S | S | * | * | cis | 82.7 | 144.2 | 46.2 | -152.3 | -81.9 | 0 | 0 | 0 | 116.6 | ||||
| 24 | S | 37.2 | Very low | 35.3 | Very low | 105 Ų | 105 | 122.5 Ų | 122.5 | 73% | 0.734 | 81% | 0.81 | S | S | * | * | trans | 85 | 146.7 | 175.6 | -47.5 | 0 | 0 | 0 | 0 | 116.1 | ||||
| 25 | D | 32.7 | Very low | 35.1 | Very low | 144 Ų | 144 | 123.9 Ų | 123.9 | 77% | 0.77 | 82% | 0.819 | S | S | * | * | cis | -147.2 | 165.3 | 7.8 | -173.2 | -140.9 | 0 | 0 | 0 | 114.7 | ||||
| 26 | S | 34.5 | Very low | 35.1 | Very low | 108 Ų | 108 | 120.3 Ų | 120.3 | 76% | 0.755 | 81% | 0.814 | S | S | * | * | trans | -15.7 | 158 | 169.1 | -56.8 | 0 | 0 | 0 | 0 | 124.4 | ||||
| 27 | G | 30.5 | Very low | 34.8 | Very low | 79 Ų | 79 | 117.3 Ų | 117.3 | 81% | 0.814 | 81% | 0.812 | S | S | * | * | trans | 170.5 | 50.5 | 156.8 | 0 | 0 | 0 | 0 | 0 | 123.3 | ||||
| 28 | G | 31.6 | Very low | 35.2 | Very low | 88 Ų | 88 | 118 Ų | 118 | 91% | 0.907 | 81% | 0.811 | S | S | * | * | trans | 74.1 | 171.7 | 165 | 0 | 0 | 0 | 0 | 0 | 117.6 | ||||
| 29 | G | 33 | Very low | 35.2 | Very low | 81 Ų | 81 | 118.1 Ų | 118.1 | 84% | 0.835 | 81% | 0.807 | S | S | * | * | cis | 174 | 141.7 | -8.2 | 0 | 0 | 0 | 0 | 0 | 113.2 | ||||
| 30 | G | 33.3 | Very low | 35.5 | Very low | 75 Ų | 75 | 119.5 Ų | 119.5 | 77% | 0.773 | 80% | 0.804 | S | S | * | * | trans | 81.9 | 161.5 | 177.5 | 0 | 0 | 0 | 0 | 0 | 115.7 | ||||
| 31 | M | 39.2 | Very low | 35.5 | Very low | 197 Ų | 197 | 116.8 Ų | 116.8 | 97% | 0.97 | 79% | 0.794 | S | S | * | * | cis | 176.8 | 157.6 | -41.9 | -100.9 | 167.6 | 83.8 | 0 | 0 | 107 | ||||
| 32 | Q | 36.7 | Very low | 35.3 | Very low | 189 Ų | 189 | 115.2 Ų | 115.2 | 88% | 0.883 | 80% | 0.797 | S | S | * | * | trans | -63.7 | -176.4 | -174.7 | -116.4 | -167.6 | -24 | 0 | 0 | 115.7 | ||||
| 33 | P | 54.7 | Low | 35.1 | Very low | 111 Ų | 111 | 112.2 Ų | 112.2 | 72% | 0.721 | 79% | 0.791 | S | S | * | * | cis | -140.6 | -177.8 | -10.9 | 38.1 | -18.7 | 0 | 0 | 0 | 116.8 | ||||
| 34 | G | 32.8 | Very low | 35.1 | Very low | 65 Ų | 65 | 107.3 Ų | 107.3 | 67% | 0.67 | 79% | 0.787 | S | S | * | * | 130.4 | 127.9 | 127.6 | 0 | 0 | 0 | 0 | 0 | 121.2 | |||||
| 35 | S | 32.7 | Very low | 35 | Very low | 127 Ų | 127 | 112.8 Ų | 112.8 | 89% | 0.888 | 79% | 0.794 | S | S | * | * | trans | 65.8 | 151.2 | 150.4 | -62.5 | 0 | 0 | 0 | 0 | 121.1 | ||||
| 36 | A | 35.4 | Very low | 35.3 | Very low | 90 Ų | 90 | 118.4 Ų | 118.4 | 74% | 0.744 | 80% | 0.804 | S | S | * | * | cis | -167.8 | 152.9 | -21.7 | 0 | 0 | 0 | 0 | 0 | 111.8 | ||||
| 37 | A | 33 | Very low | 35.1 | Very low | 95 Ų | 95 | 117.1 Ų | 117.1 | 79% | 0.785 | 81% | 0.808 | S | S | * | * | trans | 64.4 | 157.2 | 165.7 | 0 | 0 | 0 | 0 | 0 | 117.2 | ||||
| 38 | V | 36.4 | Very low | 35.2 | Very low | 139 Ų | 139 | 120.9 Ų | 120.9 | 84% | 0.842 | 81% | 0.809 | S | S | * | * | cis | -134.3 | 165.2 | 17.6 | -71.1 | 0 | 0 | 0 | 0 | 113.8 | ||||
| 39 | T | 36.4 | Very low | 36.3 | Very low | 133 Ų | 133 | 121.1 Ų | 121.1 | 82% | 0.816 | 80% | 0.795 | S | S | * | * | trans | -91 | 172.9 | 169.3 | 53 | 0 | 0 | 0 | 0 | 110.9 | ||||
| 40 | S | 37.5 | Very low | 36.3 | Very low | 111 Ų | 111 | 123.1 Ų | 123.1 | 78% | 0.776 | 79% | 0.791 | S | S | * | * | cis | -151.8 | -178.6 | 4 | -137 | 0 | 0 | 0 | 0 | 108.8 | ||||
| 41 | G | 32.7 | Very low | 36.5 | Very low | 59 Ų | 59 | 126.5 Ų | 126.5 | 61% | 0.608 | 80% | 0.797 | S | S | * | * | cis | -164.1 | 165.7 | 3.3 | 0 | 0 | 0 | 0 | 0 | 110.4 | ||||
| 42 | S | 34.1 | Very low | 36.4 | Very low | 124 Ų | 124 | 126.4 Ų | 126.4 | 87% | 0.867 | 79% | 0.791 | S | S | * | * | 60.1 | 114.6 | 96.6 | -56.9 | 0 | 0 | 0 | 0 | 114.4 | |||||
| 43 | G | 30.9 | Very low | 36.5 | Very low | 63 Ų | 63 | 125.8 Ų | 125.8 | 65% | 0.649 | 79% | 0.79 | S | S | * | * | cis | -173.7 | 176.4 | 0.1 | 0 | 0 | 0 | 0 | 0 | 111.6 | ||||
| 44 | G | 32.8 | Very low | 35.6 | Very low | 70 Ų | 70 | 126.7 Ų | 126.7 | 72% | 0.722 | 79% | 0.793 | S | S | * | * | trans | -135.7 | 161 | -178.3 | 0 | 0 | 0 | 0 | 0 | 113.2 | ||||
| 45 | Y | 33.8 | Very low | 35.5 | Very low | 221 Ų | 221 | 131 Ų | 131 | 87% | 0.867 | 80% | 0.796 | S | S | * | * | trans | -136.6 | 142 | -173.7 | -41.3 | -72.2 | 0 | 0 | 0 | 111.1 | ||||
| 46 | R | 38.4 | Very low | 35.5 | Very low | 261 Ų | 261 | 130.6 Ų | 130.6 | 99% | 0.985 | 79% | 0.793 | S | S | * | * | trans | -89.5 | 156.1 | 172.2 | -81.6 | 174.1 | 147.6 | -143.5 | -1.9 | 110.7 | ||||
| 47 | G | 30.4 | Very low | 35.4 | Very low | 82 Ų | 82 | 133.4 Ų | 133.4 | 85% | 0.845 | 80% | 0.796 | S | S | * | * | trans | -168.5 | 117.1 | 167.6 | 0 | 0 | 0 | 0 | 0 | 113.8 | ||||
| 48 | D | 33.5 | Very low | 35.6 | Very low | 157 Ų | 157 | 137.9 Ų | 137.9 | 84% | 0.84 | 80% | 0.798 | S | S | * | * | trans | -147.8 | 162.3 | 173.2 | -156.7 | 23.3 | 0 | 0 | 0 | 104.2 | ||||
| 49 | P | 53.9 | Low | 35.8 | Very low | 94 Ų | 94 | 138.6 Ų | 138.6 | 61% | 0.61 | 79% | 0.794 | S | S | * | * | cis | -139.8 | 177.7 | 3 | 42 | -22.6 | 0 | 0 | 0 | 117.2 | ||||
| 50 | T | 34.3 | Very low | 35.8 | Very low | 123 Ų | 123 | 140.2 Ų | 140.2 | 76% | 0.755 | 79% | 0.792 | S | S | * | * | trans | 41.8 | 126.2 | 147.6 | 55.8 | 0 | 0 | 0 | 0 | 123 | ||||
| 51 | V | 37 | Very low | 35.5 | Very low | 146 Ų | 146 | 137.9 Ų | 137.9 | 89% | 0.885 | 79% | 0.785 | S | S | * | * | trans | -137 | 149.4 | 142.4 | 180 | 0 | 0 | 0 | 0 | 109.3 | ||||
| 52 | K | 37.5 | Very low | 35.5 | Very low | 194 Ų | 194 | 140.3 Ų | 140.3 | 84% | 0.843 | 80% | 0.8 | S | S | * | * | trans | -121.9 | 140.8 | 175.6 | -67.1 | 178.9 | 177.9 | 178.2 | 0 | 111.6 | ||||
| 53 | M | 37.8 | Very low | 35.6 | Very low | 176 Ų | 176 | 142.4 Ų | 142.4 | 87% | 0.867 | 80% | 0.798 | S | S | * | * | trans | -163.5 | 130.8 | 151.8 | -99.1 | 156.2 | -165.7 | 0 | 0 | 106.4 | ||||
| 54 | V | 36.7 | Very low | 35.7 | Very low | 130 Ų | 130 | 144 Ų | 144 | 79% | 0.788 | 81% | 0.805 | S | S | * | * | 60 | 127.6 | 79.3 | 173.1 | 0 | 0 | 0 | 0 | 111.9 | |||||
| 55 | Q | 29.9 | Very low | 35.9 | Very low | 156 Ų | 156 | 145.6 Ų | 145.6 | 73% | 0.729 | 81% | 0.811 | S | S | * | * | cis | -173 | 144.8 | -15.3 | 169.2 | 174.5 | 1.8 | 0 | 0 | 107.2 | ||||
| 56 | S | 34.1 | Very low | 35.8 | Very low | 119 Ų | 119 | 140.4 Ų | 140.4 | 83% | 0.832 | 81% | 0.808 | S | S | * | * | trans | 169.4 | 137.7 | 145.8 | -79.6 | 0 | 0 | 0 | 0 | 112.3 | ||||
| 57 | D | 32.5 | Very low | 35.6 | Very low | 149 Ų | 149 | 136 Ų | 136 | 80% | 0.797 | 80% | 0.803 | S | S | * | * | trans | -82.6 | 130.3 | 178.3 | -57.6 | -110.1 | 0 | 0 | 0 | 112.8 | ||||
| 58 | F | 36.4 | Very low | 35.6 | Very low | 189 Ų | 189 | 135.7 Ų | 135.7 | 83% | 0.829 | 80% | 0.8 | S | S | * | * | trans | -155.3 | 114.7 | 141.1 | -157.2 | -105.5 | 0 | 0 | 0 | 113.2 | ||||
| 59 | M | 40.5 | Very low | 35.4 | Very low | 153 Ų | 153 | 131.4 Ų | 131.4 | 75% | 0.754 | 79% | 0.793 | S | S | * | * | trans | 31.8 | 93.3 | 162.2 | -64.1 | -172.9 | 68.1 | 0 | 0 | 119.5 | ||||
| 60 | Q | 36.8 | Very low | 34.5 | Very low | 167 Ų | 167 | 136.5 Ų | 136.5 | 78% | 0.78 | 81% | 0.808 | S | S | * | * | trans | -50.3 | 141.1 | 146 | -170.6 | 79.2 | -0.2 | 0 | 0 | 110.5 | ||||
| 61 | G | 31.5 | Very low | 34.6 | Very low | 62 Ų | 62 | 138.5 Ų | 138.5 | 64% | 0.639 | 81% | 0.811 | S | S | * | * | cis | 167.7 | 163 | -8.7 | 0 | 0 | 0 | 0 | 0 | 111.8 | ||||
| 62 | A | 32.4 | Very low | 34.7 | Very low | 110 Ų | 110 | 139.6 Ų | 139.6 | 91% | 0.909 | 81% | 0.811 | S | S | * | * | trans | -115.3 | 114.5 | 169 | 0 | 0 | 0 | 0 | 0 | 108.9 | ||||
| 63 | M | 35.8 | Very low | 34.3 | Very low | 168 Ų | 168 | 136.2 Ų | 136.2 | 83% | 0.828 | 81% | 0.812 | S | S | * | * | trans | -123.2 | 139.9 | -176.6 | 67.2 | -171.7 | -169.7 | 0 | 0 | 110 | ||||
| 64 | A | 33.5 | Very low | 34.2 | Very low | 98 Ų | 98 | 136.5 Ų | 136.5 | 81% | 0.81 | 81% | 0.811 | S | S | * | * | cis | -152.6 | 163.6 | -8.8 | 0 | 0 | 0 | 0 | 0 | 110 | ||||
| 65 | A | 37.3 | Very low | 34.1 | Very low | 102 Ų | 102 | 134.6 Ų | 134.6 | 84% | 0.843 | 81% | 0.809 | S | S | * | * | trans | -116.7 | 128.9 | 168.4 | 0 | 0 | 0 | 0 | 0 | 110.5 | ||||
| 66 | S | 31.3 | Very low | 34.5 | Very low | 113 Ų | 113 | 136.2 Ų | 136.2 | 79% | 0.79 | 82% | 0.816 | S | S | * | * | trans | -148.2 | 101.5 | 173.7 | 55.5 | 0 | 0 | 0 | 0 | 106.7 | ||||
| 67 | N | 33.9 | Very low | 34.4 | Very low | 167 Ų | 167 | 138.7 Ų | 138.7 | 89% | 0.893 | 81% | 0.814 | S | S | * | * | cis | 84.9 | 116.1 | 42.1 | -164.3 | 34.8 | 0 | 0 | 0 | 112.9 | ||||
| 68 | G | 31.6 | Very low | 34.5 | Very low | 76 Ų | 76 | 141.9 Ų | 141.9 | 78% | 0.784 | 82% | 0.815 | S | S | * | * | trans | 77.4 | 125.6 | -178.7 | 0 | 0 | 0 | 0 | 0 | 114.6 | ||||
| 69 | G | 29.8 | Very low | 34.3 | Very low | 67 Ų | 67 | 137.9 Ų | 137.9 | 69% | 0.691 | 81% | 0.806 | S | S | * | * | cis | 133.9 | 104.9 | -9.5 | 0 | 0 | 0 | 0 | 0 | 113.1 | ||||
| 70 | H | 34.6 | Very low | 34.5 | Very low | 201 Ų | 201 | 136.5 Ų | 136.5 | 93% | 0.931 | 81% | 0.806 | S | S | * | * | trans | -149.7 | 168 | 166.6 | -92.2 | -66.9 | 0 | 0 | 0 | 110.8 | ||||
| 71 | M | 36.8 | Very low | 34.2 | Very low | 166 Ų | 166 | 132.9 Ų | 132.9 | 82% | 0.818 | 80% | 0.799 | S | S | * | * | trans | -115.8 | 157 | -161.5 | -55 | 173.8 | 74.6 | 0 | 0 | 112.6 | ||||
| 72 | L | 38 | Very low | 34.2 | Very low | 169 Ų | 169 | 138.1 Ų | 138.1 | 89% | 0.885 | 81% | 0.812 | S | S | * | * | trans | 61.7 | 103.5 | 162.6 | -62.1 | 157.9 | 0 | 0 | 0 | 117.3 | ||||
| 73 | S | 30 | Very low | 34.7 | Very low | 122 Ų | 122 | 139 Ų | 139 | 85% | 0.853 | 81% | 0.808 | S | S | * | * | 174.2 | 168 | 113.6 | -162.1 | 0 | 0 | 0 | 0 | 112.6 | |||||
| 74 | H | 35.5 | Very low | 34.8 | Very low | 183 Ų | 183 | 140.2 Ų | 140.2 | 85% | 0.847 | 81% | 0.812 | S | S | * | * | trans | -36.6 | 167.5 | -175.8 | -86.8 | -8.3 | 0 | 0 | 0 | 122.3 | ||||
| 75 | A | 33.5 | Very low | 34.8 | Very low | 90 Ų | 90 | 139.8 Ų | 139.8 | 74% | 0.744 | 81% | 0.808 | S | S | * | * | trans | 93.9 | 122.8 | 152.9 | 0 | 0 | 0 | 0 | 0 | 118.2 | Q77 | A75-Q77 PolarHBondContact O-N 3.37Š| ||
| 76 | H | 38.3 | Very low | 34.7 | Very low | 189 Ų | 189 | 140.1 Ų | 140.1 | 88% | 0.875 | 81% | 0.811 | S | S | * | * | trans | -74.2 | 112.1 | 171.6 | -66.7 | -99.7 | 0 | 0 | 0 | 110.4 | W78 | H76-W78 PolarHBondContact O-N 3.24Š| ||
| 77 | Q | 33.2 | Very low | 34.8 | Very low | 172 Ų | 172 | 139.9 Ų | 139.9 | 80% | 0.804 | 82% | 0.815 | S | S | * | * | trans | -80.9 | 116.2 | 167 | -66.6 | -164 | 2.9 | 0 | 0 | 110.7 | A75 V79 | A75-Q77 PolarHBondContact O-N 3.37Å; Q77-V79 HydrophobicContact CB-CG2 4.26Å; Q77-V79 PolarHBondContact O-N 3.38Å | ||
| 78 | W | 34.9 | Very low | 34.7 | Very low | 216 Ų | 216 | 137 Ų | 137 | 82% | 0.818 | 82% | 0.815 | S | S | * | * | trans | -92.1 | 78 | 168.9 | 47.5 | -83 | 0 | 0 | 0 | 109.3 | H76 T80 | H76-W78 PolarHBondContact O-N 3.24Å; W78-T80 HydrophobicContact CE3-CG2 4.43Å; W78-T80 PolarHBondContact O-N 3.36Å | ||
| 79 | V | 32 | Very low | 34.9 | Very low | 105 Ų | 105 | 138.4 Ų | 138.4 | 64% | 0.636 | 82% | 0.819 | S | S | * | * | trans | -76 | 97 | 177.5 | 179.2 | 0 | 0 | 0 | 0 | 110 | Q77 S81 | Q77-V79 HydrophobicContact CB-CG2 4.26Å; Q77-V79 PolarHBondContact O-N 3.38Å; V79-S81 PolarHBondContact O-N 3.34Å | ||
| 80 | T | 43.2 | Very low | 35.1 | Very low | 123 Ų | 123 | 139.9 Ų | 139.9 | 76% | 0.755 | 83% | 0.825 | S | S | * | * | trans | -80.2 | 92.6 | 168.8 | 46.3 | 0 | 0 | 0 | 0 | 110.9 | W78 | W78-T80 HydrophobicContact CE3-CG2 4.43Å; W78-T80 PolarHBondContact O-N 3.36Å | ||
| 81 | S | 31.9 | Very low | 35.1 | Very low | 91 Ų | 91 | 135.5 Ų | 135.5 | 64% | 0.636 | 82% | 0.823 | S | S | * | * | trans | -156.9 | 105 | 164 | 59.2 | 0 | 0 | 0 | 0 | 112.1 | V79 | V79-S81 PolarHBondContact O-N 3.34Š| ||
| 82 | L | 31.2 | Very low | 34.9 | Very low | 173 Ų | 173 | 132.5 Ų | 132.5 | 91% | 0.906 | 83% | 0.825 | S | S | * | * | trans | -123.9 | 129.6 | 158.8 | -130.8 | 73.8 | 0 | 0 | 0 | 107.2 | ||||
| 83 | P | 42.3 | Very low | 34.5 | Very low | 127 Ų | 127 | 129 Ų | 129 | 83% | 0.825 | 82% | 0.82 | S | S | * | * | trans | -77 | 149.6 | -167.9 | 30.2 | -35.7 | 0 | 0 | 0 | 113.1 | ||||
| 84 | H | 38.5 | Very low | 34.6 | Very low | 195 Ų | 195 | 130.3 Ų | 130.3 | 90% | 0.903 | 82% | 0.823 | S | S | * | * | trans | -98.9 | 94.6 | 178.6 | -177.8 | 97.6 | 0 | 0 | 0 | 110.8 | ||||
| 85 | A | 33.7 | Very low | 34.5 | Very low | 88 Ų | 88 | 126.2 Ų | 126.2 | 73% | 0.727 | 82% | 0.821 | S | S | * | * | trans | -162.7 | 161.3 | 167.6 | 0 | 0 | 0 | 0 | 0 | 112 | ||||
| 86 | A | 34.9 | Very low | 34.6 | Very low | 110 Ų | 110 | 126.6 Ų | 126.6 | 91% | 0.909 | 82% | 0.824 | S | S | * | * | S | Bend | trans | 65 | 52.6 | 161.6 | 0 | 0 | 0 | 0 | 0 | 119 | ||
| 87 | A | 32.9 | Very low | 34.3 | Very low | 107 Ų | 107 | 122.4 Ų | 122.4 | 88% | 0.884 | 82% | 0.822 | S | S | * | * | trans | -149.9 | 36.2 | 161.7 | 0 | 0 | 0 | 0 | 0 | 114.2 | ||||
| 88 | A | 32.9 | Very low | 34.2 | Very low | 106 Ų | 106 | 123.4 Ų | 123.4 | 88% | 0.876 | 83% | 0.827 | S | S | * | * | trans | -137.2 | 66.9 | -175 | 0 | 0 | 0 | 0 | 0 | 112.2 | ||||
| 89 | A | 35 | Very low | 34.1 | Very low | 106 Ų | 106 | 117.6 Ų | 117.6 | 88% | 0.876 | 83% | 0.825 | S | S | * | * | trans | -151.6 | 54.2 | -175.4 | 0 | 0 | 0 | 0 | 0 | 113.9 | ||||
| 90 | A | 33.8 | Very low | 34 | Very low | 99 Ų | 99 | 116.1 Ų | 116.1 | 82% | 0.818 | 83% | 0.831 | S | S | * | * | S | Bend | trans | -158.1 | 149 | 165.8 | 0 | 0 | 0 | 0 | 0 | 112.4 | ||
| 91 | A | 34.8 | Very low | 33.3 | Very low | 108 Ų | 108 | 115.8 Ų | 115.8 | 89% | 0.893 | 83% | 0.833 | S | S | * | * | S | Bend | trans | 60.6 | 64.1 | 161.3 | 0 | 0 | 0 | 0 | 0 | 119.3 | ||
| 92 | A | 31.8 | Very low | 33.9 | Very low | 103 Ų | 103 | 116.7 Ų | 116.7 | 85% | 0.851 | 84% | 0.837 | S | S | * | * | trans | -155.2 | 65.9 | 158.5 | 0 | 0 | 0 | 0 | 0 | 112.8 | ||||
| 93 | A | 29.9 | Very low | 33.9 | Very low | 96 Ų | 96 | 119.1 Ų | 119.1 | 79% | 0.793 | 84% | 0.835 | S | S | * | * | trans | -155.1 | 63.4 | -176 | 0 | 0 | 0 | 0 | 0 | 115.8 | ||||
| 94 | V | 32.3 | Very low | 33.3 | Very low | 149 Ų | 149 | 117.7 Ų | 117.7 | 90% | 0.903 | 83% | 0.827 | S | S | * | * | trans | -145.7 | 104.6 | 156.6 | -176.3 | 0 | 0 | 0 | 0 | 110.1 | ||||
| 95 | A | 34.3 | Very low | 32.8 | Very low | 98 Ų | 98 | 114 Ų | 114 | 81% | 0.81 | 82% | 0.824 | S | S | * | * | trans | 155.5 | 148.9 | 142.1 | 0 | 0 | 0 | 0 | 0 | 112.7 | ||||
| 96 | A | 33.8 | Very low | 32.7 | Very low | 97 Ų | 97 | 115.2 Ų | 115.2 | 80% | 0.802 | 83% | 0.827 | S | S | * | * | trans | 64.8 | 87.8 | 159.9 | 0 | 0 | 0 | 0 | 0 | 119.8 | ||||
| 97 | A | 33.6 | Very low | 33.6 | Very low | 101 Ų | 101 | 115.1 Ų | 115.1 | 84% | 0.835 | 82% | 0.817 | S | S | * | * | 69.3 | 108.7 | 125.9 | 0 | 0 | 0 | 0 | 0 | 121.2 | |||||
| 98 | E | 31.2 | Very low | 33.6 | Very low | 193 Ų | 193 | 117 Ų | 117 | 90% | 0.902 | 82% | 0.817 | S | S | * | * | trans | -69.4 | 166.3 | 135.7 | -43.8 | -170.9 | 99.2 | 0 | 0 | 109.5 | ||||
| 99 | A | 32.9 | Very low | 33.4 | Very low | 95 Ų | 95 | 115.2 Ų | 115.2 | 79% | 0.785 | 81% | 0.809 | S | S | * | * | cis | -154.5 | 171.2 | 10.1 | 0 | 0 | 0 | 0 | 0 | 111.5 | ||||
| 100 | G | 29.2 | Very low | 33.2 | Very low | 73 Ų | 73 | 119.2 Ų | 119.2 | 75% | 0.753 | 81% | 0.812 | S | S | * | * | trans | 84.8 | 74.9 | 137.5 | 0 | 0 | 0 | 0 | 0 | 120.4 | ||||
| 101 | S | 29.1 | Very low | 33.2 | Very low | 116 Ų | 116 | 121.8 Ų | 121.8 | 81% | 0.811 | 82% | 0.817 | S | S | * | * | -14.6 | 162 | 124.9 | -62.1 | 0 | 0 | 0 | 0 | 118.4 | |||||
| 102 | P | 43.7 | Very low | 33 | Very low | 111 Ų | 111 | 119.9 Ų | 119.9 | 72% | 0.721 | 81% | 0.808 | S | S | * | * | cis | -142.5 | -156.4 | -5.8 | 33 | -7.4 | 0 | 0 | 0 | 115.6 | ||||
| 103 | W | 30.6 | Very low | 33 | Very low | 224 Ų | 224 | 120.8 Ų | 120.8 | 85% | 0.848 | 81% | 0.808 | S | S | * | * | trans | -65 | 135.1 | -176.2 | 36.3 | -86.8 | 0 | 0 | 0 | 118 | ||||
| 104 | S | 29.5 | Very low | 34.1 | Very low | 96 Ų | 96 | 121.7 Ų | 121.7 | 67% | 0.671 | 81% | 0.806 | S | S | * | * | 156.9 | 147.4 | 116.7 | -90.5 | 0 | 0 | 0 | 0 | 117.7 | |||||
| 105 | S | 28.6 | Very low | 34 | Very low | 118 Ų | 118 | 121.6 Ų | 121.6 | 83% | 0.825 | 80% | 0.796 | S | S | * | * | trans | 56.7 | 121.8 | 146.2 | -57.4 | 0 | 0 | 0 | 0 | 123.4 | ||||
| 106 | S | 32 | Very low | 34 | Very low | 113 Ų | 113 | 123.9 Ų | 123.9 | 79% | 0.79 | 79% | 0.79 | S | S | * | * | trans | -75.7 | -179.8 | 153.4 | -38.5 | 0 | 0 | 0 | 0 | 111.2 | ||||
| 107 | P | 54.6 | Low | 34 | Very low | 109 Ų | 109 | 127.4 Ų | 127.4 | 71% | 0.708 | 79% | 0.79 | S | S | * | * | cis | -140.1 | -155.3 | 10.7 | 41.4 | -18.8 | 0 | 0 | 0 | 115.3 | ||||
| 108 | V | 31.5 | Very low | 33.8 | Very low | 145 Ų | 145 | 129.2 Ų | 129.2 | 88% | 0.879 | 79% | 0.786 | S | S | * | * | trans | 76.8 | 140.2 | 175.2 | -35.7 | 0 | 0 | 0 | 0 | 117.5 | ||||
| 109 | G | 28.8 | Very low | 34.1 | Very low | 69 Ų | 69 | 126.8 Ų | 126.8 | 71% | 0.711 | 78% | 0.783 | S | S | * | * | cis | 171.3 | 166.8 | -12.2 | 0 | 0 | 0 | 0 | 0 | 115.9 | ||||
| 110 | M | 30.6 | Very low | 34.2 | Very low | 190 Ų | 190 | 129.8 Ų | 129.8 | 94% | 0.936 | 78% | 0.779 | S | S | * | * | trans | 74 | 149.2 | 161.8 | -61.4 | 177.8 | 65.3 | 0 | 0 | 121.1 | ||||
| 111 | T | 33.9 | Very low | 34 | Very low | 153 Ų | 153 | 131.5 Ų | 131.5 | 94% | 0.939 | 78% | 0.779 | S | S | * | * | trans | 68.2 | 133.7 | 176 | -137.5 | 0 | 0 | 0 | 0 | 117.5 | ||||
| 112 | G | 31.1 | Very low | 34.1 | Very low | 68 Ų | 68 | 130.5 Ų | 130.5 | 70% | 0.701 | 77% | 0.772 | S | S | * | * | cis | -166.2 | 157.6 | -4.6 | 0 | 0 | 0 | 0 | 0 | 113.1 | ||||
| 113 | S | 32.2 | Very low | 33.6 | Very low | 122 Ų | 122 | 129.3 Ų | 129.3 | 85% | 0.853 | 77% | 0.772 | S | S | * | * | trans | -99.8 | 174.7 | 178.7 | -59.5 | 0 | 0 | 0 | 0 | 110.6 | ||||
| 114 | P | 51.8 | Low | 33.9 | Very low | 115 Ų | 115 | 129.4 Ų | 129.4 | 75% | 0.747 | 77% | 0.772 | S | S | * | * | cis | -142.6 | -178.7 | 15.3 | 39.9 | -18.8 | 0 | 0 | 0 | 117.5 | ||||
| 115 | Q | 31.6 | Very low | 34.1 | Very low | 148 Ų | 148 | 130.4 Ų | 130.4 | 69% | 0.692 | 77% | 0.77 | S | S | * | * | 145.4 | 113 | 113.9 | -171.2 | 160.3 | -19.9 | 0 | 0 | 116.5 | |||||
| 116 | Q | 33.1 | Very low | 34.3 | Very low | 146 Ų | 146 | 131.6 Ų | 131.6 | 68% | 0.682 | 77% | 0.767 | S | S | * | * | trans | 64.1 | 153.7 | 154.1 | -70.9 | 167 | -26.3 | 0 | 0 | 118.6 | ||||
| 117 | Q | 34.3 | Very low | 34.7 | Very low | 170 Ų | 170 | 132 Ų | 132 | 79% | 0.794 | 76% | 0.76 | S | S | * | * | cis | -150.8 | 173.2 | 3.3 | -136.8 | 161 | 4.3 | 0 | 0 | 113.3 | ||||
| 118 | D | 30.3 | Very low | 33.9 | Very low | 140 Ų | 140 | 134.1 Ų | 134.1 | 75% | 0.749 | 76% | 0.76 | S | S | * | * | trans | -56.5 | 168.9 | 173.3 | -106.4 | -96.9 | 0 | 0 | 0 | 114.6 | ||||
| 119 | V | 36.2 | Very low | 34 | Very low | 141 Ų | 141 | 133.8 Ų | 133.8 | 86% | 0.855 | 76% | 0.759 | S | S | * | * | cis | -146.4 | 162 | 45.7 | 177.7 | 0 | 0 | 0 | 0 | 112.9 | ||||
| 120 | K | 35.1 | Very low | 34.1 | Very low | 158 Ų | 158 | 133.5 Ų | 133.5 | 69% | 0.687 | 76% | 0.755 | S | S | * | * | trans | -121 | 150.5 | -174 | 147.8 | -171.3 | 172.3 | -174.5 | 0 | 114.2 | ||||
| 121 | S | 26.4 | Very low | 34.2 | Very low | 110 Ų | 110 | 131.7 Ų | 131.7 | 77% | 0.769 | 76% | 0.755 | S | S | * | * | trans | 177 | 142.4 | 144.6 | -80.5 | 0 | 0 | 0 | 0 | 109.8 | ||||
| 122 | S | 30.3 | Very low | 34.1 | Very low | 95 Ų | 95 | 129.2 Ų | 129.2 | 66% | 0.664 | 75% | 0.75 | S | S | * | * | cis | 75.8 | 139.6 | 25.4 | -50.7 | 0 | 0 | 0 | 0 | 114.9 | ||||
| 123 | A | 33.3 | Very low | 34.3 | Very low | 86 Ų | 86 | 133.1 Ų | 133.1 | 71% | 0.711 | 75% | 0.754 | S | S | * | * | cis | -172.1 | -175.3 | -16.2 | 0 | 0 | 0 | 0 | 0 | 108.8 | ||||
| 124 | R | 36.4 | Very low | 34.3 | Very low | 225 Ų | 225 | 134.5 Ų | 134.5 | 85% | 0.849 | 75% | 0.747 | S | S | * | * | trans | 79.3 | 162.2 | 160.5 | -54.1 | -157.7 | 148.3 | 130.1 | -0.8 | 119.7 | ||||
| 125 | D | 34.3 | Very low | 33.4 | Very low | 117 Ų | 117 | 137.2 Ų | 137.2 | 63% | 0.626 | 75% | 0.749 | S | S | * | * | cis | -170.8 | 160.8 | -34.7 | -86.8 | -31.8 | 0 | 0 | 0 | 108.6 | ||||
| 126 | D | 32.9 | Very low | 33.3 | Very low | 143 Ų | 143 | 141 Ų | 141 | 77% | 0.765 | 76% | 0.757 | S | S | * | * | trans | 63.2 | 157.6 | 149 | -79.7 | -40.1 | 0 | 0 | 0 | 122.3 | ||||
| 127 | L | 40 | Very low | 34.3 | Very low | 122 Ų | 122 | 138.8 Ų | 138.8 | 64% | 0.639 | 76% | 0.755 | S | S | * | * | cis | -171.6 | 172.4 | -13.9 | -174.6 | 56 | 0 | 0 | 0 | 112 | ||||
| 128 | H | 38.4 | Very low | 35.4 | Very low | 153 Ų | 153 | 135.6 Ų | 135.6 | 71% | 0.708 | 75% | 0.749 | S | S | * | * | trans | 79.2 | 147.2 | 169.1 | -52.2 | 112.9 | 0 | 0 | 0 | 118.1 | ||||
| 129 | T | 33.1 | Very low | 35.7 | Very low | 139 Ų | 139 | 137.3 Ų | 137.3 | 85% | 0.853 | 75% | 0.752 | S | S | * | * | cis | 102.1 | 129.6 | 13.9 | -60.9 | 0 | 0 | 0 | 0 | 114.8 | ||||
| 130 | G | 31.3 | Very low | 35.6 | Very low | 62 Ų | 62 | 138.9 Ų | 138.9 | 64% | 0.639 | 76% | 0.755 | S | S | * | * | cis | 166.9 | -175.1 | -5.9 | 0 | 0 | 0 | 0 | 0 | 115.4 | ||||
| 131 | T | 32.2 | Very low | 35.5 | Very low | 153 Ų | 153 | 135.8 Ų | 135.8 | 94% | 0.939 | 76% | 0.759 | S | S | * | * | trans | 74.5 | 151.2 | 168.2 | 22.1 | 0 | 0 | 0 | 0 | 123.8 | ||||
| 132 | A | 31.6 | Very low | 36.7 | Very low | 100 Ų | 100 | 135.7 Ų | 135.7 | 83% | 0.826 | 76% | 0.756 | S | S | * | * | trans | 105 | 139.1 | 147.5 | 0 | 0 | 0 | 0 | 0 | 123.3 | ||||
| 133 | L | 34.6 | Very low | 36.9 | Very low | 150 Ų | 150 | 140.4 Ų | 140.4 | 79% | 0.785 | 77% | 0.767 | S | S | * | * | trans | -60.9 | 166 | -176.4 | -66.7 | 131.6 | 0 | 0 | 0 | 117.7 | ||||
| 134 | H | 33.1 | Very low | 37 | Very low | 152 Ų | 152 | 144.6 Ų | 144.6 | 70% | 0.704 | 77% | 0.771 | S | S | * | * | 169.5 | 142.3 | 107.5 | -98 | -91.5 | 0 | 0 | 0 | 117.3 | |||||
| 135 | H | 33.2 | Very low | 36.9 | Very low | 172 Ų | 172 | 140.2 Ų | 140.2 | 80% | 0.796 | 77% | 0.77 | S | S | * | * | trans | 71.6 | 160.7 | 153.7 | -64.2 | -52.6 | 0 | 0 | 0 | 124.9 | ||||
| 136 | R | 30.1 | Very low | 37 | Very low | 228 Ų | 228 | 142.8 Ų | 142.8 | 86% | 0.86 | 78% | 0.777 | S | S | * | * | trans | -167.6 | 168.9 | -168.8 | -166.7 | -145.1 | 160.7 | 170.5 | -6.7 | 109.3 | ||||
| 137 | P | 52.5 | Low | 36.8 | Very low | 99 Ų | 99 | 140.7 Ų | 140.7 | 64% | 0.643 | 78% | 0.78 | S | S | * | * | -90.5 | -110.1 | -77.8 | 38.2 | -19.5 | 0 | 0 | 0 | 108.5 | |||||
| 138 | P | 57.2 | Low | 36.4 | Very low | 102 Ų | 102 | 138.7 Ų | 138.7 | 66% | 0.662 | 79% | 0.789 | S | S | * | * | cis | -116.4 | 160.3 | -23.5 | 39.7 | -26.6 | 0 | 0 | 0 | 115.5 | ||||
| 139 | H | 36.8 | Very low | 36 | Very low | 176 Ų | 176 | 136.2 Ų | 136.2 | 82% | 0.815 | 80% | 0.795 | S | S | * | * | -177 | 141.6 | 122 | 52.3 | -87.7 | 0 | 0 | 0 | 114.5 | |||||
| 140 | L | 35.7 | Very low | 36.5 | Very low | 175 Ų | 175 | 142.1 Ų | 142.1 | 92% | 0.916 | 80% | 0.802 | S | S | * | * | trans | 39 | 144.8 | 148.1 | -58.6 | 172.6 | 0 | 0 | 0 | 123.5 | ||||
| 141 | A | 31.5 | Very low | 36.4 | Very low | 93 Ų | 93 | 142.9 Ų | 142.9 | 77% | 0.769 | 81% | 0.809 | S | S | * | * | trans | -112.6 | -167.5 | 175.5 | 0 | 0 | 0 | 0 | 0 | 109.2 | ||||
| 142 | P | 51.3 | Low | 36.4 | Very low | 108 Ų | 108 | 141.6 Ų | 141.6 | 70% | 0.701 | 81% | 0.807 | S | S | * | * | cis | -136.5 | -179.8 | -0.9 | 43.7 | -27.1 | 0 | 0 | 0 | 115.5 | ||||
| 143 | H | 34.9 | Very low | 36.5 | Very low | 194 Ų | 194 | 143.4 Ų | 143.4 | 90% | 0.898 | 81% | 0.808 | S | S | * | * | trans | -161.1 | 163.5 | 142 | -100.7 | -67.3 | 0 | 0 | 0 | 111.1 | ||||
| 144 | H | 36.9 | Very low | 36.5 | Very low | 174 Ų | 174 | 143.2 Ų | 143.2 | 81% | 0.806 | 81% | 0.813 | S | S | * | * | trans | -85.5 | 152.2 | -170.5 | -78.7 | -156.9 | 0 | 0 | 0 | 114.7 | ||||
| 145 | T | 32.5 | Very low | 36.4 | Very low | 132 Ų | 132 | 140.8 Ų | 140.8 | 81% | 0.81 | 82% | 0.819 | S | S | * | * | -176.1 | 165.1 | 108.5 | 26.3 | 0 | 0 | 0 | 0 | 113.5 | |||||
| 146 | H | 36.3 | Very low | 36.3 | Very low | 171 Ų | 171 | 137.4 Ų | 137.4 | 79% | 0.792 | 82% | 0.821 | S | S | * | * | trans | -44.1 | 142.6 | -174.3 | -52.6 | -90.2 | 0 | 0 | 0 | 115.4 | ||||
| 147 | A | 30.4 | Very low | 36.6 | Very low | 99 Ų | 99 | 135.3 Ų | 135.3 | 82% | 0.818 | 82% | 0.821 | S | S | * | * | cis | 71.1 | 120.3 | 43.2 | 0 | 0 | 0 | 0 | 0 | 114 | ||||
| 148 | G | 31.6 | Very low | 35.8 | Very low | 80 Ų | 80 | 138 Ų | 138 | 83% | 0.825 | 83% | 0.828 | S | S | * | * | cis | -167.3 | 156.8 | -4.4 | 0 | 0 | 0 | 0 | 0 | 113 | ||||
| 149 | A | 30 | Very low | 34.5 | Very low | 101 Ų | 101 | 140.4 Ų | 140.4 | 84% | 0.835 | 84% | 0.835 | S | S | * | * | trans | -103.2 | 140.6 | -177.9 | 0 | 0 | 0 | 0 | 0 | 111.9 | G151 | A149-G151 PolarHBondContact O-N 3.03Š| ||
| 150 | W | 43.6 | Very low | 34.1 | Very low | 264 Ų | 264 | 136.7 Ų | 136.7 | 100% | 1 | 83% | 0.829 | S | S | * | * | trans | -79.3 | 104.4 | 172.8 | -73.5 | -7.5 | 0 | 0 | 0 | 111 | ||||
| 151 | G | 29 | Very low | 33.9 | Very low | 77 Ų | 77 | 135.9 Ų | 135.9 | 79% | 0.794 | 82% | 0.824 | S | S | * | * | trans | -72.8 | 150.1 | 166.6 | 0 | 0 | 0 | 0 | 0 | 111.8 | A149 | A149-G151 PolarHBondContact O-N 3.03Š| ||
| 152 | S | 31.4 | Very low | 33.9 | Very low | 127 Ų | 127 | 136.6 Ų | 136.6 | 89% | 0.888 | 82% | 0.823 | S | S | * | * | trans | -132.6 | 136.6 | 162.8 | -157.1 | 0 | 0 | 0 | 0 | 108.1 | ||||
| 153 | T | 33.2 | Very low | 32.8 | Very low | 138 Ų | 138 | 135 Ų | 135 | 85% | 0.847 | 83% | 0.827 | S | S | * | * | trans | -85.1 | 150.4 | -161.8 | 40.3 | 0 | 0 | 0 | 0 | 113.6 | ||||
| 154 | T | 34.7 | Very low | 32.5 | Very low | 146 Ų | 146 | 129.7 Ų | 129.7 | 90% | 0.896 | 82% | 0.824 | S | S | * | * | trans | -76.8 | 132.7 | 172.5 | 40.2 | 0 | 0 | 0 | 0 | 111.4 | ||||
| 155 | A | 31.7 | Very low | 32.2 | Very low | 100 Ų | 100 | 131 Ų | 131 | 83% | 0.826 | 83% | 0.831 | S | S | * | * | trans | -147.8 | 131.3 | 163.2 | 0 | 0 | 0 | 0 | 0 | 108.8 | ||||
| 156 | A | 31 | Very low | 32.3 | Very low | 102 Ų | 102 | 134.2 Ų | 134.2 | 84% | 0.843 | 84% | 0.836 | S | S | * | * | trans | -127.7 | 143.4 | -176.6 | 0 | 0 | 0 | 0 | 0 | 111.1 | ||||
| 157 | H | 36.3 | Very low | 32.2 | Very low | 184 Ų | 184 | 135.7 Ų | 135.7 | 85% | 0.852 | 84% | 0.844 | S | S | * | * | trans | -160.1 | 169.9 | 163.1 | 52 | -98.2 | 0 | 0 | 0 | 111.7 | ||||
| 158 | I | 35.3 | Very low | 32.4 | Very low | 156 Ų | 156 | 139.1 Ų | 139.1 | 80% | 0.8 | 84% | 0.843 | S | S | * | * | trans | -139.2 | 149.1 | -160.2 | -77.7 | 160.8 | 0 | 0 | 0 | 106.1 | ||||
| 159 | N | 31.4 | Very low | 32.4 | Very low | 152 Ų | 152 | 144.1 Ų | 144.1 | 81% | 0.813 | 85% | 0.845 | S | S | * | * | cis | -147.9 | -177.2 | 40.9 | -152.4 | -5.2 | 0 | 0 | 0 | 115.2 | ||||
| 160 | S | 27.4 | Very low | 32.6 | Very low | 98 Ų | 98 | 147.2 Ų | 147.2 | 69% | 0.685 | 84% | 0.842 | S | S | * | * | trans | -70.8 | 153.3 | 166.6 | -175.7 | 0 | 0 | 0 | 0 | 113.7 | ||||
| 161 | I | 32.5 | Very low | 31.9 | Very low | 157 Ų | 157 | 140.1 Ų | 140.1 | 81% | 0.805 | 83% | 0.833 | S | S | * | * | -163 | 175.8 | 118.5 | -136.3 | 159.5 | 0 | 0 | 0 | 113.3 | |||||
| 162 | S | 31.3 | Very low | 32.1 | Very low | 108 Ų | 108 | 143.6 Ų | 143.6 | 76% | 0.755 | 83% | 0.832 | S | S | * | * | trans | -58.6 | 166.5 | 177.7 | 47.5 | 0 | 0 | 0 | 0 | 115.6 | ||||
| 163 | G | 27.4 | Very low | 32.2 | Very low | 76 Ų | 76 | 145 Ų | 145 | 78% | 0.784 | 83% | 0.828 | S | S | * | * | cis | 151.7 | 168.4 | 0 | 0 | 0 | 0 | 0 | 0 | 111.4 | ||||
| 164 | G | 28.7 | Very low | 31.9 | Very low | 81 Ų | 81 | 149.4 Ų | 149.4 | 84% | 0.835 | 83% | 0.831 | S | S | * | * | trans | 111.7 | 136.9 | 165.8 | 0 | 0 | 0 | 0 | 0 | 118.5 | ||||
| 165 | Q | 30.6 | Very low | 31.9 | Very low | 203 Ų | 203 | 146.1 Ų | 146.1 | 95% | 0.949 | 81% | 0.814 | S | S | * | * | trans | 51.6 | 139.7 | 160.6 | -67.3 | -170.9 | -20.3 | 0 | 0 | 122.6 | ||||
| 166 | Q | 35.4 | Very low | 32.3 | Very low | 198 Ų | 198 | 149.1 Ų | 149.1 | 93% | 0.925 | 81% | 0.811 | S | S | * | * | trans | -116.4 | 152.3 | 166.6 | -61 | 170.4 | -68.9 | 0 | 0 | 108.7 | ||||
| 167 | Q | 33.3 | Very low | 33.3 | Very low | 202 Ų | 202 | 150 Ų | 150 | 94% | 0.944 | 81% | 0.808 | S | S | * | * | trans | -140.7 | 154.1 | 160.8 | -149.5 | 168.2 | 15 | 0 | 0 | 110 | ||||
| 168 | Q | 35.1 | Very low | 33.1 | Very low | 172 Ų | 172 | 145 Ų | 145 | 80% | 0.804 | 81% | 0.807 | S | S | * | * | trans | -143.5 | 116.6 | -151.5 | -175.9 | -174.6 | 24 | 0 | 0 | 113.2 | ||||
| 169 | Q | 31.4 | Very low | 33 | Very low | 184 Ų | 184 | 141.3 Ų | 141.3 | 86% | 0.86 | 81% | 0.807 | S | S | * | * | trans | -141.6 | 126.4 | 159 | -77.5 | 177.1 | -10 | 0 | 0 | 106.6 | ||||
| 170 | Q | 34.7 | Very low | 33.1 | Very low | 166 Ų | 166 | 143.9 Ų | 143.9 | 78% | 0.776 | 81% | 0.811 | S | S | * | * | 75.2 | 109 | 50.6 | -68.8 | -157.5 | 21.8 | 0 | 0 | 114.8 | |||||
| 171 | S | 28.1 | Very low | 33.6 | Very low | 115 Ų | 115 | 146.2 Ų | 146.2 | 80% | 0.804 | 82% | 0.822 | S | S | * | * | trans | -159.1 | 137.7 | 142.3 | 50.6 | 0 | 0 | 0 | 0 | 110.8 | ||||
| 172 | L | 33.1 | Very low | 34 | Very low | 151 Ų | 151 | 144.4 Ų | 144.4 | 79% | 0.791 | 82% | 0.818 | S | S | * | * | trans | -72.1 | 150.2 | 174.7 | -79.9 | 48.8 | 0 | 0 | 0 | 108.6 | ||||
| 173 | I | 33.5 | Very low | 34.1 | Very low | 157 Ų | 157 | 146.8 Ų | 146.8 | 81% | 0.805 | 82% | 0.822 | S | S | * | * | cis | 65 | 90.4 | 43.1 | -51.1 | -174.9 | 0 | 0 | 0 | 113.5 | ||||
| 174 | Y | 27.8 | Very low | 34.2 | Very low | 229 Ų | 229 | 146.7 Ų | 146.7 | 90% | 0.898 | 82% | 0.821 | S | S | * | * | trans | -104.4 | 161.4 | 157 | -171 | -96.2 | 0 | 0 | 0 | 109.1 | ||||
| 175 | S | 34.5 | Very low | 34.3 | Very low | 77 Ų | 77 | 150.7 Ų | 150.7 | 54% | 0.538 | 82% | 0.82 | S | S | . | * | trans | -150 | 172.3 | -161.9 | -164 | 0 | 0 | 0 | 0 | 114.3 | ||||
| 176 | Q | 40.5 | Very low | 34.4 | Very low | 164 Ų | 164 | 148.1 Ų | 148.1 | 77% | 0.766 | 81% | 0.812 | S | S | * | * | trans | 77.1 | 162.8 | 171.5 | -53.4 | -66.9 | 2 | 0 | 0 | 116 | ||||
| 177 | P | 50.9 | Low | 34.3 | Very low | 120 Ų | 120 | 144.1 Ų | 144.1 | 78% | 0.779 | 81% | 0.805 | S | S | * | * | -140.9 | 179.4 | -78.7 | 37.9 | -18.3 | 0 | 0 | 0 | 115.6 | |||||
| 178 | G | 32.8 | Very low | 34.8 | Very low | 80 Ų | 80 | 140.9 Ų | 140.9 | 83% | 0.825 | 80% | 0.802 | S | S | * | * | trans | 145.9 | 148.4 | 165.6 | 0 | 0 | 0 | 0 | 0 | 111.9 | ||||
| 179 | G | 31.9 | Very low | 34.6 | Very low | 78 Ų | 78 | 136.3 Ų | 136.3 | 80% | 0.804 | 80% | 0.801 | S | S | * | * | cis | 158.5 | 121.9 | -2 | 0 | 0 | 0 | 0 | 0 | 109.3 | ||||
| 180 | F | 34.2 | Very low | 34.7 | Very low | 206 Ų | 206 | 133.2 Ų | 133.2 | 90% | 0.904 | 80% | 0.8 | S | S | * | * | trans | -75 | 145.9 | -176.2 | -71.8 | -101.7 | 0 | 0 | 0 | 112.7 | ||||
| 181 | T | 39.2 | Very low | 34.7 | Very low | 147 Ų | 147 | 134.6 Ų | 134.6 | 90% | 0.902 | 81% | 0.806 | S | S | * | * | -162.5 | 160.4 | 125.1 | 26.9 | 0 | 0 | 0 | 0 | 110.9 | |||||
| 182 | V | 40.9 | Very low | 34.9 | Very low | 119 Ų | 119 | 133.5 Ų | 133.5 | 72% | 0.721 | 80% | 0.799 | S | S | * | * | trans | -117.5 | 148.8 | 176.3 | -72.3 | 0 | 0 | 0 | 0 | 110.3 | ||||
| 183 | N | 32.4 | Very low | 35 | Very low | 158 Ų | 158 | 134.3 Ų | 134.3 | 85% | 0.845 | 80% | 0.803 | S | S | * | * | 159.7 | 140.7 | 125.3 | -84 | -18.1 | 0 | 0 | 0 | 114.8 | |||||
| 184 | G | 29.2 | Very low | 35.2 | Very low | 74 Ų | 74 | 132.5 Ų | 132.5 | 76% | 0.763 | 80% | 0.799 | S | S | * | * | trans | 92.6 | 153.1 | 149.1 | 0 | 0 | 0 | 0 | 0 | 118.1 | ||||
| 185 | M | 31.2 | Very low | 35.4 | Very low | 164 Ų | 164 | 130.4 Ų | 130.4 | 81% | 0.808 | 80% | 0.797 | S | S | * | * | cis | -165.6 | 160 | -19.1 | -147.2 | 166.4 | 64.8 | 0 | 0 | 111 | ||||
| 186 | L | 32.5 | Very low | 35.7 | Very low | 150 Ų | 150 | 132.5 Ų | 132.5 | 79% | 0.785 | 81% | 0.809 | S | S | * | * | trans | 69.1 | 118.2 | 163.4 | -53.3 | 178.4 | 0 | 0 | 0 | 119.6 | ||||
| 187 | S | 32.4 | Very low | 35.3 | Very low | 113 Ų | 113 | 128.3 Ų | 128.3 | 79% | 0.79 | 81% | 0.81 | S | S | * | * | trans | -77.3 | 163.9 | 144.6 | -41.2 | 0 | 0 | 0 | 0 | 109.5 | ||||
| 188 | P | 44.8 | Very low | 34.6 | Very low | 134 Ų | 134 | 131.1 Ų | 131.1 | 87% | 0.87 | 82% | 0.817 | S | S | * | * | -150.9 | -174.6 | 80.4 | 41.1 | -23 | 0 | 0 | 0 | 114.6 | |||||
| 189 | G | 30.1 | Very low | 35 | Very low | 77 Ų | 77 | 133.9 Ų | 133.9 | 79% | 0.794 | 82% | 0.818 | S | S | * | * | trans | 118 | 86.5 | 152 | 0 | 0 | 0 | 0 | 0 | 116.9 | ||||
| 190 | S | 35.1 | Very low | 35 | Very low | 119 Ų | 119 | 142 Ų | 142 | 83% | 0.832 | 82% | 0.824 | S | S | * | * | trans | -77.6 | 139 | 159.1 | 53.6 | 0 | 0 | 0 | 0 | 111.6 | ||||
| 191 | Q | 33.8 | Very low | 34.9 | Very low | 194 Ų | 194 | 135.3 Ų | 135.3 | 91% | 0.907 | 81% | 0.813 | S | S | * | * | trans | -150 | 158.8 | 159.6 | -92.4 | -78.4 | 13.1 | 0 | 0 | 109.8 | ||||
| 192 | S | 31.3 | Very low | 34.5 | Very low | 92 Ų | 92 | 135.4 Ų | 135.4 | 64% | 0.643 | 81% | 0.808 | S | S | * | * | trans | -98.4 | 152.2 | -171 | -174.1 | 0 | 0 | 0 | 0 | 113.3 | ||||
| 193 | L | 35.4 | Very low | 34.3 | Very low | 169 Ų | 169 | 135.7 Ų | 135.7 | 89% | 0.885 | 81% | 0.81 | S | S | * | * | trans | -137.5 | 140 | 161.8 | -87.7 | 172.7 | 0 | 0 | 0 | 110.7 | ||||
| 194 | V | 37.9 | Very low | 35.5 | Very low | 119 Ų | 119 | 133.8 Ų | 133.8 | 72% | 0.721 | 81% | 0.807 | S | S | * | * | trans | -125.9 | 145.9 | -175.1 | -67.4 | 0 | 0 | 0 | 0 | 110.6 | ||||
| 195 | H | 32.3 | Very low | 35.6 | Very low | 185 Ų | 185 | 136.9 Ų | 136.9 | 86% | 0.856 | 81% | 0.806 | S | S | * | * | trans | -145.8 | 137.5 | 165.7 | -88.5 | -75.2 | 0 | 0 | 0 | 111.2 | ||||
| 196 | P | 41.9 | Very low | 36 | Very low | 121 Ų | 121 | 135.8 Ų | 135.8 | 79% | 0.786 | 80% | 0.802 | S | S | * | * | trans | -115 | 150.4 | -170 | 40.1 | -32.4 | 0 | 0 | 0 | 116.2 | ||||
| 197 | G | 30.3 | Very low | 35.8 | Very low | 76 Ų | 76 | 135.6 Ų | 135.6 | 78% | 0.784 | 80% | 0.797 | S | S | * | * | 76.9 | 130.4 | 128.1 | 0 | 0 | 0 | 0 | 0 | 121.6 | |||||
| 198 | L | 37.8 | Very low | 36.1 | Very low | 178 Ų | 178 | 138.2 Ų | 138.2 | 93% | 0.932 | 80% | 0.797 | S | S | * | * | trans | -158.4 | 158.4 | 143.3 | -109.8 | 173.9 | 0 | 0 | 0 | 109.8 | ||||
| 199 | V | 41.5 | Very low | 35.6 | Very low | 139 Ų | 139 | 135 Ų | 135 | 84% | 0.842 | 79% | 0.787 | S | S | * | * | trans | -135.1 | 128.9 | -163.4 | 177 | 0 | 0 | 0 | 0 | 113.9 | ||||
| 200 | R | 31 | Very low | 35.7 | Very low | 249 Ų | 249 | 135.9 Ų | 135.9 | 94% | 0.94 | 78% | 0.781 | S | S | * | * | trans | -176.9 | 149.2 | 158.2 | -123.4 | 172 | 169.8 | 156.8 | -3.5 | 107.9 | ||||
| 201 | G | 31.1 | Very low | 35.8 | Very low | 65 Ų | 65 | 137.8 Ų | 137.8 | 67% | 0.67 | 78% | 0.777 | S | S | * | * | cis | 165.5 | 152.4 | -7.4 | 0 | 0 | 0 | 0 | 0 | 110.4 | ||||
| 202 | D | 32 | Very low | 35.9 | Very low | 149 Ų | 149 | 135.6 Ų | 135.6 | 80% | 0.797 | 77% | 0.766 | S | S | * | * | trans | 76.3 | 113.6 | 169 | -94.4 | -72 | 0 | 0 | 0 | 122.8 | ||||
| 203 | T | 35.4 | Very low | 36.1 | Very low | 124 Ų | 124 | 138 Ų | 138 | 76% | 0.761 | 77% | 0.767 | S | S | * | * | trans | 57.4 | 150.9 | 134.1 | 43.3 | 0 | 0 | 0 | 0 | 124.8 | ||||
| 204 | P | 58.7 | Low | 36 | Very low | 119 Ų | 119 | 137.1 Ų | 137.1 | 77% | 0.773 | 76% | 0.758 | S | S | * | * | trans | -111.3 | 179 | -174.5 | 43.9 | -35 | 0 | 0 | 0 | 114.4 | ||||
| 205 | D | 31.1 | Very low | 36 | Very low | 139 Ų | 139 | 138.1 Ų | 138.1 | 74% | 0.743 | 76% | 0.755 | S | S | * | * | 173.6 | 162.8 | 117 | -158.9 | -166.4 | 0 | 0 | 0 | 113.6 | |||||
| 206 | L | 39.3 | Very low | 36.1 | Very low | 141 Ų | 141 | 136.1 Ų | 136.1 | 74% | 0.738 | 75% | 0.746 | S | S | * | * | trans | 61.7 | 165.7 | 164.4 | -52 | -177.9 | 0 | 0 | 0 | 120.9 | ||||
| 207 | E | 28.2 | Very low | 35.7 | Very low | 146 Ų | 146 | 138.6 Ų | 138.6 | 68% | 0.682 | 75% | 0.746 | S | S | * | * | -163.7 | 164.8 | -62.7 | -142.6 | -158.2 | 166.7 | 0 | 0 | 109.6 | |||||
| 208 | H | 39.7 | Very low | 35.9 | Very low | 168 Ų | 168 | 141 Ų | 141 | 78% | 0.778 | 74% | 0.737 | S | S | * | * | trans | 59 | 138.5 | 169.5 | -72.3 | 88.9 | 0 | 0 | 0 | 118.7 | ||||
| 209 | G | 32.7 | Very low | 35.7 | Very low | 65 Ų | 65 | 140.5 Ų | 140.5 | 67% | 0.67 | 73% | 0.73 | S | S | * | * | cis | 173 | 148.2 | -9.9 | 0 | 0 | 0 | 0 | 0 | 114.7 | ||||
| 210 | S | 33.6 | Very low | 36.1 | Very low | 96 Ų | 96 | 139 Ų | 139 | 67% | 0.671 | 72% | 0.723 | S | S | * | * | trans | 71.6 | 116.7 | 148.8 | -68.1 | 0 | 0 | 0 | 0 | 124.3 | ||||
| 211 | H | 37 | Very low | 36.6 | Very low | 160 Ų | 160 | 135.9 Ų | 135.9 | 74% | 0.741 | 72% | 0.719 | S | S | * | * | trans | 76.7 | 149.9 | 142 | -48.7 | -30.5 | 0 | 0 | 0 | 118.8 | ||||
| 212 | H | 36.2 | Very low | 36.9 | Very low | 147 Ų | 147 | 141.8 Ų | 141.8 | 68% | 0.681 | 73% | 0.728 | S | S | * | * | cis | -138.4 | 177.8 | 9.9 | -98.4 | -63.6 | 0 | 0 | 0 | 113 | ||||
| 213 | H | 34.8 | Very low | 37.2 | Very low | 142 Ų | 142 | 143.4 Ų | 143.4 | 66% | 0.657 | 73% | 0.731 | S | S | * | * | trans | -6.8 | 153 | 149.8 | -51.6 | -62.7 | 0 | 0 | 0 | 118.7 | ||||
| 214 | H | 33.7 | Very low | 37.2 | Very low | 151 Ų | 151 | 145.9 Ų | 145.9 | 70% | 0.699 | 73% | 0.733 | S | S | * | * | cis | -167.5 | 168.9 | 8.6 | -115.7 | -27.5 | 0 | 0 | 0 | 107.4 | ||||
| 215 | H | 37.4 | Very low | 36.2 | Very low | 141 Ų | 141 | 148.2 Ų | 148.2 | 65% | 0.653 | 73% | 0.734 | S | S | * | * | cis | -153.5 | 163.1 | -7 | -155.7 | -59.6 | 0 | 0 | 0 | 107.2 | ||||
| 216 | H | 33.9 | Very low | 36.3 | Very low | 143 Ų | 143 | 146.3 Ų | 146.3 | 66% | 0.662 | 74% | 0.737 | S | S | * | * | trans | -123.7 | 137.3 | 164.4 | -170.8 | 71.7 | 0 | 0 | 0 | 109.8 | Q218 | H216-Q218 PolarHBondContact CD2-NE2 3.05Å; H216-Q218 PolarHBondContact NE2-NE2 2.93Å | ||
| 217 | H | 35.2 | Very low | 36.6 | Very low | 173 Ų | 173 | 144.5 Ų | 144.5 | 80% | 0.801 | 74% | 0.742 | S | S | * | * | trans | -118.5 | 132.6 | -178.2 | -133.5 | 70.7 | 0 | 0 | 0 | 108.5 | ||||
| 218 | Q | 33.4 | Very low | 37.2 | Very low | 127 Ų | 127 | 144 Ų | 144 | 59% | 0.593 | 75% | 0.749 | S | S | * | * | trans | -128.4 | 162 | -177.3 | -71.7 | -169.8 | -6.8 | 0 | 0 | 111.7 | H216 | H216-Q218 PolarHBondContact CD2-NE2 3.05Å; H216-Q218 PolarHBondContact NE2-NE2 2.93Å | ||
| 219 | H | 34.6 | Very low | 37.7 | Very low | 167 Ų | 167 | 143.9 Ų | 143.9 | 77% | 0.773 | 75% | 0.754 | S | S | * | * | trans | 75 | 158.3 | 171.8 | -53.2 | -67 | 0 | 0 | 0 | 117.1 | ||||
| 220 | P | 49.3 | Very low | 37.9 | Very low | 107 Ų | 107 | 146 Ų | 146 | 70% | 0.695 | 76% | 0.759 | S | S | * | * | cis | -117 | 165.3 | -5.2 | 21.7 | -0.2 | 0 | 0 | 0 | 114.5 | ||||
| 221 | H | 40.6 | Very low | 38.2 | Very low | 184 Ų | 184 | 149.8 Ų | 149.8 | 85% | 0.852 | 77% | 0.765 | S | S | * | * | trans | -64.2 | 140.1 | 159.2 | -75.2 | -97.2 | 0 | 0 | 0 | 110.1 | ||||
| 222 | H | 38 | Very low | 38.1 | Very low | 188 Ų | 188 | 147.8 Ų | 147.8 | 87% | 0.87 | 76% | 0.76 | S | S | * | * | trans | -125.2 | 141.4 | 152.3 | -90.5 | 25.6 | 0 | 0 | 0 | 108.9 | ||||
| 223 | Q | 39.7 | Very low | 38.6 | Very low | 183 Ų | 183 | 145.8 Ų | 145.8 | 86% | 0.855 | 76% | 0.76 | S | S | * | * | trans | -122.6 | 122 | -172.5 | 175.2 | -178.3 | 29.6 | 0 | 0 | 107.4 | ||||
| 224 | H | 35.4 | Very low | 39.2 | Very low | 176 Ų | 176 | 147.6 Ų | 147.6 | 82% | 0.815 | 77% | 0.769 | S | S | * | * | trans | -159.1 | 117.4 | 166.4 | -109.1 | -162.4 | 0 | 0 | 0 | 112.4 | ||||
| 225 | H | 36 | Very low | 39.8 | Very low | 169 Ų | 169 | 145.1 Ų | 145.1 | 78% | 0.782 | 77% | 0.769 | S | S | * | * | trans | 28.9 | 147.5 | 143.6 | -60.7 | -76 | 0 | 0 | 0 | 124.8 | ||||
| 226 | A | 34.2 | Very low | 40.3 | Very low | 99 Ų | 99 | 146.3 Ų | 146.3 | 82% | 0.818 | 78% | 0.78 | S | S | * | * | trans | 86.4 | 133.4 | 148.2 | 0 | 0 | 0 | 0 | 0 | 117.9 | ||||
| 227 | A | 45.9 | Very low | 40.9 | Very low | 102 Ų | 102 | 145.3 Ų | 145.3 | 84% | 0.843 | 78% | 0.779 | S | S | * | * | trans | -87.8 | 134 | 176 | 0 | 0 | 0 | 0 | 0 | 110.7 | ||||
| 228 | V | 41.1 | Very low | 42.2 | Very low | 136 Ų | 136 | 144.8 Ų | 144.8 | 82% | 0.824 | 78% | 0.782 | S | S | * | * | trans | -133.4 | 135.3 | 156.4 | -86.6 | 0 | 0 | 0 | 0 | 108.8 | S230 | V228-S230 PolarHBondContact O-N 3.05Š| ||
| 229 | N | 48.8 | Very low | 43.6 | Very low | 166 Ų | 166 | 143.3 Ų | 143.3 | 89% | 0.888 | 78% | 0.782 | S | S | * | * | trans | -85.1 | 95.8 | -174 | -178.1 | 62.2 | 0 | 0 | 0 | 110.3 | ||||
| 230 | S | 36.3 | Very low | 45.4 | Very low | 108 Ų | 108 | 137 Ų | 137 | 76% | 0.755 | 76% | 0.756 | S | S | * | * | trans | -124.3 | 108.3 | 172.8 | -71 | 0 | 0 | 0 | 0 | 110.2 | V228 D232 | V228-S230 PolarHBondContact O-N 3.05Å; S230-D232 PolarHBondContact O-N 3.33Å | ||
| 231 | H | 41.8 | Very low | 47.1 | Very low | 176 Ų | 176 | 134.7 Ų | 134.7 | 82% | 0.815 | 74% | 0.74 | S | S | * | * | trans | -83.3 | 97.1 | 173.4 | -168.2 | 83.7 | 0 | 0 | 0 | 107.9 | P233 | H231-P233 WeakPolarHBondContact O-CD 3.44Š| ||
| 232 | D | 34.5 | Very low | 49.3 | Very low | 119 Ų | 119 | 129.7 Ų | 129.7 | 64% | 0.636 | 73% | 0.726 | S | S | * | * | trans | -76.3 | 119.4 | 177.6 | -167.6 | -58.4 | 0 | 0 | 0 | 110 | S230 H234 | S230-D232 PolarHBondContact O-N 3.33Å; D232-H234 WeakPolarHBondContact OD1-CB 3.46Å; D232-H234 IonicContact OD1-CD2 3.29Å; D232-H234 PolarHBondContact OD1-CD2 3.36Å; D232-H234 VanDerWaalsContact OD1-CD2 3.31Å; D232-H234 IonicContact OD1-CG 3.06Å; D232-H234 PolarHBondContact OD1-N 3.49Å | ||
| 233 | P | 47.1 | Very low | 51.8 | Low | 105 Ų | 105 | 125.8 Ų | 125.8 | 68% | 0.682 | 71% | 0.711 | S | S | * | * | trans | -103.6 | 34.3 | -175.6 | 41.1 | -32.4 | 0 | 0 | 0 | 112.5 | H231 S235 | H231-P233 WeakPolarHBondContact O-CD 3.44Å; P233-S235 PolarHBondContact O-N 3.37Å | ||
| 234 | H | 46.4 | Very low | 54.3 | Low | 179 Ų | 179 | 119.5 Ų | 119.5 | 83% | 0.829 | 68% | 0.684 | S | S | * | * | trans | -67.9 | 76.2 | 165 | -86.3 | -68.4 | 0 | 0 | 0 | 111.2 | D232 | D232-H234 WeakPolarHBondContact OD1-CB 3.46Å; D232-H234 IonicContact OD1-CD2 3.29Å; D232-H234 PolarHBondContact OD1-CD2 3.36Å; D232-H234 VanDerWaalsContact OD1-CD2 3.31Å; D232-H234 IonicContact OD1-CG 3.06Å; D232-H234 PolarHBondContact OD1-N 3.49Å | ||
| 235 | S | 47.3 | Very low | 57.1 | Low | 100 Ų | 100 | 111.4 Ų | 111.4 | 70% | 0.699 | 65% | 0.646 | S | S | * | * | trans | -83.8 | 157.9 | 179.3 | -160.1 | 0 | 0 | 0 | 0 | 112.3 | P233 D237 | P233-S235 PolarHBondContact O-N 3.37Å; S235-D237 PolarHBondContact O-N 2.62Å | ||
| 236 | D | 47.1 | Very low | 59.9 | Low | 166 Ų | 166 | 106.9 Ų | 106.9 | 89% | 0.888 | 63% | 0.626 | S | S | * | * | trans | -72.3 | 36.5 | -175.8 | -113.3 | -66.8 | 0 | 0 | 0 | 114.2 | D238 | D236-D238 VanDerWaalsContact C-N 3.34Å; D236-D238 PolarHBondContact O-N 3.08Å; D236-D238 VanDerWaalsContact O-N 3.08Å | ||
| 237 | D | 47.2 | Very low | 62.9 | Low | 121 Ų | 121 | 107.8 Ų | 107.8 | 65% | 0.647 | 61% | 0.613 | S | S | * | * | trans | -89 | 38.9 | -159.5 | -150.4 | -121.5 | 0 | 0 | 0 | 115.6 | S235 T239 | S235-D237 PolarHBondContact O-N 2.62Å; D237-T239 VanDerWaalsContact C-N 3.27Å; D237-T239 PolarHBondContact O-N 3.32Å | ||
| 238 | D | 60.8 | Low | 65.3 | Low | 162 Ų | 162 | 103.6 Ų | 103.6 | 87% | 0.866 | 58% | 0.576 | S | S | * | * | trans | -83.6 | -0.5 | 173.8 | -117.3 | -45.6 | 0 | 0 | 0 | 112.9 | D236 | D236-D238 VanDerWaalsContact C-N 3.34Å; D236-D238 PolarHBondContact O-N 3.08Å; D236-D238 VanDerWaalsContact O-N 3.08Å | ||
| 239 | T | 63.8 | Low | 68 | Low | 96 Ų | 96 | 97.2 Ų | 97.2 | 59% | 0.589 | 54% | 0.537 | S | S | * | . | S | Bend | trans | -105.1 | 103.8 | 179.3 | -61.6 | 0 | 0 | 0 | 0 | 110.9 | D237 T241 | D237-T239 VanDerWaalsContact C-N 3.27Å; D237-T239 PolarHBondContact O-N 3.32Å; T239-T241 PolarHBondContact O-N 2.91Å |
| 240 | P | 71.8 | Confident | 70.3 | Confident | 36 Ų | 36 | 95.2 Ų | 95.2 | 23% | 0.234 | 52% | 0.52 | C | S | . | . | trans | -62 | 132.1 | -176 | 25.3 | -34.9 | 0 | 0 | 0 | 111.7 | D244 F293 K300 | P240-D244 HydrophobicContact CB-CB 4.3Å; P240-F293 WeakPolarHBondContact O-CZ 3.2Å; P240-K300 HydrophobicContact CB-CD 4.14Å; P240-K300 HydrophobicContact CG-CD 4.22Å | ||
| 241 | T | 85.1 | Confident | 73.1 | Confident | 57 Ų | 57 | 93.8 Ų | 93.8 | 35% | 0.35 | 50% | 0.502 | S | S | . | . | trans | -69.4 | 172.1 | -176.6 | 71.4 | 0 | 0 | 0 | 0 | 112.3 | T239 D243 D244 L245 | T239-T241 PolarHBondContact O-N 2.91Å; T241-D243 PolarHBondContact O-N 3.45Å; T241-D243 PolarHBondContact OG1-N 3.15Å; T241-D244 VanDerWaalsContact CB-OD2 3.31Å; T241-D244 WeakPolarHBondContact CB-OD2 3.47Å; T241-D244 WeakPolarHBondContact CG2-OD2 3.47Å; T241-D244 PolarHBondContact N-OD2 3.01Å; T241-D244 PolarHBondContact O-N 2.86Å; T241-D244 PolarHBondContact OG1-N 3.13Å; T241-D244 VanDerWaalsContact OG1-N 3.13Å; T241-D244 PolarHBondContact OG1-OD2 3.49Å; T241-L245 PolarHBondContact O-N 3.38Å | ||
| 242 | S | 86.6 | Confident | 75.8 | Confident | 80 Ų | 80 | 85.4 Ų | 85.4 | 56% | 0.559 | 46% | 0.463 | S | S | * | . | H | α-helix | trans | -59.8 | -39 | 172.2 | -168.5 | 0 | 0 | 0 | 0 | 111.6 | L245 E246 | S242-L245 WeakPolarHBondContact O-CB 3.4Å; S242-L245 PolarHBondContact O-N 3.45Å; S242-E246 PolarHBondContact O-N 3.36Å; S242-E246 VanDerWaalsContact O-N 3.09Å |
| 243 | D | 90.1 | Very high | 78.8 | Confident | 106 Ų | 106 | 84 Ų | 84 | 57% | 0.567 | 45% | 0.452 | S | S | * | . | H | α-helix | trans | -74 | -32.9 | -177.4 | -57.9 | -51.2 | 0 | 0 | 0 | 111.6 | T241 L245 E246 Q247 | T241-D243 PolarHBondContact O-N 3.45Å; T241-D243 PolarHBondContact OG1-N 3.15Å; D243-L245 VanDerWaalsContact C-N 3.26Å; D243-L245 PolarHBondContact O-N 3.21Å; D243-E246 PolarHBondContact O-N 3.39Å; D243-Q247 WeakPolarHBondContact O-CB 3.42Å; D243-Q247 VanDerWaalsContact O-CG 3.25Å; D243-Q247 WeakPolarHBondContact O-CG 3.25Å; D243-Q247 PolarHBondContact O-N 3.04Å; D243-Q247 PolarHBondContact O-NE2 3.33Å |
| 244 | D | 93.2 | Very high | 81.1 | Confident | 51 Ų | 51 | 86 Ų | 86 | 27% | 0.273 | 45% | 0.451 | S | S | . | . | H | α-helix | trans | -67.4 | -27.4 | 172.4 | -57.9 | -48.5 | 0 | 0 | 0 | 112.9 | P240 T241 F248 | P240-D244 HydrophobicContact CB-CB 4.3Å; T241-D244 VanDerWaalsContact CB-OD2 3.31Å; T241-D244 WeakPolarHBondContact CB-OD2 3.47Å; T241-D244 WeakPolarHBondContact CG2-OD2 3.47Å; T241-D244 PolarHBondContact N-OD2 3.01Å; T241-D244 PolarHBondContact O-N 2.86Å; T241-D244 PolarHBondContact OG1-N 3.13Å; T241-D244 VanDerWaalsContact OG1-N 3.13Å; T241-D244 PolarHBondContact OG1-OD2 3.49Å; D244-F248 WeakPolarHBondContact O-CB 3.34Å; D244-F248 PolarHBondContact O-N 3.36Å |
| 245 | L | 94 | Very high | 83.4 | Confident | 5 Ų | 5 | 81.1 Ų | 81.1 | 3% | 0.026 | 43% | 0.426 | C | S | . | . | H | α-helix | trans | -76.5 | -37.9 | 173.2 | -72.7 | 170.2 | 0 | 0 | 0 | 111.6 | T241 S242 D243 A249 F293 M296 K300 | T241-L245 PolarHBondContact O-N 3.38Å; S242-L245 WeakPolarHBondContact O-CB 3.4Å; S242-L245 PolarHBondContact O-N 3.45Å; D243-L245 VanDerWaalsContact C-N 3.26Å; D243-L245 PolarHBondContact O-N 3.21Å; L245-A249 VanDerWaalsContact O-CB 3.24Å; L245-A249 WeakPolarHBondContact O-CB 3.17Å; L245-A249 PolarHBondContact O-N 3.45Å; L245-F293 HydrophobicContact CD1-CD2 3.61Å; L245-F293 HydrophobicContact CD1-CE2 3.51Å; L245-F293 HydrophobicContact CD1-CZ 4.39Å; L245-M296 HydrophobicContact CD1-CB 3.78Å; L245-M296 HydrophobicContact CD2-CB 4.03Å; L245-M296 HydrophobicContact CG-CB 4.46Å; L245-K300 HydrophobicContact CD2-CB 4.05Å; L245-K300 HydrophobicContact CD2-CD 3.89Å; L245-K300 HydrophobicContact CD2-CG 4.27Å |
| 246 | E | 95.1 | Very high | 85.7 | Confident | 75 Ų | 75 | 77.3 Ų | 77.3 | 35% | 0.35 | 40% | 0.396 | S | S | . | . | H | α-helix | trans | -65.6 | -47.8 | 173.4 | 176.7 | 156.9 | 160.4 | 0 | 0 | 111.8 | S242 D243 A249 K250 L289 | S242-E246 PolarHBondContact O-N 3.36Å; S242-E246 VanDerWaalsContact O-N 3.09Å; D243-E246 PolarHBondContact O-N 3.39Å; E246-A249 PolarHBondContact O-N 3.41Å; E246-K250 HydrophobicContact CG-CD 4.16Å; E246-K250 VanDerWaalsContact CG-CE 3.5Å; E246-K250 WeakPolarHBondContact O-CG 3.27Å; E246-K250 PolarHBondContact O-N 3.48Å; E246-K250 WeakPolarHBondContact OE1-CE 3.39Å; E246-K250 IonicContact OE1-NZ 3.74Å; E246-K250 PolarHBondContact OE1-NZ 2.83Å; E246-L289 HydrophobicContact CB-CD1 3.82Å; E246-L289 HydrophobicContact CG-CD1 3.84Å |
| 247 | Q | 96.2 | Very high | 87.9 | Confident | 118 Ų | 118 | 74 Ų | 74 | 55% | 0.551 | 38% | 0.378 | S | S | * | . | H | α-helix | trans | -59 | -48.2 | 174.9 | -72 | 176.2 | 78.7 | 0 | 0 | 111.4 | D243 K250 Q251 | D243-Q247 WeakPolarHBondContact O-CB 3.42Å; D243-Q247 VanDerWaalsContact O-CG 3.25Å; D243-Q247 WeakPolarHBondContact O-CG 3.25Å; D243-Q247 PolarHBondContact O-N 3.04Å; D243-Q247 PolarHBondContact O-NE2 3.33Å; Q247-K250 PolarHBondContact O-N 3.07Å; Q247-Q251 WeakPolarHBondContact O-CB 3.2Å; Q247-Q251 PolarHBondContact O-N 3.02Å |
| 248 | F | 97 | Very high | 90 | Very high | 13 Ų | 13 | 76.8 Ų | 76.8 | 6% | 0.057 | 38% | 0.384 | C | S | . | . | H | α-helix | trans | -63 | -43.8 | 177.9 | 178 | -94.5 | 0 | 0 | 0 | 112.3 | D244 K250 Q251 F252 F286 K300 L303 N304 | D244-F248 WeakPolarHBondContact O-CB 3.34Å; D244-F248 PolarHBondContact O-N 3.36Å; F248-K250 VanDerWaalsContact C-N 3.34Å; F248-K250 PolarHBondContact O-N 2.94Å; F248-Q251 PolarHBondContact O-N 3.35Å; F248-F252 HydrophobicContact CE1-CB 4.14Å; F248-F252 HydrophobicContact CE1-CD2 4.33Å; F248-F252 HydrophobicContact CE1-CG 4.43Å; F248-F252 HydrophobicContact CZ-CB 4.23Å; F248-F252 HydrophobicContact CZ-CD2 4.02Å; F248-F252 HydrophobicContact CZ-CG 4.47Å; F248-F252 WeakPolarHBondContact O-CB 3.39Å; F248-F252 PolarHBondContact O-N 2.86Å; F248-F286 AromaticContact CD1-CE1 3.63Å; F248-F286 HydrophobicContact CD1-CE1 3.63Å; F248-F286 AromaticContact CD1-CZ 3.57Å; F248-F286 HydrophobicContact CD1-CZ 3.57Å; F248-F286 AromaticContact CE1-CE1 3.56Å; F248-F286 HydrophobicContact CE1-CE1 3.56Å; F248-F286 AromaticContact CE1-CZ 3.56Å; F248-F286 HydrophobicContact CE1-CZ 3.56Å; F248-K300 HydrophobicContact CD1-CG 3.87Å; F248-K300 HydrophobicContact CD2-CG 4.38Å; F248-K300 HydrophobicContact CE1-CG 4.11Å; F248-K300 HydrophobicContact CG-CG 4.02Å; F248-K300 HydrophobicContact CZ-CG 4.48Å; F248-L303 HydrophobicContact CE1-CB 3.94Å; F248-L303 HydrophobicContact CZ-CB 3.9Å; F248-N304 HydrophobicContact CE2-CB 3.74Å; F248-N304 WeakPolarHBondContact CE2-OD1 3.42Å; F248-N304 HydrophobicContact CZ-CB 3.92Å |
| 249 | A | 97.3 | Very high | 91.4 | Very high | 2 Ų | 2 | 71 Ų | 71 | 2% | 0.017 | 35% | 0.353 | C | S | . | . | H | α-helix | trans | -63.1 | -39.3 | 179.2 | 0 | 0 | 0 | 0 | 0 | 112.3 | L245 E246 K253 F286 L289 | L245-A249 VanDerWaalsContact O-CB 3.24Å; L245-A249 WeakPolarHBondContact O-CB 3.17Å; L245-A249 PolarHBondContact O-N 3.45Å; E246-A249 PolarHBondContact O-N 3.41Å; A249-K253 VanDerWaalsContact O-CB 3.27Å; A249-K253 WeakPolarHBondContact O-CB 3.48Å; A249-K253 PolarHBondContact O-N 3.34Å; A249-F286 HydrophobicContact CB-CD1 4.42Å; A249-F286 HydrophobicContact CB-CE1 4.15Å; A249-L289 HydrophobicContact CB-CD2 3.59Å |
| 250 | K | 96.8 | Very high | 92.6 | Very high | 124 Ų | 124 | 69.5 Ų | 69.5 | 54% | 0.539 | 36% | 0.356 | S | S | . | . | H | α-helix | trans | -63.1 | -50.9 | 173 | -71.3 | 170 | -176.9 | 171.1 | 0 | 111.5 | E246 Q247 F248 K253 Q254 | E246-K250 HydrophobicContact CG-CD 4.16Å; E246-K250 VanDerWaalsContact CG-CE 3.5Å; E246-K250 WeakPolarHBondContact O-CG 3.27Å; E246-K250 PolarHBondContact O-N 3.48Å; E246-K250 WeakPolarHBondContact OE1-CE 3.39Å; E246-K250 IonicContact OE1-NZ 3.74Å; E246-K250 PolarHBondContact OE1-NZ 2.83Å; Q247-K250 PolarHBondContact O-N 3.07Å; F248-K250 VanDerWaalsContact C-N 3.34Å; F248-K250 PolarHBondContact O-N 2.94Å; K250-K253 PolarHBondContact O-N 3.42Å; K250-Q254 WeakPolarHBondContact O-CB 3.3Å; K250-Q254 PolarHBondContact O-N 3.27Å |
| 251 | Q | 96.6 | Very high | 93.5 | Very high | 78 Ų | 78 | 69.2 Ų | 69.2 | 36% | 0.364 | 35% | 0.351 | S | S | . | . | H | α-helix | trans | -61.8 | -46.7 | -179.8 | -173.8 | -176 | 103.4 | 0 | 0 | 111.7 | Q247 F248 K253 Q254 R255 | Q247-Q251 WeakPolarHBondContact O-CB 3.2Å; Q247-Q251 PolarHBondContact O-N 3.02Å; F248-Q251 PolarHBondContact O-N 3.35Å; Q251-K253 PolarHBondContact O-N 2.92Å; Q251-Q254 PolarHBondContact O-N 2.61Å; Q251-R255 PolarHBondContact O-N 3.13Å; Q251-R255 VanDerWaalsContact OE1-CZ 3.28Å |
| 252 | F | 97.4 | Very high | 93.9 | Very high | 0 Ų | 0 | 69.8 Ų | 69.8 | 0% | 0 | 36% | 0.355 | C | S | . | . | H | α-helix | trans | -56.4 | -50.4 | 176.4 | 177.8 | -86.9 | 0 | 0 | 0 | 111.4 | F248 Q254 R255 R256 V266 I283 E287 L303 W306 L307 | F248-F252 HydrophobicContact CE1-CB 4.14Å; F248-F252 HydrophobicContact CE1-CD2 4.33Å; F248-F252 HydrophobicContact CE1-CG 4.43Å; F248-F252 HydrophobicContact CZ-CB 4.23Å; F248-F252 HydrophobicContact CZ-CD2 4.02Å; F248-F252 HydrophobicContact CZ-CG 4.47Å; F248-F252 WeakPolarHBondContact O-CB 3.39Å; F248-F252 PolarHBondContact O-N 2.86Å; F252-Q254 PolarHBondContact O-N 2.77Å; F252-R255 PolarHBondContact O-N 2.89Å; F252-R256 HydrophobicContact CE1-CB 4.44Å; F252-R256 VanDerWaalsContact O-CB 3.28Å; F252-R256 WeakPolarHBondContact O-CB 3.48Å; F252-R256 PolarHBondContact O-N 3.14Å; F252-V266 HydrophobicContact CZ-CG1 3.9Å; F252-V266 HydrophobicContact CZ-CG2 4.32Å; F252-I283 HydrophobicContact CE1-CG2 4.05Å; F252-E287 HydrophobicContact CD1-CG 4.33Å; F252-L303 HydrophobicContact CD2-CB 3.94Å; F252-L303 HydrophobicContact CE1-CD2 4.23Å; F252-L303 HydrophobicContact CE2-CB 3.76Å; F252-L303 HydrophobicContact CE2-CD2 3.7Å; F252-L303 HydrophobicContact CE2-CG 4.28Å; F252-L303 HydrophobicContact CZ-CB 4.46Å; F252-L303 HydrophobicContact CZ-CD2 3.56Å; F252-W306 AromaticContact CE2-CE3 3.75Å; F252-W306 HydrophobicContact CE2-CE3 3.75Å; F252-W306 AromaticContact CE2-CZ3 3.88Å; F252-W306 HydrophobicContact CE2-CZ3 3.88Å; F252-W306 HydrophobicContact CZ-CE3 4.06Å; F252-W306 AromaticContact CZ-CZ3 3.94Å; F252-W306 HydrophobicContact CZ-CZ3 3.94Å; F252-L307 HydrophobicContact CB-CD2 4.48Å; F252-L307 HydrophobicContact CD2-CB 4.34Å; F252-L307 HydrophobicContact CD2-CD1 4.19Å; F252-L307 HydrophobicContact CD2-CD2 4.03Å; F252-L307 HydrophobicContact CD2-CG 4.45Å; F252-L307 HydrophobicContact CE2-CB 4.44Å; F252-L307 HydrophobicContact CE2-CD1 4.27Å |
| 253 | K | 97 | Very high | 94.2 | Very high | 91 Ų | 91 | 67.5 Ų | 67.5 | 40% | 0.396 | 34% | 0.335 | S | S | . | . | H | α-helix | trans | -59.6 | -45.4 | 177.7 | -177.2 | 179.2 | -173.2 | 179.5 | 0 | 111.7 | A249 K250 Q251 I257 E287 | A249-K253 VanDerWaalsContact O-CB 3.27Å; A249-K253 WeakPolarHBondContact O-CB 3.48Å; A249-K253 PolarHBondContact O-N 3.34Å; K250-K253 PolarHBondContact O-N 3.42Å; Q251-K253 PolarHBondContact O-N 2.92Å; K253-I257 HydrophobicContact CG-CD1 3.93Å; K253-I257 WeakPolarHBondContact O-CB 3.13Å; K253-I257 WeakPolarHBondContact O-CD1 3.41Å; K253-I257 VanDerWaalsContact O-CG1 3.25Å; K253-I257 WeakPolarHBondContact O-CG1 3.17Å; K253-I257 PolarHBondContact O-N 2.95Å; K253-I257 VanDerWaalsContact O-N 3.1Å; K253-E287 HydrophobicContact CB-CG 4.01Å; K253-E287 HydrophobicContact CD-CB 4.24Å; K253-E287 HydrophobicContact CD-CG 4.44Å; K253-E287 HydrophobicContact CG-CG 4.23Å |
| 254 | Q | 96.1 | Very high | 94.2 | Very high | 145 Ų | 145 | 64.4 Ų | 64.4 | 68% | 0.678 | 32% | 0.324 | S | S | * | . | H | α-helix | trans | -63.1 | -49.4 | 179.8 | -173.8 | -176.6 | 11.4 | 0 | 0 | 111.5 | K250 Q251 F252 I257 K258 | K250-Q254 WeakPolarHBondContact O-CB 3.3Å; K250-Q254 PolarHBondContact O-N 3.27Å; Q251-Q254 PolarHBondContact O-N 2.61Å; F252-Q254 PolarHBondContact O-N 2.77Å; Q254-I257 PolarHBondContact O-N 3.03Å; Q254-K258 WeakPolarHBondContact O-CB 3.27Å; Q254-K258 PolarHBondContact O-N 3.26Å |
| 255 | R | 94.8 | Very high | 94.1 | Very high | 78 Ų | 78 | 64.4 Ų | 64.4 | 29% | 0.294 | 32% | 0.324 | S | S | . | . | H | α-helix | trans | -64.7 | -47 | 178 | -70.2 | -151.7 | -162.2 | 110.2 | 6.6 | 111.6 | Q251 F252 I257 K258 L259 L307 D311 | Q251-R255 PolarHBondContact O-N 3.13Å; Q251-R255 VanDerWaalsContact OE1-CZ 3.28Å; F252-R255 PolarHBondContact O-N 2.89Å; R255-I257 VanDerWaalsContact C-N 3.26Å; R255-I257 PolarHBondContact O-N 3.27Å; R255-K258 CarbonylContact O-C 3.59Å; R255-K258 WeakPolarHBondContact O-CA 3.13Å; R255-K258 WeakPolarHBondContact O-CB 3.45Å; R255-K258 PolarHBondContact O-N 2.96Å; R255-L259 WeakPolarHBondContact O-CG 3.32Å; R255-L259 PolarHBondContact O-N 3.3Å; R255-L307 HydrophobicContact CB-CD1 3.79Å; R255-L307 HydrophobicContact CB-CD2 4.19Å; R255-L307 HydrophobicContact CB-CG 4.34Å; R255-L307 HydrophobicContact CG-CD2 4.49Å; R255-L307 VanDerWaalsContact NH1-CD2 3.32Å; R255-D311 WeakPolarHBondContact CD-OD1 3.5Å; R255-D311 WeakPolarHBondContact CD-OD2 3.45Å; R255-D311 IonicContact CZ-OD2 3.62Å; R255-D311 IonicContact NE-OD2 2.86Å; R255-D311 PolarHBondContact NE-OD2 2.86Å; R255-D311 IonicContact NH1-OD2 3.31Å; R255-D311 PolarHBondContact NH1-OD2 3.4Å |
| 256 | R | 95 | Very high | 94 | Very high | 20 Ų | 20 | 64.1 Ų | 64.1 | 8% | 0.075 | 32% | 0.323 | C | S | . | . | H | α-helix | trans | -50.9 | -46.6 | 175.4 | -176.1 | -169.7 | 56.4 | 71 | -3.5 | 111.9 | F252 L259 G260 F261 V266 E287 W306 | F252-R256 HydrophobicContact CE1-CB 4.44Å; F252-R256 VanDerWaalsContact O-CB 3.28Å; F252-R256 WeakPolarHBondContact O-CB 3.48Å; F252-R256 PolarHBondContact O-N 3.14Å; R256-L259 PolarHBondContact O-N 3.46Å; R256-G260 PolarHBondContact O-N 3.1Å; R256-F261 HydrophobicContact CG-CB 3.77Å; R256-F261 WeakPolarHBondContact CG-O 3.16Å; R256-F261 PolarHBondContact NH1-O 3.19Å; R256-F261 PolarHBondContact O-N 2.98Å; R256-V266 VanDerWaalsContact CD-CG2 3.47Å; R256-V266 HydrophobicContact CG-CG2 3.9Å; R256-E287 IonicContact CZ-OE1 3.71Å; R256-E287 IonicContact NE-OE1 3.5Å; R256-E287 PolarHBondContact NE-OE1 2.7Å; R256-E287 VanDerWaalsContact NH2-CD 3.34Å; R256-E287 IonicContact NH2-OE1 3.75Å; R256-E287 PolarHBondContact NH2-OE1 2.91Å; R256-E287 IonicContact NH2-OE2 3.42Å; R256-E287 PolarHBondContact NH2-OE2 2.7Å; R256-W306 HydrophobicContact CG-CH2 4.49Å |
| 257 | I | 93.1 | Very high | 93.9 | Very high | 97 Ų | 97 | 60.6 Ų | 60.6 | 50% | 0.497 | 31% | 0.306 | S | S | . | . | H | α-helix | trans | -68 | -42.2 | 178.6 | -67.1 | 167.6 | 0 | 0 | 0 | 111.1 | K253 Q254 R255 L259 G260 | K253-I257 HydrophobicContact CG-CD1 3.93Å; K253-I257 WeakPolarHBondContact O-CB 3.13Å; K253-I257 WeakPolarHBondContact O-CD1 3.41Å; K253-I257 VanDerWaalsContact O-CG1 3.25Å; K253-I257 WeakPolarHBondContact O-CG1 3.17Å; K253-I257 PolarHBondContact O-N 2.95Å; K253-I257 VanDerWaalsContact O-N 3.1Å; Q254-I257 PolarHBondContact O-N 3.03Å; R255-I257 VanDerWaalsContact C-N 3.26Å; R255-I257 PolarHBondContact O-N 3.27Å; I257-L259 PolarHBondContact O-N 3.22Å; I257-G260 PolarHBondContact O-N 2.92Å |
| 258 | K | 92.8 | Very high | 93.4 | Very high | 179 Ų | 179 | 57.5 Ų | 57.5 | 78% | 0.778 | 29% | 0.294 | S | S | * | . | H | α-helix | trans | -59.8 | -34.5 | 175.2 | -174.4 | -174.5 | 174.8 | -169 | 0 | 112.5 | Q254 R255 G260 | Q254-K258 WeakPolarHBondContact O-CB 3.27Å; Q254-K258 PolarHBondContact O-N 3.26Å; R255-K258 CarbonylContact O-C 3.59Å; R255-K258 WeakPolarHBondContact O-CA 3.13Å; R255-K258 WeakPolarHBondContact O-CB 3.45Å; R255-K258 PolarHBondContact O-N 2.96Å; K258-G260 VanDerWaalsContact C-N 3.31Å |
| 259 | L | 89.1 | Confident | 93 | Very high | 41 Ų | 41 | 57.4 Ų | 57.4 | 22% | 0.215 | 30% | 0.295 | C | S | . | . | T | Hydrogen-bonded Turn | trans | -85.1 | 3.5 | 176.1 | -58.7 | -164.5 | 0 | 0 | 0 | 113.7 | R255 R256 I257 F261 A310 T314 | R255-L259 WeakPolarHBondContact O-CG 3.32Å; R255-L259 PolarHBondContact O-N 3.3Å; R256-L259 PolarHBondContact O-N 3.46Å; I257-L259 PolarHBondContact O-N 3.22Å; L259-F261 HydrophobicContact CB-CD2 3.67Å; L259-F261 HydrophobicContact CB-CE2 3.96Å; L259-F261 HydrophobicContact CD1-CD2 4.43Å; L259-F261 HydrophobicContact CD1-CE2 4.2Å; L259-F261 PolarHBondContact O-N 2.92Å; L259-A310 HydrophobicContact CD1-CB 3.77Å; L259-T314 HydrophobicContact CD1-CG2 4.12Å; L259-T314 HydrophobicContact CD2-CG2 3.57Å; L259-T314 HydrophobicContact CG-CG2 4.42Å |
| 260 | G | 89 | Confident | 92.6 | Very high | 64 Ų | 64 | 57.3 Ų | 57.3 | 66% | 0.66 | 29% | 0.294 | S | S | * | . | T | Hydrogen-bonded Turn | trans | 76.3 | -6.8 | 176.8 | 0 | 0 | 0 | 0 | 0 | 116.4 | R256 I257 K258 | R256-G260 PolarHBondContact O-N 3.1Å; I257-G260 PolarHBondContact O-N 2.92Å; K258-G260 VanDerWaalsContact C-N 3.31Å |
| 261 | F | 90.8 | Very high | 92 | Very high | 30 Ų | 30 | 51.9 Ų | 51.9 | 13% | 0.132 | 27% | 0.273 | C | S | . | . | trans | -67.1 | 137.9 | -177.1 | -71.7 | -68.8 | 0 | 0 | 0 | 113.2 | R256 L259 D265 V266 W306 A310 I320 | R256-F261 HydrophobicContact CG-CB 3.77Å; R256-F261 WeakPolarHBondContact CG-O 3.16Å; R256-F261 PolarHBondContact NH1-O 3.19Å; R256-F261 PolarHBondContact O-N 2.98Å; L259-F261 HydrophobicContact CB-CD2 3.67Å; L259-F261 HydrophobicContact CB-CE2 3.96Å; L259-F261 HydrophobicContact CD1-CD2 4.43Å; L259-F261 HydrophobicContact CD1-CE2 4.2Å; L259-F261 PolarHBondContact O-N 2.92Å; F261-D265 HydrophobicContact CD1-CB 4.05Å; F261-V266 HydrophobicContact CB-CG2 4.46Å; F261-W306 HydrophobicContact CB-CH2 4.29Å; F261-W306 HydrophobicContact CD1-CZ2 4.32Å; F261-W306 AromaticContact CD2-CH2 3.56Å; F261-W306 HydrophobicContact CD2-CH2 3.56Å; F261-W306 AromaticContact CD2-CZ2 3.72Å; F261-W306 HydrophobicContact CD2-CZ2 3.72Å; F261-W306 HydrophobicContact CE1-CZ2 4.4Å; F261-W306 HydrophobicContact CE2-CH2 4Å; F261-W306 AromaticContact CE2-CZ2 3.81Å; F261-W306 HydrophobicContact CE2-CZ2 3.81Å; F261-W306 AromaticContact CG-CH2 3.98Å; F261-W306 HydrophobicContact CG-CH2 3.98Å; F261-W306 AromaticContact CG-CZ2 3.97Å; F261-W306 HydrophobicContact CG-CZ2 3.97Å; F261-W306 HydrophobicContact CZ-CZ2 4.14Å; F261-A310 HydrophobicContact CE2-CB 4.14Å; F261-I320 HydrophobicContact CE1-CG2 3.91Å; F261-I320 HydrophobicContact CZ-CD1 4.04Å; F261-I320 HydrophobicContact CZ-CG1 4.4Å; F261-I320 HydrophobicContact CZ-CG2 3.59Å | ||
| 262 | T | 93.9 | Very high | 91.3 | Very high | 69 Ų | 69 | 51 Ų | 51 | 42% | 0.423 | 27% | 0.273 | S | S | . | . | trans | -80 | 163.1 | 166.7 | 80.3 | 0 | 0 | 0 | 0 | 111.4 | A264 D265 V266 | T262-A264 PolarHBondContact O-N 2.86Å; T262-A264 PolarHBondContact OG1-N 2.85Å; T262-A264 VanDerWaalsContact OG1-N 3.16Å; T262-D265 WeakPolarHBondContact CA-OD2 3.31Å; T262-D265 WeakPolarHBondContact CB-OD2 3.4Å; T262-D265 VanDerWaalsContact CG2-OD2 3.32Å; T262-D265 WeakPolarHBondContact CG2-OD2 3.4Å; T262-D265 PolarHBondContact N-OD2 2.95Å; T262-D265 PolarHBondContact O-N 3.17Å; T262-D265 PolarHBondContact OG1-N 3.27Å; T262-D265 PolarHBondContact OG1-OD1 3.33Å; T262-D265 PolarHBondContact OG1-OD2 3.12Å; T262-V266 PolarHBondContact O-N 3.38Å | ||
| 263 | Q | 93.1 | Very high | 90.1 | Very high | 32 Ų | 32 | 54.3 Ų | 54.3 | 15% | 0.15 | 29% | 0.29 | C | S | . | . | H | α-helix | trans | -62.6 | -17.5 | 171.3 | -69.6 | 173.1 | -16 | 0 | 0 | 113.4 | Q280 I283 E287 | Q263-Q280 HydrophobicContact CB-CB 4.45Å; Q263-Q280 HydrophobicContact CB-CG 3.84Å; Q263-I283 HydrophobicContact CB-CB 4.16Å; Q263-I283 HydrophobicContact CB-CG2 4.2Å; Q263-I283 HydrophobicContact CG-CB 4.4Å; Q263-I283 HydrophobicContact CG-CG2 4.07Å; Q263-I283 WeakPolarHBondContact O-CG1 3.32Å; Q263-E287 PolarHBondContact NE2-OE2 2.79Å |
| 264 | A | 90.1 | Very high | 89.3 | Confident | 41 Ų | 41 | 54 Ų | 54 | 34% | 0.339 | 29% | 0.287 | S | S | . | . | H | α-helix | trans | -80.1 | -41.4 | 174.6 | 0 | 0 | 0 | 0 | 0 | 111.3 | T262 V266 G267 L268 Q280 | T262-A264 PolarHBondContact O-N 2.86Å; T262-A264 PolarHBondContact OG1-N 2.85Å; T262-A264 VanDerWaalsContact OG1-N 3.16Å; A264-V266 PolarHBondContact O-N 3.02Å; A264-G267 WeakPolarHBondContact O-CA 3.42Å; A264-G267 PolarHBondContact O-N 3.41Å; A264-L268 WeakPolarHBondContact O-CG 3.41Å; A264-L268 PolarHBondContact O-N 3.19Å; A264-Q280 HydrophobicContact CB-CB 4.47Å |
| 265 | D | 90.9 | Very high | 88.4 | Confident | 50 Ų | 50 | 50.6 Ų | 50.6 | 27% | 0.267 | 29% | 0.291 | S | S | . | . | H | α-helix | trans | -65.9 | -41 | -177.2 | -46.2 | -42.5 | 0 | 0 | 0 | 111.2 | F261 T262 G267 L268 A269 | F261-D265 HydrophobicContact CD1-CB 4.05Å; T262-D265 WeakPolarHBondContact CA-OD2 3.31Å; T262-D265 WeakPolarHBondContact CB-OD2 3.4Å; T262-D265 VanDerWaalsContact CG2-OD2 3.32Å; T262-D265 WeakPolarHBondContact CG2-OD2 3.4Å; T262-D265 PolarHBondContact N-OD2 2.95Å; T262-D265 PolarHBondContact O-N 3.17Å; T262-D265 PolarHBondContact OG1-N 3.27Å; T262-D265 PolarHBondContact OG1-OD1 3.33Å; T262-D265 PolarHBondContact OG1-OD2 3.12Å; D265-G267 VanDerWaalsContact C-N 3.31Å; D265-G267 PolarHBondContact O-N 2.93Å; D265-L268 PolarHBondContact O-N 3.35Å; D265-A269 WeakPolarHBondContact O-CB 3.43Å; D265-A269 PolarHBondContact O-N 2.81Å |
| 266 | V | 92.8 | Very high | 87.8 | Confident | 0 Ų | 0 | 52.1 Ų | 52.1 | 0% | 0 | 31% | 0.305 | C | S | . | . | H | α-helix | trans | -54.5 | -47.7 | 168.5 | 174.8 | 0 | 0 | 0 | 0 | 111.2 | F252 R256 F261 T262 A264 L268 A269 L270 I283 L303 W306 | F252-V266 HydrophobicContact CZ-CG1 3.9Å; F252-V266 HydrophobicContact CZ-CG2 4.32Å; R256-V266 VanDerWaalsContact CD-CG2 3.47Å; R256-V266 HydrophobicContact CG-CG2 3.9Å; F261-V266 HydrophobicContact CB-CG2 4.46Å; T262-V266 PolarHBondContact O-N 3.38Å; A264-V266 PolarHBondContact O-N 3.02Å; V266-L268 VanDerWaalsContact C-N 3.28Å; V266-L268 PolarHBondContact O-N 3.14Å; V266-A269 PolarHBondContact O-N 3.48Å; V266-L270 HydrophobicContact CG1-CD1 3.77Å; V266-L270 HydrophobicContact CG1-CG 4.35Å; V266-L270 WeakPolarHBondContact O-CB 3.29Å; V266-L270 VanDerWaalsContact O-CG 3.23Å; V266-L270 WeakPolarHBondContact O-CG 3.4Å; V266-L270 PolarHBondContact O-N 3.38Å; V266-I283 HydrophobicContact CB-CG1 4.35Å; V266-I283 HydrophobicContact CG1-CD1 3.75Å; V266-I283 HydrophobicContact CG1-CG1 4.06Å; V266-I283 HydrophobicContact CG1-CG2 4.32Å; V266-L303 HydrophobicContact CG1-CD2 4.02Å; V266-W306 HydrophobicContact CG1-CD2 4.49Å; V266-W306 HydrophobicContact CG1-CE3 4.41Å; V266-W306 HydrophobicContact CG2-CE3 4.38Å; V266-W306 HydrophobicContact CG2-CH2 3.54Å; V266-W306 HydrophobicContact CG2-CZ2 3.83Å; V266-W306 HydrophobicContact CG2-CZ3 3.83Å |
| 267 | G | 91.4 | Very high | 87.3 | Confident | 0 Ų | 0 | 52.5 Ų | 52.5 | 0% | 0 | 31% | 0.31 | C | S | . | . | H | α-helix | trans | -63.7 | -33.9 | -179.1 | 0 | 0 | 0 | 0 | 0 | 113.4 | A264 D265 G271 V277 F278 | A264-G267 WeakPolarHBondContact O-CA 3.42Å; A264-G267 PolarHBondContact O-N 3.41Å; D265-G267 VanDerWaalsContact C-N 3.31Å; D265-G267 PolarHBondContact O-N 2.93Å; G267-G271 PolarHBondContact O-N 3.29Å; G267-V277 WeakPolarHBondContact O-CA 3.43Å; G267-V277 WeakPolarHBondContact O-CG1 3.47Å; G267-F278 WeakPolarHBondContact CA-O 3.25Å; G267-F278 PolarHBondContact O-N 2.94Å; G267-F278 VanDerWaalsContact O-N 3.09Å |
| 268 | L | 87.3 | Confident | 87.1 | Confident | 54 Ų | 54 | 49.8 Ų | 49.8 | 28% | 0.283 | 29% | 0.294 | S | S | . | . | H | α-helix | trans | -73.5 | -49.8 | 174.8 | -70.2 | 166.4 | 0 | 0 | 0 | 112 | A264 D265 V266 L270 G271 T272 V277 | A264-L268 WeakPolarHBondContact O-CG 3.41Å; A264-L268 PolarHBondContact O-N 3.19Å; D265-L268 PolarHBondContact O-N 3.35Å; V266-L268 VanDerWaalsContact C-N 3.28Å; V266-L268 PolarHBondContact O-N 3.14Å; L268-L270 PolarHBondContact O-N 3.12Å; L268-G271 CarbonylContact O-C 3.6Å; L268-G271 VanDerWaalsContact O-CA 3.31Å; L268-G271 WeakPolarHBondContact O-CA 3.39Å; L268-G271 PolarHBondContact O-N 2.97Å; L268-T272 PolarHBondContact O-N 3.18Å; L268-T272 VanDerWaalsContact O-N 3.1Å; L268-V277 HydrophobicContact CD2-CG1 3.93Å |
| 269 | A | 87.2 | Confident | 86.9 | Confident | 10 Ų | 10 | 42 Ų | 42 | 8% | 0.083 | 26% | 0.262 | C | S | . | . | H | α-helix | trans | -61.1 | -44.7 | -179.4 | 0 | 0 | 0 | 0 | 0 | 112.1 | D265 V266 G271 T272 L273 I323 | D265-A269 WeakPolarHBondContact O-CB 3.43Å; D265-A269 PolarHBondContact O-N 2.81Å; V266-A269 PolarHBondContact O-N 3.48Å; A269-G271 PolarHBondContact O-N 3.26Å; A269-T272 WeakPolarHBondContact O-CB 3.49Å; A269-T272 PolarHBondContact O-N 2.86Å; A269-L273 PolarHBondContact O-N 3.11Å; A269-I323 HydrophobicContact CB-CG2 4.17Å |
| 270 | L | 88.8 | Confident | 87 | Confident | 1 Ų | 1 | 44 Ų | 44 | 1% | 0.005 | 27% | 0.271 | C | S | . | . | H | α-helix | trans | -59.6 | -31.8 | 170.9 | -70.1 | 171.1 | 0 | 0 | 0 | 112.6 | V266 L268 T272 L273 Y274 F278 I283 L302 L303 W306 | V266-L270 HydrophobicContact CG1-CD1 3.77Å; V266-L270 HydrophobicContact CG1-CG 4.35Å; V266-L270 WeakPolarHBondContact O-CB 3.29Å; V266-L270 VanDerWaalsContact O-CG 3.23Å; V266-L270 WeakPolarHBondContact O-CG 3.4Å; V266-L270 PolarHBondContact O-N 3.38Å; L268-L270 PolarHBondContact O-N 3.12Å; L270-T272 VanDerWaalsContact C-N 3.32Å; L270-L273 PolarHBondContact O-N 3.37Å; L270-Y274 HydrophobicContact CB-CD2 4.41Å; L270-Y274 HydrophobicContact CD2-CD2 3.85Å; L270-Y274 HydrophobicContact CD2-CE2 3.64Å; L270-Y274 WeakPolarHBondContact O-CB 3.26Å; L270-Y274 WeakPolarHBondContact O-CD2 3.45Å; L270-Y274 PolarHBondContact O-N 3.49Å; L270-F278 HydrophobicContact CB-CD2 3.7Å; L270-F278 HydrophobicContact CB-CE2 4.16Å; L270-F278 HydrophobicContact CD1-CD2 3.7Å; L270-F278 HydrophobicContact CD1-CE2 4.24Å; L270-F278 HydrophobicContact CG-CD2 4.33Å; L270-I283 HydrophobicContact CD1-CD1 4.18Å; L270-L302 HydrophobicContact CD2-CB 4.45Å; L270-L302 WeakPolarHBondContact CD2-O 3.41Å; L270-L303 HydrophobicContact CD1-CD2 3.75Å; L270-W306 HydrophobicContact CD2-CB 3.61Å; L270-W306 HydrophobicContact CD2-CG 4.11Å; L270-W306 HydrophobicContact CG-CB 4.42Å; L270-W306 HydrophobicContact CG-CG 4.43Å |
| 271 | G | 85.3 | Confident | 87.3 | Confident | 9 Ų | 9 | 44.2 Ų | 44.2 | 9% | 0.093 | 26% | 0.259 | C | S | . | . | H | α-helix | trans | -68.3 | -30 | 174.4 | 0 | 0 | 0 | 0 | 0 | 113.8 | G267 L268 A269 G275 N276 | G267-G271 PolarHBondContact O-N 3.29Å; L268-G271 CarbonylContact O-C 3.6Å; L268-G271 VanDerWaalsContact O-CA 3.31Å; L268-G271 WeakPolarHBondContact O-CA 3.39Å; L268-G271 PolarHBondContact O-N 2.97Å; A269-G271 PolarHBondContact O-N 3.26Å; G271-G275 CarbonylContact O-C 3.49Å; G271-G275 VanDerWaalsContact O-CA 3.24Å; G271-G275 WeakPolarHBondContact O-CA 3.46Å; G271-G275 PolarHBondContact O-N 3.45Å; G271-G275 VanDerWaalsContact O-N 3.09Å; G271-N276 WeakPolarHBondContact CA-O 3.36Å |
| 272 | T | 80.8 | Confident | 87.5 | Confident | 60 Ų | 60 | 44.5 Ų | 44.5 | 37% | 0.368 | 26% | 0.264 | S | S | . | . | H | α-helix | trans | -74.7 | -41.8 | 171.5 | -61.5 | 0 | 0 | 0 | 0 | 111.5 | L268 A269 L270 I323 | L268-T272 PolarHBondContact O-N 3.18Å; L268-T272 VanDerWaalsContact O-N 3.1Å; A269-T272 WeakPolarHBondContact O-CB 3.49Å; A269-T272 PolarHBondContact O-N 2.86Å; L270-T272 VanDerWaalsContact C-N 3.32Å; T272-I323 HydrophobicContact CG2-CG2 4.48Å |
| 273 | L | 72.4 | Confident | 87.6 | Confident | 69 Ų | 69 | 41.4 Ų | 41.4 | 36% | 0.361 | 24% | 0.244 | S | C | . | . | H | α-helix | trans | -73.4 | -37.3 | -179 | -66.7 | 170.9 | 0 | 0 | 0 | 114 | A269 L270 W306 E309 | A269-L273 PolarHBondContact O-N 3.11Å; L270-L273 PolarHBondContact O-N 3.37Å; L273-W306 HydrophobicContact CD1-CB 4.42Å; L273-E309 VanDerWaalsContact CD1-OE2 3.28Å; L273-E309 WeakPolarHBondContact CD1-OE2 3.46Å; L273-E309 WeakPolarHBondContact CD2-OE2 3.38Å |
| 274 | Y | 81.2 | Confident | 87.8 | Confident | 85 Ų | 85 | 42.1 Ų | 42.1 | 33% | 0.333 | 25% | 0.252 | S | S | . | . | H | α-helix | trans | -122.9 | 11.9 | -170.7 | -56.9 | -74.1 | 0 | 0 | 0 | 113.9 | L270 N276 L302 K305 | L270-Y274 HydrophobicContact CB-CD2 4.41Å; L270-Y274 HydrophobicContact CD2-CD2 3.85Å; L270-Y274 HydrophobicContact CD2-CE2 3.64Å; L270-Y274 WeakPolarHBondContact O-CB 3.26Å; L270-Y274 WeakPolarHBondContact O-CD2 3.45Å; L270-Y274 PolarHBondContact O-N 3.49Å; Y274-N276 PolarHBondContact O-N 3.46Å; Y274-N276 VanDerWaalsContact O-N 3.11Å; Y274-L302 HydrophobicContact CD1-CD2 3.79Å; Y274-L302 HydrophobicContact CD2-CD2 4.17Å; Y274-L302 HydrophobicContact CE1-CD2 3.57Å; Y274-L302 HydrophobicContact CE2-CB 4.15Å; Y274-L302 HydrophobicContact CE2-CD2 3.97Å; Y274-L302 HydrophobicContact CG-CD2 4.07Å; Y274-K305 WeakPolarHBondContact OH-CD 3.45Å |
| 275 | G | 77.6 | Confident | 88.1 | Confident | 73 Ų | 73 | 46.2 Ų | 46.2 | 75% | 0.753 | 26% | 0.259 | S | S | * | . | S | Bend | trans | 71.7 | -0.6 | 173.7 | 0 | 0 | 0 | 0 | 0 | 116.6 | G271 | G271-G275 CarbonylContact O-C 3.49Å; G271-G275 VanDerWaalsContact O-CA 3.24Å; G271-G275 WeakPolarHBondContact O-CA 3.46Å; G271-G275 PolarHBondContact O-N 3.45Å; G271-G275 VanDerWaalsContact O-N 3.09Å |
| 276 | N | 81.9 | Confident | 88.4 | Confident | 110 Ų | 110 | 43.8 Ų | 43.8 | 59% | 0.588 | 25% | 0.246 | S | C | * | . | S | Bend | trans | -136.2 | 112.1 | -178.8 | -171.7 | 12.1 | 0 | 0 | 0 | 112 | G271 Y274 F278 | G271-N276 WeakPolarHBondContact CA-O 3.36Å; Y274-N276 PolarHBondContact O-N 3.46Å; Y274-N276 VanDerWaalsContact O-N 3.11Å; N276-F278 PolarHBondContact O-N 3.09Å |
| 277 | V | 83.7 | Confident | 88.6 | Confident | 29 Ų | 29 | 44.7 Ų | 44.7 | 18% | 0.176 | 25% | 0.25 | C | S | . | . | trans | -69.7 | 110.1 | -176.9 | -179.3 | 0 | 0 | 0 | 0 | 110.7 | G267 L268 R330 | G267-V277 WeakPolarHBondContact O-CA 3.43Å; G267-V277 WeakPolarHBondContact O-CG1 3.47Å; L268-V277 HydrophobicContact CD2-CG1 3.93Å; V277-R330 HydrophobicContact CB-CB 4.28Å; V277-R330 HydrophobicContact CB-CG 4.17Å; V277-R330 HydrophobicContact CG1-CB 4.02Å; V277-R330 HydrophobicContact CG1-CG 4.07Å | ||
| 278 | F | 89.1 | Confident | 88.8 | Confident | 40 Ų | 40 | 46.9 Ų | 46.9 | 18% | 0.175 | 27% | 0.268 | C | S | . | . | trans | -69.1 | 155.5 | 172.6 | -68 | -74.3 | 0 | 0 | 0 | 111.2 | G267 L270 N276 T282 I283 L299 L302 | G267-F278 WeakPolarHBondContact CA-O 3.25Å; G267-F278 PolarHBondContact O-N 2.94Å; G267-F278 VanDerWaalsContact O-N 3.09Å; L270-F278 HydrophobicContact CB-CD2 3.7Å; L270-F278 HydrophobicContact CB-CE2 4.16Å; L270-F278 HydrophobicContact CD1-CD2 3.7Å; L270-F278 HydrophobicContact CD1-CE2 4.24Å; L270-F278 HydrophobicContact CG-CD2 4.33Å; N276-F278 PolarHBondContact O-N 3.09Å; F278-T282 HydrophobicContact CD1-CG2 4.06Å; F278-I283 HydrophobicContact CB-CD1 4.3Å; F278-L299 HydrophobicContact CD1-CD2 4.21Å; F278-L299 HydrophobicContact CE1-CD2 3.63Å; F278-L299 HydrophobicContact CZ-CD2 3.83Å; F278-L302 HydrophobicContact CE2-CD1 4.05Å; F278-L302 HydrophobicContact CZ-CD1 3.77Å | ||
| 279 | S | 88.4 | Confident | 89.2 | Confident | 15 Ų | 15 | 47.6 Ų | 47.6 | 11% | 0.105 | 27% | 0.272 | C | S | . | . | trans | -89 | 149.3 | 178.4 | 77.8 | 0 | 0 | 0 | 0 | 111.3 | T281 T282 I283 R330 | S279-T281 PolarHBondContact O-N 2.87Å; S279-T281 VanDerWaalsContact O-N 3.11Å; S279-T281 PolarHBondContact OG-N 3.21Å; S279-T282 PolarHBondContact N-OG1 2.85Å; S279-T282 WeakPolarHBondContact O-CA 3.26Å; S279-T282 WeakPolarHBondContact O-CB 3.24Å; S279-T282 PolarHBondContact O-N 2.8Å; S279-T282 PolarHBondContact OG-N 2.87Å; S279-T282 PolarHBondContact OG-OG1 3.38Å; S279-I283 PolarHBondContact O-N 3.4Å; S279-I283 VanDerWaalsContact O-N 3.15Å; S279-R330 VanDerWaalsContact CB-CZ 3.43Å | ||
| 280 | Q | 91.9 | Very high | 89.6 | Confident | 83 Ų | 83 | 53.3 Ų | 53.3 | 39% | 0.388 | 30% | 0.297 | S | S | . | . | H | α-helix | trans | -45.9 | -41 | 165.1 | 170.7 | -79.4 | -23.4 | 0 | 0 | 111.2 | Q263 A264 T282 I283 C284 | Q263-Q280 HydrophobicContact CB-CB 4.45Å; Q263-Q280 HydrophobicContact CB-CG 3.84Å; A264-Q280 HydrophobicContact CB-CB 4.47Å; Q280-T282 VanDerWaalsContact C-N 3.28Å; Q280-T282 PolarHBondContact O-N 3.12Å; Q280-I283 PolarHBondContact O-N 3.18Å; Q280-C284 VanDerWaalsContact O-CB 3.26Å; Q280-C284 WeakPolarHBondContact O-CB 3.42Å; Q280-C284 PolarHBondContact O-N 2.99Å |
| 281 | T | 94.9 | Very high | 89.9 | Confident | 69 Ų | 69 | 55.1 Ų | 55.1 | 42% | 0.423 | 31% | 0.306 | S | S | . | . | H | α-helix | trans | -68.3 | -25.8 | 179.2 | -40.1 | 0 | 0 | 0 | 0 | 112.8 | S279 R285 | S279-T281 PolarHBondContact O-N 2.87Å; S279-T281 VanDerWaalsContact O-N 3.11Å; S279-T281 PolarHBondContact OG-N 3.21Å; T281-R285 WeakPolarHBondContact O-CB 3.26Å; T281-R285 WeakPolarHBondContact O-CG 3.34Å; T281-R285 PolarHBondContact O-N 3.11Å; T281-R285 VanDerWaalsContact O-N 3.12Å |
| 282 | T | 95.4 | Very high | 90.2 | Very high | 36 Ų | 36 | 58 Ų | 58 | 22% | 0.221 | 33% | 0.325 | C | S | . | . | H | α-helix | trans | -70.6 | -50.1 | 172.2 | -50.6 | 0 | 0 | 0 | 0 | 110 | F278 S279 Q280 R285 F286 L299 | F278-T282 HydrophobicContact CD1-CG2 4.06Å; S279-T282 PolarHBondContact N-OG1 2.85Å; S279-T282 WeakPolarHBondContact O-CA 3.26Å; S279-T282 WeakPolarHBondContact O-CB 3.24Å; S279-T282 PolarHBondContact O-N 2.8Å; S279-T282 PolarHBondContact OG-N 2.87Å; S279-T282 PolarHBondContact OG-OG1 3.38Å; Q280-T282 VanDerWaalsContact C-N 3.28Å; Q280-T282 PolarHBondContact O-N 3.12Å; T282-R285 PolarHBondContact O-N 3.09Å; T282-F286 PolarHBondContact O-N 3.13Å; T282-L299 HydrophobicContact CG2-CD1 3.92Å |
| 283 | I | 95.3 | Very high | 90.8 | Very high | 3 Ų | 3 | 60 Ų | 60 | 2% | 0.015 | 33% | 0.329 | C | S | . | . | H | α-helix | trans | -63.1 | -45.1 | 178.9 | -49.3 | -53.5 | 0 | 0 | 0 | 110.2 | F252 Q263 V266 L270 F278 S279 Q280 R285 F286 E287 L303 | F252-I283 HydrophobicContact CE1-CG2 4.05Å; Q263-I283 HydrophobicContact CB-CB 4.16Å; Q263-I283 HydrophobicContact CB-CG2 4.2Å; Q263-I283 HydrophobicContact CG-CB 4.4Å; Q263-I283 HydrophobicContact CG-CG2 4.07Å; Q263-I283 WeakPolarHBondContact O-CG1 3.32Å; V266-I283 HydrophobicContact CB-CG1 4.35Å; V266-I283 HydrophobicContact CG1-CD1 3.75Å; V266-I283 HydrophobicContact CG1-CG1 4.06Å; V266-I283 HydrophobicContact CG1-CG2 4.32Å; L270-I283 HydrophobicContact CD1-CD1 4.18Å; F278-I283 HydrophobicContact CB-CD1 4.3Å; S279-I283 PolarHBondContact O-N 3.4Å; S279-I283 VanDerWaalsContact O-N 3.15Å; Q280-I283 PolarHBondContact O-N 3.18Å; I283-R285 PolarHBondContact O-N 2.91Å; I283-F286 WeakPolarHBondContact O-CB 3.34Å; I283-F286 PolarHBondContact O-N 3.12Å; I283-F286 VanDerWaalsContact O-N 3.14Å; I283-E287 WeakPolarHBondContact O-CG 3.39Å; I283-E287 PolarHBondContact O-N 3.06Å; I283-L303 HydrophobicContact CD1-CD2 3.95Å |
| 284 | C | 96.9 | Very high | 91.7 | Very high | 47 Ų | 47 | 64.1 Ų | 64.1 | 32% | 0.318 | 34% | 0.344 | S | S | . | . | H | α-helix | trans | -59.2 | -43.4 | 176.7 | -169.8 | 0 | 0 | 0 | 0 | 112.9 | Q280 F286 E287 A288 | Q280-C284 VanDerWaalsContact O-CB 3.26Å; Q280-C284 WeakPolarHBondContact O-CB 3.42Å; Q280-C284 PolarHBondContact O-N 2.99Å; C284-F286 VanDerWaalsContact C-N 3.34Å; C284-E287 PolarHBondContact O-N 3.48Å; C284-A288 VanDerWaalsContact O-CB 3.31Å; C284-A288 WeakPolarHBondContact O-CB 3.37Å; C284-A288 PolarHBondContact O-N 2.8Å; C284-A288 VanDerWaalsContact O-N 3.07Å |
| 285 | R | 96.7 | Very high | 92.2 | Very high | 127 Ų | 127 | 63.8 Ų | 63.8 | 48% | 0.479 | 35% | 0.348 | S | S | . | . | H | α-helix | trans | -69.4 | -31.2 | 176 | -73.9 | 174.8 | -178.6 | -140.2 | -1.6 | 112.9 | T281 T282 I283 L289 Q290 L291 | T281-R285 WeakPolarHBondContact O-CB 3.26Å; T281-R285 WeakPolarHBondContact O-CG 3.34Å; T281-R285 PolarHBondContact O-N 3.11Å; T281-R285 VanDerWaalsContact O-N 3.12Å; T282-R285 PolarHBondContact O-N 3.09Å; I283-R285 PolarHBondContact O-N 2.91Å; R285-L289 PolarHBondContact O-N 3.45Å; R285-Q290 HydrophobicContact CB-CB 4.17Å; R285-Q290 HydrophobicContact CG-CB 4.2Å; R285-Q290 PolarHBondContact O-N 3.4Å; R285-L291 HydrophobicContact CB-CD1 4.43Å; R285-L291 HydrophobicContact CB-CD2 3.65Å; R285-L291 HydrophobicContact CB-CG 3.82Å; R285-L291 HydrophobicContact CG-CD2 4.47Å |
| 286 | F | 97.4 | Very high | 93 | Very high | 0 Ų | 0 | 60.7 Ų | 60.7 | 0% | 0 | 31% | 0.314 | C | S | . | . | H | α-helix | trans | -66.8 | -49.8 | 172.6 | -173.6 | -83.9 | 0 | 0 | 0 | 111 | F248 A249 T282 I283 C284 A288 L289 L291 M296 L299 L303 | F248-F286 AromaticContact CD1-CE1 3.63Å; F248-F286 HydrophobicContact CD1-CE1 3.63Å; F248-F286 AromaticContact CD1-CZ 3.57Å; F248-F286 HydrophobicContact CD1-CZ 3.57Å; F248-F286 AromaticContact CE1-CE1 3.56Å; F248-F286 HydrophobicContact CE1-CE1 3.56Å; F248-F286 AromaticContact CE1-CZ 3.56Å; F248-F286 HydrophobicContact CE1-CZ 3.56Å; A249-F286 HydrophobicContact CB-CD1 4.42Å; A249-F286 HydrophobicContact CB-CE1 4.15Å; T282-F286 PolarHBondContact O-N 3.13Å; I283-F286 WeakPolarHBondContact O-CB 3.34Å; I283-F286 PolarHBondContact O-N 3.12Å; I283-F286 VanDerWaalsContact O-N 3.14Å; C284-F286 VanDerWaalsContact C-N 3.34Å; F286-A288 PolarHBondContact O-N 3.18Å; F286-A288 VanDerWaalsContact O-N 3.14Å; F286-L289 PolarHBondContact O-N 3.41Å; F286-L291 HydrophobicContact CB-CD1 4.11Å; F286-L291 HydrophobicContact CD2-CD1 4.38Å; F286-M296 HydrophobicContact CB-SD 4.45Å; F286-M296 HydrophobicContact CD1-CE 4.24Å; F286-M296 HydrophobicContact CD2-CE 3.53Å; F286-M296 HydrophobicContact CD2-SD 3.44Å; F286-M296 WeakPolarHBondContact CD2-SD 3.2Å; F286-M296 HydrophobicContact CE1-CE 4.15Å; F286-M296 HydrophobicContact CE2-CB 4.48Å; F286-M296 HydrophobicContact CE2-CE 3.44Å; F286-M296 VanDerWaalsContact CE2-CE 3.44Å; F286-M296 HydrophobicContact CE2-SD 3.8Å; F286-M296 HydrophobicContact CG-CE 3.94Å; F286-M296 HydrophobicContact CG-SD 4.06Å; F286-M296 HydrophobicContact CZ-CE 3.76Å; F286-L299 HydrophobicContact CD2-CB 3.64Å; F286-L299 HydrophobicContact CD2-CD1 3.93Å; F286-L299 HydrophobicContact CD2-CG 4.46Å; F286-L299 HydrophobicContact CE2-CB 3.64Å; F286-L303 HydrophobicContact CB-CD1 4.4Å; F286-L303 HydrophobicContact CD1-CD1 3.47Å; F286-L303 VanDerWaalsContact CD1-CD1 3.47Å; F286-L303 HydrophobicContact CD2-CD1 3.66Å; F286-L303 HydrophobicContact CE1-CD1 3.51Å; F286-L303 HydrophobicContact CE2-CD1 3.68Å; F286-L303 HydrophobicContact CG-CD1 3.55Å; F286-L303 HydrophobicContact CZ-CD1 3.61Å |
| 287 | E | 97.3 | Very high | 93.6 | Very high | 18 Ų | 18 | 57.1 Ų | 57.1 | 8% | 0.084 | 30% | 0.297 | C | S | . | . | H | α-helix | trans | -59.8 | -22.3 | 175.6 | -73.1 | -174.4 | 177 | 0 | 0 | 114.4 | F252 K253 R256 Q263 I283 C284 | F252-E287 HydrophobicContact CD1-CG 4.33Å; K253-E287 HydrophobicContact CB-CG 4.01Å; K253-E287 HydrophobicContact CD-CB 4.24Å; K253-E287 HydrophobicContact CD-CG 4.44Å; K253-E287 HydrophobicContact CG-CG 4.23Å; R256-E287 IonicContact CZ-OE1 3.71Å; R256-E287 IonicContact NE-OE1 3.5Å; R256-E287 PolarHBondContact NE-OE1 2.7Å; R256-E287 VanDerWaalsContact NH2-CD 3.34Å; R256-E287 IonicContact NH2-OE1 3.75Å; R256-E287 PolarHBondContact NH2-OE1 2.91Å; R256-E287 IonicContact NH2-OE2 3.42Å; R256-E287 PolarHBondContact NH2-OE2 2.7Å; Q263-E287 PolarHBondContact NE2-OE2 2.79Å; I283-E287 WeakPolarHBondContact O-CG 3.39Å; I283-E287 PolarHBondContact O-N 3.06Å; C284-E287 PolarHBondContact O-N 3.48Å |
| 288 | A | 96.3 | Very high | 94 | Very high | 46 Ų | 46 | 62.3 Ų | 62.3 | 38% | 0.38 | 32% | 0.318 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -102.1 | 3.7 | 178.7 | 0 | 0 | 0 | 0 | 0 | 113.7 | C284 F286 Q290 | C284-A288 VanDerWaalsContact O-CB 3.31Å; C284-A288 WeakPolarHBondContact O-CB 3.37Å; C284-A288 PolarHBondContact O-N 2.8Å; C284-A288 VanDerWaalsContact O-N 3.07Å; F286-A288 PolarHBondContact O-N 3.18Å; F286-A288 VanDerWaalsContact O-N 3.14Å; A288-Q290 HydrophobicContact CB-CG 3.88Å; A288-Q290 WeakPolarHBondContact O-CG 3.26Å; A288-Q290 PolarHBondContact O-N 3.07Å |
| 289 | L | 95.7 | Very high | 94.2 | Very high | 69 Ų | 69 | 61.2 Ų | 61.2 | 36% | 0.361 | 31% | 0.313 | S | S | . | . | T | Hydrogen-bonded Turn | trans | 58 | 23.4 | -174.9 | -51.9 | 177.3 | 0 | 0 | 0 | 114.3 | E246 A249 R285 F286 L291 M296 | E246-L289 HydrophobicContact CB-CD1 3.82Å; E246-L289 HydrophobicContact CG-CD1 3.84Å; A249-L289 HydrophobicContact CB-CD2 3.59Å; R285-L289 PolarHBondContact O-N 3.45Å; F286-L289 PolarHBondContact O-N 3.41Å; L289-L291 VanDerWaalsContact C-N 3.3Å; L289-L291 PolarHBondContact O-N 3.35Å; L289-M296 HydrophobicContact CD2-CE 3.55Å |
| 290 | Q | 95.4 | Very high | 94.5 | Very high | 131 Ų | 131 | 62.6 Ų | 62.6 | 61% | 0.612 | 32% | 0.318 | S | S | * | . | trans | -92 | 30.3 | -176.8 | -65.5 | 177.9 | 5.6 | 0 | 0 | 113.5 | R285 A288 | R285-Q290 HydrophobicContact CB-CB 4.17Å; R285-Q290 HydrophobicContact CG-CB 4.2Å; R285-Q290 PolarHBondContact O-N 3.4Å; A288-Q290 HydrophobicContact CB-CG 3.88Å; A288-Q290 WeakPolarHBondContact O-CG 3.26Å; A288-Q290 PolarHBondContact O-N 3.07Å | ||
| 291 | L | 93.4 | Very high | 94.6 | Very high | 38 Ų | 38 | 62.3 Ų | 62.3 | 20% | 0.199 | 32% | 0.323 | C | S | . | . | S | Bend | trans | -121.4 | 152.9 | 171.8 | -58.2 | 174.9 | 0 | 0 | 0 | 108.8 | R285 F286 L289 N295 M296 L299 | R285-L291 HydrophobicContact CB-CD1 4.43Å; R285-L291 HydrophobicContact CB-CD2 3.65Å; R285-L291 HydrophobicContact CB-CG 3.82Å; R285-L291 HydrophobicContact CG-CD2 4.47Å; F286-L291 HydrophobicContact CB-CD1 4.11Å; F286-L291 HydrophobicContact CD2-CD1 4.38Å; L289-L291 VanDerWaalsContact C-N 3.3Å; L289-L291 PolarHBondContact O-N 3.35Å; L291-N295 HydrophobicContact CB-CB 4.2Å; L291-M296 HydrophobicContact CB-CG 4.01Å; L291-M296 HydrophobicContact CB-SD 3.78Å; L291-M296 HydrophobicContact CD1-SD 4.07Å; L291-M296 HydrophobicContact CG-SD 4.26Å; L291-L299 HydrophobicContact CD1-CD1 3.5Å |
| 292 | S | 93.6 | Very high | 94.5 | Very high | 69 Ų | 69 | 61 Ų | 61 | 48% | 0.483 | 31% | 0.313 | S | S | . | . | trans | -60.1 | 146.4 | 171.9 | 51.8 | 0 | 0 | 0 | 0 | 110.7 | K294 N295 M296 | S292-K294 VanDerWaalsContact C-N 3.28Å; S292-K294 PolarHBondContact O-N 3.06Å; S292-N295 WeakPolarHBondContact O-CA 3.36Å; S292-N295 WeakPolarHBondContact O-CB 3.22Å; S292-N295 PolarHBondContact O-N 3.37Å; S292-N295 PolarHBondContact OG-ND2 3.46Å; S292-M296 PolarHBondContact O-N 2.78Å | ||
| 293 | F | 91.4 | Very high | 94.4 | Very high | 103 Ų | 103 | 59.3 Ų | 59.3 | 45% | 0.452 | 30% | 0.303 | S | S | . | . | H | α-helix | trans | -45.8 | -49.3 | 179.1 | -176 | -99.6 | 0 | 0 | 0 | 112.6 | P240 L245 N295 M296 C297 | P240-F293 WeakPolarHBondContact O-CZ 3.2Å; L245-F293 HydrophobicContact CD1-CD2 3.61Å; L245-F293 HydrophobicContact CD1-CE2 3.51Å; L245-F293 HydrophobicContact CD1-CZ 4.39Å; F293-N295 PolarHBondContact O-N 3.13Å; F293-N295 VanDerWaalsContact O-N 3.11Å; F293-M296 WeakPolarHBondContact O-CA 3.31Å; F293-M296 WeakPolarHBondContact O-CB 3.48Å; F293-M296 PolarHBondContact O-N 3.04Å; F293-C297 VanDerWaalsContact CE1-SG 3.59Å; F293-C297 PolarHBondContact O-N 3.19Å; F293-C297 PolarHBondContact O-SG 3.32Å |
| 294 | K | 91.9 | Very high | 94.3 | Very high | 156 Ų | 156 | 61.4 Ų | 61.4 | 68% | 0.678 | 31% | 0.314 | S | S | * | . | H | α-helix | trans | -58.2 | -24.6 | 175.5 | -175.6 | 165.7 | -176.1 | 163 | 0 | 115.3 | S292 K298 | S292-K294 VanDerWaalsContact C-N 3.28Å; S292-K294 PolarHBondContact O-N 3.06Å; K294-K298 VanDerWaalsContact O-CG 3.31Å; K294-K298 WeakPolarHBondContact O-CG 3.44Å |
| 295 | N | 93.2 | Very high | 94.1 | Very high | 78 Ų | 78 | 64 Ų | 64 | 42% | 0.417 | 32% | 0.32 | S | S | . | . | H | α-helix | trans | -88.2 | -33.7 | 171.9 | -74.7 | -10.8 | 0 | 0 | 0 | 112 | L291 S292 F293 K298 L299 | L291-N295 HydrophobicContact CB-CB 4.2Å; S292-N295 WeakPolarHBondContact O-CA 3.36Å; S292-N295 WeakPolarHBondContact O-CB 3.22Å; S292-N295 PolarHBondContact O-N 3.37Å; S292-N295 PolarHBondContact OG-ND2 3.46Å; F293-N295 PolarHBondContact O-N 3.13Å; F293-N295 VanDerWaalsContact O-N 3.11Å; N295-K298 PolarHBondContact O-N 3.28Å; N295-L299 WeakPolarHBondContact O-CG 3.44Å; N295-L299 PolarHBondContact O-N 3.37Å |
| 296 | M | 94.3 | Very high | 93.9 | Very high | 7 Ų | 7 | 58.5 Ų | 58.5 | 3% | 0.034 | 30% | 0.299 | C | S | . | . | H | α-helix | trans | -61.2 | -51.5 | 172.5 | -68.1 | -64.2 | -65.5 | 0 | 0 | 111 | L245 F286 L289 L291 S292 F293 K298 L299 K300 | L245-M296 HydrophobicContact CD1-CB 3.78Å; L245-M296 HydrophobicContact CD2-CB 4.03Å; L245-M296 HydrophobicContact CG-CB 4.46Å; F286-M296 HydrophobicContact CB-SD 4.45Å; F286-M296 HydrophobicContact CD1-CE 4.24Å; F286-M296 HydrophobicContact CD2-CE 3.53Å; F286-M296 HydrophobicContact CD2-SD 3.44Å; F286-M296 WeakPolarHBondContact CD2-SD 3.2Å; F286-M296 HydrophobicContact CE1-CE 4.15Å; F286-M296 HydrophobicContact CE2-CB 4.48Å; F286-M296 HydrophobicContact CE2-CE 3.44Å; F286-M296 VanDerWaalsContact CE2-CE 3.44Å; F286-M296 HydrophobicContact CE2-SD 3.8Å; F286-M296 HydrophobicContact CG-CE 3.94Å; F286-M296 HydrophobicContact CG-SD 4.06Å; F286-M296 HydrophobicContact CZ-CE 3.76Å; L289-M296 HydrophobicContact CD2-CE 3.55Å; L291-M296 HydrophobicContact CB-CG 4.01Å; L291-M296 HydrophobicContact CB-SD 3.78Å; L291-M296 HydrophobicContact CD1-SD 4.07Å; L291-M296 HydrophobicContact CG-SD 4.26Å; S292-M296 PolarHBondContact O-N 2.78Å; F293-M296 WeakPolarHBondContact O-CA 3.31Å; F293-M296 WeakPolarHBondContact O-CB 3.48Å; F293-M296 PolarHBondContact O-N 3.04Å; M296-K298 PolarHBondContact O-N 2.81Å; M296-L299 PolarHBondContact O-N 2.83Å; M296-K300 PolarHBondContact O-N 3.15Å |
| 297 | C | 93.6 | Very high | 93.6 | Very high | 36 Ų | 36 | 58.6 Ų | 58.6 | 24% | 0.243 | 30% | 0.299 | C | S | . | . | H | α-helix | trans | -59.5 | -32.2 | 177.7 | -51 | 0 | 0 | 0 | 0 | 112.7 | F293 P301 | F293-C297 VanDerWaalsContact CE1-SG 3.59Å; F293-C297 PolarHBondContact O-N 3.19Å; F293-C297 PolarHBondContact O-SG 3.32Å; C297-P301 WeakPolarHBondContact O-CD 3.37Å |
| 298 | K | 92.2 | Very high | 93.4 | Very high | 138 Ų | 138 | 62.6 Ų | 62.6 | 60% | 0.6 | 32% | 0.318 | S | S | * | . | H | α-helix | trans | -72.8 | -24.9 | 175.3 | -79.6 | -174.9 | 172.1 | -151.2 | 0 | 114.4 | K294 N295 M296 | K294-K298 VanDerWaalsContact O-CG 3.31Å; K294-K298 WeakPolarHBondContact O-CG 3.44Å; N295-K298 PolarHBondContact O-N 3.28Å; M296-K298 PolarHBondContact O-N 2.81Å |
| 299 | L | 93.6 | Very high | 93 | Very high | 16 Ų | 16 | 63.7 Ų | 63.7 | 8% | 0.084 | 32% | 0.315 | C | S | . | . | H | α-helix | trans | -95.2 | -29.8 | -179.9 | -70.5 | 172.6 | 0 | 0 | 0 | 112.3 | F278 T282 F286 L291 N295 M296 L302 L303 | F278-L299 HydrophobicContact CD1-CD2 4.21Å; F278-L299 HydrophobicContact CE1-CD2 3.63Å; F278-L299 HydrophobicContact CZ-CD2 3.83Å; T282-L299 HydrophobicContact CG2-CD1 3.92Å; F286-L299 HydrophobicContact CD2-CB 3.64Å; F286-L299 HydrophobicContact CD2-CD1 3.93Å; F286-L299 HydrophobicContact CD2-CG 4.46Å; F286-L299 HydrophobicContact CE2-CB 3.64Å; L291-L299 HydrophobicContact CD1-CD1 3.5Å; N295-L299 WeakPolarHBondContact O-CG 3.44Å; N295-L299 PolarHBondContact O-N 3.37Å; M296-L299 PolarHBondContact O-N 2.83Å; L299-L302 PolarHBondContact O-N 2.94Å; L299-L303 HydrophobicContact CB-CD1 3.91Å; L299-L303 WeakPolarHBondContact O-CB 3.44Å; L299-L303 WeakPolarHBondContact O-CG 3.39Å; L299-L303 PolarHBondContact O-N 3.11Å |
| 300 | K | 94.2 | Very high | 92.6 | Very high | 45 Ų | 45 | 60.5 Ų | 60.5 | 20% | 0.196 | 30% | 0.299 | C | S | . | . | H | α-helix | trans | -45.5 | -55.3 | 177 | -168.7 | -174.9 | -171.2 | 174.6 | 0 | 113.1 | P240 L245 F248 M296 L302 L303 N304 | P240-K300 HydrophobicContact CB-CD 4.14Å; P240-K300 HydrophobicContact CG-CD 4.22Å; L245-K300 HydrophobicContact CD2-CB 4.05Å; L245-K300 HydrophobicContact CD2-CD 3.89Å; L245-K300 HydrophobicContact CD2-CG 4.27Å; F248-K300 HydrophobicContact CD1-CG 3.87Å; F248-K300 HydrophobicContact CD2-CG 4.38Å; F248-K300 HydrophobicContact CE1-CG 4.11Å; F248-K300 HydrophobicContact CG-CG 4.02Å; F248-K300 HydrophobicContact CZ-CG 4.48Å; M296-K300 PolarHBondContact O-N 3.15Å; K300-L302 PolarHBondContact O-N 2.82Å; K300-L303 PolarHBondContact O-N 2.76Å; K300-N304 VanDerWaalsContact O-CB 3.23Å; K300-N304 WeakPolarHBondContact O-CB 3.32Å; K300-N304 PolarHBondContact O-N 3.14Å |
| 301 | P | 93.1 | Very high | 92.1 | Very high | 77 Ų | 77 | 56.5 Ų | 56.5 | 50% | 0.5 | 28% | 0.282 | S | S | . | . | H | α-helix | trans | -68.3 | -35.7 | -176.3 | 26.6 | -35 | 0 | 0 | 0 | 113.5 | C297 N304 K305 | C297-P301 WeakPolarHBondContact O-CD 3.37Å; P301-N304 PolarHBondContact O-N 2.89Å; P301-K305 PolarHBondContact O-N 2.99Å |
| 302 | L | 93 | Very high | 91.6 | Very high | 41 Ų | 41 | 59.5 Ų | 59.5 | 22% | 0.215 | 31% | 0.306 | C | S | . | . | H | α-helix | trans | -67.5 | -42.2 | 178.2 | -56.2 | 178.9 | 0 | 0 | 0 | 111.2 | L270 Y274 F278 L299 K300 W306 | L270-L302 HydrophobicContact CD2-CB 4.45Å; L270-L302 WeakPolarHBondContact CD2-O 3.41Å; Y274-L302 HydrophobicContact CD1-CD2 3.79Å; Y274-L302 HydrophobicContact CD2-CD2 4.17Å; Y274-L302 HydrophobicContact CE1-CD2 3.57Å; Y274-L302 HydrophobicContact CE2-CB 4.15Å; Y274-L302 HydrophobicContact CE2-CD2 3.97Å; Y274-L302 HydrophobicContact CG-CD2 4.07Å; F278-L302 HydrophobicContact CE2-CD1 4.05Å; F278-L302 HydrophobicContact CZ-CD1 3.77Å; L299-L302 PolarHBondContact O-N 2.94Å; K300-L302 PolarHBondContact O-N 2.82Å; L302-W306 PolarHBondContact O-N 3.4Å |
| 303 | L | 94.4 | Very high | 90.4 | Very high | 1 Ų | 1 | 58 Ų | 58 | 1% | 0.005 | 30% | 0.295 | C | S | . | . | H | α-helix | trans | -72.1 | -35.8 | 177.7 | -69.5 | 167.2 | 0 | 0 | 0 | 111.8 | F248 F252 V266 L270 I283 F286 L299 K300 L307 | F248-L303 HydrophobicContact CE1-CB 3.94Å; F248-L303 HydrophobicContact CZ-CB 3.9Å; F252-L303 HydrophobicContact CD2-CB 3.94Å; F252-L303 HydrophobicContact CE1-CD2 4.23Å; F252-L303 HydrophobicContact CE2-CB 3.76Å; F252-L303 HydrophobicContact CE2-CD2 3.7Å; F252-L303 HydrophobicContact CE2-CG 4.28Å; F252-L303 HydrophobicContact CZ-CB 4.46Å; F252-L303 HydrophobicContact CZ-CD2 3.56Å; V266-L303 HydrophobicContact CG1-CD2 4.02Å; L270-L303 HydrophobicContact CD1-CD2 3.75Å; I283-L303 HydrophobicContact CD1-CD2 3.95Å; F286-L303 HydrophobicContact CB-CD1 4.4Å; F286-L303 HydrophobicContact CD1-CD1 3.47Å; F286-L303 VanDerWaalsContact CD1-CD1 3.47Å; F286-L303 HydrophobicContact CD2-CD1 3.66Å; F286-L303 HydrophobicContact CE1-CD1 3.51Å; F286-L303 HydrophobicContact CE2-CD1 3.68Å; F286-L303 HydrophobicContact CG-CD1 3.55Å; F286-L303 HydrophobicContact CZ-CD1 3.61Å; L299-L303 HydrophobicContact CB-CD1 3.91Å; L299-L303 WeakPolarHBondContact O-CB 3.44Å; L299-L303 WeakPolarHBondContact O-CG 3.39Å; L299-L303 PolarHBondContact O-N 3.11Å; K300-L303 PolarHBondContact O-N 2.76Å; L303-L307 VanDerWaalsContact O-CB 3.29Å; L303-L307 WeakPolarHBondContact O-CB 3.38Å; L303-L307 PolarHBondContact O-N 3.42Å |
| 304 | N | 93.7 | Very high | 88.9 | Confident | 47 Ų | 47 | 57.4 Ų | 57.4 | 25% | 0.251 | 30% | 0.3 | S | S | . | . | H | α-helix | trans | -65.4 | -52.3 | 177.8 | -171 | 83.7 | 0 | 0 | 0 | 111 | F248 K300 P301 W306 L307 E308 | F248-N304 HydrophobicContact CE2-CB 3.74Å; F248-N304 WeakPolarHBondContact CE2-OD1 3.42Å; F248-N304 HydrophobicContact CZ-CB 3.92Å; K300-N304 VanDerWaalsContact O-CB 3.23Å; K300-N304 WeakPolarHBondContact O-CB 3.32Å; K300-N304 PolarHBondContact O-N 3.14Å; P301-N304 PolarHBondContact O-N 2.89Å; N304-W306 PolarHBondContact O-N 3.14Å; N304-L307 CarbonylContact O-C 3.6Å; N304-L307 WeakPolarHBondContact O-CA 3.4Å; N304-L307 WeakPolarHBondContact O-CB 3.16Å; N304-L307 PolarHBondContact O-N 2.96Å; N304-E308 PolarHBondContact ND2-OE1 2.59Å; N304-E308 PolarHBondContact ND2-OE2 3.09Å; N304-E308 VanDerWaalsContact ND2-OE2 3.11Å; N304-E308 WeakPolarHBondContact O-CG 3.49Å; N304-E308 PolarHBondContact O-N 2.79Å |
| 305 | K | 91.5 | Very high | 87 | Confident | 101 Ų | 101 | 53.7 Ų | 53.7 | 44% | 0.439 | 31% | 0.307 | S | S | . | . | H | α-helix | trans | -61.1 | -41.5 | 179 | 172.3 | 164 | 172.8 | 172.7 | 0 | 112.7 | Y274 P301 L307 E308 E309 | Y274-K305 WeakPolarHBondContact OH-CD 3.45Å; P301-K305 PolarHBondContact O-N 2.99Å; K305-L307 VanDerWaalsContact C-N 3.27Å; K305-L307 PolarHBondContact O-N 2.97Å; K305-E308 WeakPolarHBondContact CA-OE2 3.32Å; K305-E308 PolarHBondContact O-N 3.11Å; K305-E309 WeakPolarHBondContact CE-OE1 3.38Å; K305-E309 IonicContact NZ-OE1 3.71Å; K305-E309 WeakPolarHBondContact O-CG 3.18Å; K305-E309 PolarHBondContact O-N 3.28Å |
| 306 | W | 92 | Very high | 84.6 | Confident | 12 Ų | 12 | 52.7 Ų | 52.7 | 5% | 0.045 | 31% | 0.306 | C | S | . | . | H | α-helix | trans | -61.3 | -37.7 | 172.7 | 173.7 | 83 | 0 | 0 | 0 | 112.2 | F252 R256 F261 V266 L270 L273 L302 N304 A310 | F252-W306 AromaticContact CE2-CE3 3.75Å; F252-W306 HydrophobicContact CE2-CE3 3.75Å; F252-W306 AromaticContact CE2-CZ3 3.88Å; F252-W306 HydrophobicContact CE2-CZ3 3.88Å; F252-W306 HydrophobicContact CZ-CE3 4.06Å; F252-W306 AromaticContact CZ-CZ3 3.94Å; F252-W306 HydrophobicContact CZ-CZ3 3.94Å; R256-W306 HydrophobicContact CG-CH2 4.49Å; F261-W306 HydrophobicContact CB-CH2 4.29Å; F261-W306 HydrophobicContact CD1-CZ2 4.32Å; F261-W306 AromaticContact CD2-CH2 3.56Å; F261-W306 HydrophobicContact CD2-CH2 3.56Å; F261-W306 AromaticContact CD2-CZ2 3.72Å; F261-W306 HydrophobicContact CD2-CZ2 3.72Å; F261-W306 HydrophobicContact CE1-CZ2 4.4Å; F261-W306 HydrophobicContact CE2-CH2 4Å; F261-W306 AromaticContact CE2-CZ2 3.81Å; F261-W306 HydrophobicContact CE2-CZ2 3.81Å; F261-W306 AromaticContact CG-CH2 3.98Å; F261-W306 HydrophobicContact CG-CH2 3.98Å; F261-W306 AromaticContact CG-CZ2 3.97Å; F261-W306 HydrophobicContact CG-CZ2 3.97Å; F261-W306 HydrophobicContact CZ-CZ2 4.14Å; V266-W306 HydrophobicContact CG1-CD2 4.49Å; V266-W306 HydrophobicContact CG1-CE3 4.41Å; V266-W306 HydrophobicContact CG2-CE3 4.38Å; V266-W306 HydrophobicContact CG2-CH2 3.54Å; V266-W306 HydrophobicContact CG2-CZ2 3.83Å; V266-W306 HydrophobicContact CG2-CZ3 3.83Å; L270-W306 HydrophobicContact CD2-CB 3.61Å; L270-W306 HydrophobicContact CD2-CG 4.11Å; L270-W306 HydrophobicContact CG-CB 4.42Å; L270-W306 HydrophobicContact CG-CG 4.43Å; L273-W306 HydrophobicContact CD1-CB 4.42Å; L302-W306 PolarHBondContact O-N 3.4Å; N304-W306 PolarHBondContact O-N 3.14Å; W306-A310 HydrophobicContact CH2-CB 4.16Å; W306-A310 HydrophobicContact CZ2-CB 4.1Å; W306-A310 HydrophobicContact CZ3-CB 4.45Å; W306-A310 VanDerWaalsContact O-CB 3.24Å; W306-A310 WeakPolarHBondContact O-CB 3.44Å; W306-A310 PolarHBondContact O-N 3.23Å |
| 307 | L | 92.9 | Very high | 82.3 | Confident | 1 Ų | 1 | 57.5 Ų | 57.5 | 1% | 0.005 | 34% | 0.337 | C | S | . | . | H | α-helix | trans | -69.3 | -38.8 | 179.3 | -164.7 | 70 | 0 | 0 | 0 | 111.8 | F252 R255 L303 N304 K305 A310 D311 | F252-L307 HydrophobicContact CB-CD2 4.48Å; F252-L307 HydrophobicContact CD2-CB 4.34Å; F252-L307 HydrophobicContact CD2-CD1 4.19Å; F252-L307 HydrophobicContact CD2-CD2 4.03Å; F252-L307 HydrophobicContact CD2-CG 4.45Å; F252-L307 HydrophobicContact CE2-CB 4.44Å; F252-L307 HydrophobicContact CE2-CD1 4.27Å; R255-L307 HydrophobicContact CB-CD1 3.79Å; R255-L307 HydrophobicContact CB-CD2 4.19Å; R255-L307 HydrophobicContact CB-CG 4.34Å; R255-L307 HydrophobicContact CG-CD2 4.49Å; R255-L307 VanDerWaalsContact NH1-CD2 3.32Å; L303-L307 VanDerWaalsContact O-CB 3.29Å; L303-L307 WeakPolarHBondContact O-CB 3.38Å; L303-L307 PolarHBondContact O-N 3.42Å; N304-L307 CarbonylContact O-C 3.6Å; N304-L307 WeakPolarHBondContact O-CA 3.4Å; N304-L307 WeakPolarHBondContact O-CB 3.16Å; N304-L307 PolarHBondContact O-N 2.96Å; K305-L307 VanDerWaalsContact C-N 3.27Å; K305-L307 PolarHBondContact O-N 2.97Å; L307-A310 PolarHBondContact O-N 2.9Å; L307-D311 WeakPolarHBondContact O-CB 3.44Å; L307-D311 PolarHBondContact O-N 2.79Å |
| 308 | E | 91.4 | Very high | 80.2 | Confident | 102 Ų | 102 | 59.7 Ų | 59.7 | 48% | 0.477 | 35% | 0.35 | S | S | . | . | H | α-helix | trans | -64.3 | -44.1 | 174.2 | -70 | 164.6 | 157.8 | 0 | 0 | 111.8 | N304 K305 A310 S312 | N304-E308 PolarHBondContact ND2-OE1 2.59Å; N304-E308 PolarHBondContact ND2-OE2 3.09Å; N304-E308 VanDerWaalsContact ND2-OE2 3.11Å; N304-E308 WeakPolarHBondContact O-CG 3.49Å; N304-E308 PolarHBondContact O-N 2.79Å; K305-E308 WeakPolarHBondContact CA-OE2 3.32Å; K305-E308 PolarHBondContact O-N 3.11Å; E308-A310 VanDerWaalsContact C-N 3.32Å; E308-A310 PolarHBondContact O-N 3.17Å; E308-S312 WeakPolarHBondContact O-CB 3.41Å; E308-S312 PolarHBondContact O-N 3Å; E308-S312 PolarHBondContact O-OG 3.03Å |
| 309 | E | 88.2 | Confident | 78.1 | Confident | 69 Ų | 69 | 55.6 Ų | 55.6 | 32% | 0.322 | 34% | 0.339 | S | S | . | . | H | α-helix | trans | -62.7 | -37.7 | 173.3 | -72.8 | 176.6 | -174 | 0 | 0 | 111.9 | L273 K305 S313 | L273-E309 VanDerWaalsContact CD1-OE2 3.28Å; L273-E309 WeakPolarHBondContact CD1-OE2 3.46Å; L273-E309 WeakPolarHBondContact CD2-OE2 3.38Å; K305-E309 WeakPolarHBondContact CE-OE1 3.38Å; K305-E309 IonicContact NZ-OE1 3.71Å; K305-E309 WeakPolarHBondContact O-CG 3.18Å; K305-E309 PolarHBondContact O-N 3.28Å; E309-S313 VanDerWaalsContact O-CB 3.29Å; E309-S313 WeakPolarHBondContact O-CB 3.45Å; E309-S313 PolarHBondContact O-N 3.34Å; E309-S313 VanDerWaalsContact O-N 3.16Å; E309-S313 PolarHBondContact O-OG 3.34Å |
| 310 | A | 87.3 | Confident | 76.2 | Confident | 3 Ų | 3 | 56.6 Ų | 56.6 | 3% | 0.025 | 34% | 0.344 | C | S | . | . | H | α-helix | trans | -71.2 | -50.8 | 178.4 | 0 | 0 | 0 | 0 | 0 | 112.7 | L259 F261 W306 L307 E308 S312 S313 T314 | L259-A310 HydrophobicContact CD1-CB 3.77Å; F261-A310 HydrophobicContact CE2-CB 4.14Å; W306-A310 HydrophobicContact CH2-CB 4.16Å; W306-A310 HydrophobicContact CZ2-CB 4.1Å; W306-A310 HydrophobicContact CZ3-CB 4.45Å; W306-A310 VanDerWaalsContact O-CB 3.24Å; W306-A310 WeakPolarHBondContact O-CB 3.44Å; W306-A310 PolarHBondContact O-N 3.23Å; L307-A310 PolarHBondContact O-N 2.9Å; E308-A310 VanDerWaalsContact C-N 3.32Å; E308-A310 PolarHBondContact O-N 3.17Å; A310-S312 PolarHBondContact O-N 3.15Å; A310-S313 PolarHBondContact O-N 2.61Å; A310-T314 VanDerWaalsContact O-CG2 3.28Å; A310-T314 WeakPolarHBondContact O-CG2 3.25Å; A310-T314 PolarHBondContact O-N 3.49Å |
| 311 | D | 84.9 | Confident | 74.2 | Confident | 47 Ų | 47 | 59.6 Ų | 59.6 | 25% | 0.251 | 36% | 0.362 | S | S | . | . | H | α-helix | trans | -57.6 | -48.3 | 176.2 | -78.3 | -36.3 | 0 | 0 | 0 | 110 | R255 L307 S313 T314 | R255-D311 WeakPolarHBondContact CD-OD1 3.5Å; R255-D311 WeakPolarHBondContact CD-OD2 3.45Å; R255-D311 IonicContact CZ-OD2 3.62Å; R255-D311 IonicContact NE-OD2 2.86Å; R255-D311 PolarHBondContact NE-OD2 2.86Å; R255-D311 IonicContact NH1-OD2 3.31Å; R255-D311 PolarHBondContact NH1-OD2 3.4Å; L307-D311 WeakPolarHBondContact O-CB 3.44Å; L307-D311 PolarHBondContact O-N 2.79Å; D311-S313 VanDerWaalsContact C-N 3.29Å; D311-S313 PolarHBondContact O-N 2.74Å; D311-T314 PolarHBondContact O-N 3.31Å; D311-T314 PolarHBondContact O-OG1 3.21Å |
| 312 | S | 83.1 | Confident | 72.1 | Confident | 100 Ų | 100 | 62.6 Ų | 62.6 | 70% | 0.699 | 37% | 0.367 | S | S | * | . | H | α-helix | trans | -61.4 | -34.3 | 179.9 | -57.9 | 0 | 0 | 0 | 0 | 113.2 | E308 A310 T314 | E308-S312 WeakPolarHBondContact O-CB 3.41Å; E308-S312 PolarHBondContact O-N 3Å; E308-S312 PolarHBondContact O-OG 3.03Å; A310-S312 PolarHBondContact O-N 3.15Å; S312-T314 VanDerWaalsContact C-N 3.33Å; S312-T314 PolarHBondContact O-N 3.25Å |
| 313 | S | 69.1 | Low | 70.3 | Confident | 37 Ų | 37 | 63.8 Ų | 63.8 | 26% | 0.259 | 37% | 0.373 | S | S | . | . | H | α-helix | trans | -76.8 | -14.5 | -178.1 | -66.3 | 0 | 0 | 0 | 0 | 114.2 | E309 A310 D311 G315 S316 | E309-S313 VanDerWaalsContact O-CB 3.29Å; E309-S313 WeakPolarHBondContact O-CB 3.45Å; E309-S313 PolarHBondContact O-N 3.34Å; E309-S313 VanDerWaalsContact O-N 3.16Å; E309-S313 PolarHBondContact O-OG 3.34Å; A310-S313 PolarHBondContact O-N 2.61Å; D311-S313 VanDerWaalsContact C-N 3.29Å; D311-S313 PolarHBondContact O-N 2.74Å; S313-G315 PolarHBondContact O-N 2.96Å; S313-S316 PolarHBondContact O-N 3.38Å; S313-S316 VanDerWaalsContact O-O 3.14Å |
| 314 | T | 58.6 | Low | 68.4 | Low | 91 Ų | 91 | 65.8 Ų | 65.8 | 56% | 0.558 | 39% | 0.39 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -67 | -9.3 | -174.1 | 59.2 | 0 | 0 | 0 | 0 | 115.1 | L259 A310 D311 S312 S316 | L259-T314 HydrophobicContact CD1-CG2 4.12Å; L259-T314 HydrophobicContact CD2-CG2 3.57Å; L259-T314 HydrophobicContact CG-CG2 4.42Å; A310-T314 VanDerWaalsContact O-CG2 3.28Å; A310-T314 WeakPolarHBondContact O-CG2 3.25Å; A310-T314 PolarHBondContact O-N 3.49Å; D311-T314 PolarHBondContact O-N 3.31Å; D311-T314 PolarHBondContact O-OG1 3.21Å; S312-T314 VanDerWaalsContact C-N 3.33Å; S312-T314 PolarHBondContact O-N 3.25Å; T314-S316 VanDerWaalsContact C-N 3.3Å; T314-S316 PolarHBondContact O-N 3.16Å |
| 315 | G | 52.5 | Low | 66.3 | Low | 79 Ų | 79 | 67.5 Ų | 67.5 | 81% | 0.814 | 41% | 0.41 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -73 | -12.8 | 169.1 | 0 | 0 | 0 | 0 | 0 | 115 | S313 | S313-G315 PolarHBondContact O-N 2.96Š|
| 316 | S | 42.2 | Very low | 64.3 | Low | 56 Ų | 56 | 68 Ų | 68 | 39% | 0.392 | 41% | 0.414 | S | S | . | . | trans | -150.1 | 114.1 | 177.5 | -178.8 | 0 | 0 | 0 | 0 | 112.2 | S313 T314 T318 | S313-S316 PolarHBondContact O-N 3.38Å; S313-S316 VanDerWaalsContact O-O 3.14Å; T314-S316 VanDerWaalsContact C-N 3.3Å; T314-S316 PolarHBondContact O-N 3.16Å; S316-T318 PolarHBondContact O-N 3.22Å; S316-T318 PolarHBondContact OG-OG1 3.36Å | ||
| 317 | P | 46.3 | Very low | 62.5 | Low | 108 Ų | 108 | 70.1 Ų | 70.1 | 70% | 0.701 | 44% | 0.44 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -77.2 | 33.9 | -173.3 | 34.3 | -38.4 | 0 | 0 | 0 | 113.6 | ||
| 318 | T | 49.1 | Very low | 60.6 | Low | 83 Ų | 83 | 78.4 Ų | 78.4 | 51% | 0.509 | 47% | 0.471 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -119.1 | -9 | -168.1 | 62.5 | 0 | 0 | 0 | 0 | 114.8 | S316 K322 | S316-T318 PolarHBondContact O-N 3.22Å; S316-T318 PolarHBondContact OG-OG1 3.36Å; T318-K322 WeakPolarHBondContact O-CD 3.43Å; T318-K322 VanDerWaalsContact O-CE 3.24Å; T318-K322 WeakPolarHBondContact O-CE 3.27Å; T318-K322 PolarHBondContact O-NZ 3.1Å |
| 319 | S | 49 | Very low | 59 | Low | 52 Ų | 52 | 83.7 Ų | 83.7 | 36% | 0.364 | 49% | 0.493 | S | S | . | . | S | Bend | trans | -97.1 | -46.4 | 177.1 | 56.5 | 0 | 0 | 0 | 0 | 112.9 | ||
| 320 | I | 53.8 | Low | 57.3 | Low | 37 Ų | 37 | 87.1 Ų | 87.1 | 19% | 0.19 | 50% | 0.503 | C | S | . | . | S | Bend | trans | -74.2 | -42.5 | -164.5 | -94.6 | 166.3 | 0 | 0 | 0 | 114.2 | F261 K322 I323 A324 | F261-I320 HydrophobicContact CE1-CG2 3.91Å; F261-I320 HydrophobicContact CZ-CD1 4.04Å; F261-I320 HydrophobicContact CZ-CG1 4.4Å; F261-I320 HydrophobicContact CZ-CG2 3.59Å; I320-K322 PolarHBondContact O-N 3.42Å; I320-K322 VanDerWaalsContact O-N 3.15Å; I320-I323 WeakPolarHBondContact O-CB 3.5Å; I320-I323 PolarHBondContact O-N 3.09Å; I320-A324 PolarHBondContact O-N 3.04Å; I320-A324 VanDerWaalsContact O-N 3.13Å |
| 321 | D | 52 | Low | 55.9 | Low | 107 Ų | 107 | 96.2 Ų | 96.2 | 57% | 0.572 | 54% | 0.542 | S | S | * | . | H | α-helix | trans | -59.5 | -31.5 | -179.6 | -69.9 | -58.1 | 0 | 0 | 0 | 112.3 | I323 A324 A325 | D321-I323 VanDerWaalsContact C-N 3.26Å; D321-I323 PolarHBondContact O-N 3.41Å; D321-A324 PolarHBondContact O-N 3.22Å; D321-A325 WeakPolarHBondContact O-CB 3.28Å; D321-A325 PolarHBondContact O-N 2.67Å |
| 322 | K | 49.8 | Very low | 54.7 | Low | 141 Ų | 141 | 103.1 Ų | 103.1 | 61% | 0.613 | 57% | 0.57 | S | S | * | * | H | α-helix | trans | -67.5 | -25.2 | 176.5 | -62.9 | 171.1 | -178 | 154.9 | 0 | 112.8 | T318 I320 Q326 | T318-K322 WeakPolarHBondContact O-CD 3.43Å; T318-K322 VanDerWaalsContact O-CE 3.24Å; T318-K322 WeakPolarHBondContact O-CE 3.27Å; T318-K322 PolarHBondContact O-NZ 3.1Å; I320-K322 PolarHBondContact O-N 3.42Å; I320-K322 VanDerWaalsContact O-N 3.15Å; K322-Q326 WeakPolarHBondContact O-CG 3.15Å |
| 323 | I | 55.1 | Low | 54.1 | Low | 66 Ų | 66 | 108.8 Ų | 108.8 | 34% | 0.338 | 58% | 0.576 | S | S | . | * | H | α-helix | trans | -84.3 | -43.9 | 176.7 | -57.4 | 174.9 | 0 | 0 | 0 | 109.8 | A269 T272 I320 D321 A325 Q326 | A269-I323 HydrophobicContact CB-CG2 4.17Å; T272-I323 HydrophobicContact CG2-CG2 4.48Å; I320-I323 WeakPolarHBondContact O-CB 3.5Å; I320-I323 PolarHBondContact O-N 3.09Å; D321-I323 VanDerWaalsContact C-N 3.26Å; D321-I323 PolarHBondContact O-N 3.41Å; I323-A325 VanDerWaalsContact C-N 3.33Å; I323-A325 PolarHBondContact O-N 3.19Å; I323-Q326 PolarHBondContact O-N 2.97Å |
| 324 | A | 53.1 | Low | 54.5 | Low | 43 Ų | 43 | 110.7 Ų | 110.7 | 36% | 0.355 | 59% | 0.586 | S | S | . | * | H | α-helix | trans | -62.4 | -38.7 | 176.1 | 0 | 0 | 0 | 0 | 0 | 112.4 | I320 D321 Q326 | I320-A324 PolarHBondContact O-N 3.04Å; I320-A324 VanDerWaalsContact O-N 3.13Å; D321-A324 PolarHBondContact O-N 3.22Å; A324-Q326 VanDerWaalsContact C-N 3.32Å; A324-Q326 PolarHBondContact O-N 3.27Å |
| 325 | A | 50.2 | Low | 55.5 | Low | 83 Ų | 83 | 111.4 Ų | 111.4 | 69% | 0.686 | 59% | 0.594 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -71.7 | -17.3 | 179.9 | 0 | 0 | 0 | 0 | 0 | 114.8 | D321 I323 G327 | D321-A325 WeakPolarHBondContact O-CB 3.28Å; D321-A325 PolarHBondContact O-N 2.67Å; I323-A325 VanDerWaalsContact C-N 3.33Å; I323-A325 PolarHBondContact O-N 3.19Å; A325-G327 VanDerWaalsContact C-N 3.25Å; A325-G327 PolarHBondContact O-N 3.45Å |
| 326 | Q | 50.7 | Low | 56.9 | Low | 110 Ų | 110 | 109.9 Ų | 109.9 | 51% | 0.514 | 57% | 0.567 | S | S | . | * | trans | -80 | 69.9 | 179.4 | -78.2 | -168.3 | 19.9 | 0 | 0 | 112.3 | K322 I323 A324 R328 | K322-Q326 WeakPolarHBondContact O-CG 3.15Å; I323-Q326 PolarHBondContact O-N 2.97Å; A324-Q326 VanDerWaalsContact C-N 3.32Å; A324-Q326 PolarHBondContact O-N 3.27Å; Q326-R328 VanDerWaalsContact C-N 3.3Å; Q326-R328 PolarHBondContact O-N 3.39Å | ||
| 327 | G | 53.2 | Low | 59.1 | Low | 58 Ų | 58 | 113.7 Ų | 113.7 | 60% | 0.598 | 58% | 0.579 | S | S | * | * | trans | -65 | 70.3 | -177.6 | 0 | 0 | 0 | 0 | 0 | 115.8 | A325 K329 | A325-G327 VanDerWaalsContact C-N 3.25Å; A325-G327 PolarHBondContact O-N 3.45Å; G327-K329 PolarHBondContact O-N 3.07Å; G327-K329 VanDerWaalsContact O-N 3.15Å | ||
| 328 | R | 53.9 | Low | 61.1 | Low | 174 Ų | 174 | 114.7 Ų | 114.7 | 66% | 0.657 | 58% | 0.582 | S | S | * | * | trans | -66.5 | 109.2 | 168 | -63.3 | -170.7 | -169.3 | -130.9 | 2.4 | 109.4 | Q326 R330 | Q326-R328 VanDerWaalsContact C-N 3.3Å; Q326-R328 PolarHBondContact O-N 3.39Å; R328-R330 PolarHBondContact O-N 3.48Å | ||
| 329 | K | 57.1 | Low | 62.9 | Low | 213 Ų | 213 | 114.4 Ų | 114.4 | 93% | 0.926 | 58% | 0.584 | S | S | * | * | trans | -59.4 | 107.6 | -178.9 | -72.4 | 178.6 | 178.4 | 173.7 | 0 | 111.2 | G327 | G327-K329 PolarHBondContact O-N 3.07Å; G327-K329 VanDerWaalsContact O-N 3.15Å | ||
| 330 | R | 51.5 | Low | 65 | Low | 141 Ų | 141 | 113 Ų | 113 | 53% | 0.532 | 57% | 0.573 | S | S | . | * | P | Polyproline II helix | trans | -52.2 | 134.6 | 174.8 | 178.8 | 178.5 | 165.5 | -130.3 | -11 | 111.6 | V277 S279 R328 K332 | V277-R330 HydrophobicContact CB-CB 4.28Å; V277-R330 HydrophobicContact CB-CG 4.17Å; V277-R330 HydrophobicContact CG1-CB 4.02Å; V277-R330 HydrophobicContact CG1-CG 4.07Å; S279-R330 VanDerWaalsContact CB-CZ 3.43Å; R328-R330 PolarHBondContact O-N 3.48Å; R330-K332 PolarHBondContact O-N 3.45Å; R330-K332 VanDerWaalsContact O-N 3.13Å |
| 331 | K | 58.7 | Low | 66.8 | Low | 195 Ų | 195 | 115.4 Ų | 115.4 | 85% | 0.848 | 58% | 0.582 | S | S | * | * | P | Polyproline II helix | trans | -56.6 | 117.8 | 176.7 | -170.6 | 169.4 | -177.8 | 175.2 | 0 | 110.2 | ||
| 332 | K | 58.8 | Low | 68.7 | Low | 192 Ų | 192 | 112 Ų | 112 | 84% | 0.835 | 57% | 0.573 | S | S | * | * | P | Polyproline II helix | trans | -65 | 134.9 | 178.6 | -168.4 | 175.7 | 179.6 | -177.6 | 0 | 108.9 | R330 | R330-K332 PolarHBondContact O-N 3.45Å; R330-K332 VanDerWaalsContact O-N 3.13Å |
| 333 | R | 70.8 | Confident | 70.8 | Confident | 219 Ų | 219 | 107.3 Ų | 107.3 | 83% | 0.826 | 56% | 0.56 | S | S | * | * | P | Polyproline II helix | trans | -68.7 | 135.3 | 170.3 | 171.2 | -175.2 | -98.6 | -159.9 | -5.4 | 108.5 | S335 | R333-S335 PolarHBondContact O-N 2.79Š|
| 334 | T | 79 | Confident | 72.7 | Confident | 77 Ų | 77 | 104.2 Ų | 104.2 | 47% | 0.472 | 54% | 0.544 | S | S | . | . | P | Polyproline II helix | trans | -56.4 | 118.1 | 169.2 | -40.8 | 0 | 0 | 0 | 0 | 109.7 | V372 | T334-V372 HydrophobicContact CG2-CG1 4.3Å; T334-V372 HydrophobicContact CG2-CG2 4.15Å |
| 335 | S | 77.8 | Confident | 74.7 | Confident | 106 Ų | 106 | 105 Ų | 105 | 74% | 0.741 | 54% | 0.54 | S | S | * | . | P | Polyproline II helix | trans | -82.1 | 138.1 | 168.4 | -162.9 | 0 | 0 | 0 | 0 | 108 | R333 | R333-S335 PolarHBondContact O-N 2.79Š|
| 336 | I | 83.2 | Confident | 76.7 | Confident | 46 Ų | 46 | 104.1 Ų | 104.1 | 24% | 0.236 | 53% | 0.529 | C | S | . | . | trans | -107.4 | 127.3 | 173.5 | -60.3 | 169.8 | 0 | 0 | 0 | 106.2 | V340 K341 L344 V372 W376 | I336-V340 HydrophobicContact CG2-CB 3.92Å; I336-V340 HydrophobicContact CG2-CG1 3.72Å; I336-K341 HydrophobicContact CG2-CB 4.36Å; I336-L344 HydrophobicContact CG2-CD1 4.28Å; I336-V372 HydrophobicContact CD1-CG1 3.78Å; I336-V372 HydrophobicContact CG1-CG1 4.07Å; I336-W376 HydrophobicContact CD1-CB 4.45Å; I336-W376 HydrophobicContact CD1-CG 4.36Å | ||
| 337 | E | 88.4 | Confident | 78.8 | Confident | 136 Ų | 136 | 101.1 Ų | 101.1 | 64% | 0.636 | 52% | 0.515 | S | S | * | . | trans | -67.3 | 160.6 | -178.8 | -60.6 | -168.7 | 167.8 | 0 | 0 | 112.4 | S339 V340 K341 | E337-S339 VanDerWaalsContact C-N 3.32Å; E337-S339 WeakPolarHBondContact CB-OG 3.33Å; E337-S339 PolarHBondContact O-N 2.95Å; E337-S339 PolarHBondContact OE2-OG 3.32Å; E337-V340 HydrophobicContact CB-CB 4.46Å; E337-V340 HydrophobicContact CB-CG2 4.24Å; E337-V340 PolarHBondContact O-N 3.42Å; E337-K341 VanDerWaalsContact O-CB 3.25Å; E337-K341 WeakPolarHBondContact O-CB 3.38Å; E337-K341 PolarHBondContact O-N 3.05Å | ||
| 338 | V | 88.4 | Confident | 80.7 | Confident | 129 Ų | 129 | 98.5 Ų | 98.5 | 78% | 0.782 | 49% | 0.487 | S | S | * | . | H | α-helix | trans | -64.9 | -38.4 | -178.4 | -175.8 | 0 | 0 | 0 | 0 | 111.3 | G342 | V338-G342 PolarHBondContact O-N 2.91Å |
| 339 | S | 87.4 | Confident | 82.6 | Confident | 78 Ų | 78 | 97 Ų | 97 | 55% | 0.545 | 49% | 0.491 | S | S | . | . | H | α-helix | trans | -54.6 | -58.7 | 170.6 | 46 | 0 | 0 | 0 | 0 | 111.8 | E337 K341 G342 A343 | E337-S339 VanDerWaalsContact C-N 3.32Å; E337-S339 WeakPolarHBondContact CB-OG 3.33Å; E337-S339 PolarHBondContact O-N 2.95Å; E337-S339 PolarHBondContact OE2-OG 3.32Å; S339-K341 VanDerWaalsContact C-N 3.34Å; S339-K341 PolarHBondContact O-N 3.39Å; S339-G342 PolarHBondContact O-N 2.98Å; S339-A343 PolarHBondContact O-N 3.05Å; S339-A343 VanDerWaalsContact O-N 3.08Å |
| 340 | V | 92.1 | Very high | 84.3 | Confident | 23 Ų | 23 | 95.1 Ų | 95.1 | 14% | 0.139 | 48% | 0.483 | C | S | . | . | H | α-helix | trans | -62.7 | -39.5 | -179.2 | 179.4 | 0 | 0 | 0 | 0 | 111.4 | I336 E337 G342 A343 L344 L366 L368 | I336-V340 HydrophobicContact CG2-CB 3.92Å; I336-V340 HydrophobicContact CG2-CG1 3.72Å; E337-V340 HydrophobicContact CB-CB 4.46Å; E337-V340 HydrophobicContact CB-CG2 4.24Å; E337-V340 PolarHBondContact O-N 3.42Å; V340-G342 VanDerWaalsContact C-N 3.34Å; V340-G342 PolarHBondContact O-N 3.2Å; V340-A343 PolarHBondContact O-N 2.86Å; V340-L344 HydrophobicContact CG1-CD1 4.19Å; V340-L344 WeakPolarHBondContact O-CG 3.41Å; V340-L344 PolarHBondContact O-N 3.4Å; V340-L366 HydrophobicContact CG1-CB 4.01Å; V340-L366 HydrophobicContact CG1-CD1 4.18Å; V340-L366 HydrophobicContact CG1-CD2 4.36Å; V340-L366 HydrophobicContact CG1-CG 4.42Å; V340-L368 HydrophobicContact CG1-CD1 3.64Å; V340-L368 HydrophobicContact CG1-CG 4.13Å |
| 341 | K | 91.9 | Very high | 86 | Confident | 87 Ų | 87 | 90 Ų | 90 | 38% | 0.378 | 47% | 0.469 | S | S | . | . | H | α-helix | trans | -59.9 | -42.7 | 172.1 | 176.7 | -176.5 | 171.2 | -71.2 | 0 | 111.6 | I336 E337 S339 L344 E345 | I336-K341 HydrophobicContact CG2-CB 4.36Å; E337-K341 VanDerWaalsContact O-CB 3.25Å; E337-K341 WeakPolarHBondContact O-CB 3.38Å; E337-K341 PolarHBondContact O-N 3.05Å; S339-K341 VanDerWaalsContact C-N 3.34Å; S339-K341 PolarHBondContact O-N 3.39Å; K341-L344 PolarHBondContact O-N 2.89Å; K341-E345 VanDerWaalsContact CE-OE1 3.27Å; K341-E345 WeakPolarHBondContact CE-OE1 3.25Å; K341-E345 HydrophobicContact CG-CG 4.49Å; K341-E345 IonicContact NZ-OE1 3.67Å; K341-E345 PolarHBondContact NZ-OE1 3.26Å; K341-E345 IonicContact NZ-OE2 2.7Å; K341-E345 PolarHBondContact NZ-OE2 3.13Å; K341-E345 WeakPolarHBondContact O-CG 3.1Å; K341-E345 PolarHBondContact O-N 3.28Å |
| 342 | G | 92.4 | Very high | 87.5 | Confident | 36 Ų | 36 | 83.3 Ų | 83.3 | 37% | 0.371 | 45% | 0.445 | S | S | . | . | H | α-helix | trans | -62.2 | -42.8 | 177.1 | 0 | 0 | 0 | 0 | 0 | 112.7 | V338 S339 V340 E345 S346 | V338-G342 PolarHBondContact O-N 2.91Å; S339-G342 PolarHBondContact O-N 2.98Å; V340-G342 VanDerWaalsContact C-N 3.34Å; V340-G342 PolarHBondContact O-N 3.2Å; G342-E345 PolarHBondContact O-N 3.17Å; G342-S346 WeakPolarHBondContact O-CB 3.24Å; G342-S346 PolarHBondContact O-N 3.39Å |
| 343 | A | 92.7 | Very high | 89.2 | Confident | 42 Ų | 42 | 82 Ų | 82 | 35% | 0.347 | 44% | 0.44 | S | S | . | . | H | α-helix | trans | -62.1 | -43.6 | 174.4 | 0 | 0 | 0 | 0 | 0 | 112.3 | S339 V340 S346 H347 L366 | S339-A343 PolarHBondContact O-N 3.05Å; S339-A343 VanDerWaalsContact O-N 3.08Å; V340-A343 PolarHBondContact O-N 2.86Å; A343-S346 PolarHBondContact O-N 3.42Å; A343-H347 PolarHBondContact O-N 3.42Å; A343-L366 HydrophobicContact CB-CD2 3.77Å |
| 344 | L | 95 | Very high | 90.2 | Very high | 0 Ų | 0 | 72.2 Ų | 72.2 | 0% | 0 | 40% | 0.404 | C | S | . | . | H | α-helix | trans | -64.3 | -38.8 | 175.3 | -70.5 | 168.1 | 0 | 0 | 0 | 112.5 | I336 V340 K341 H347 F348 L366 L368 V373 W376 F377 | I336-L344 HydrophobicContact CG2-CD1 4.28Å; V340-L344 HydrophobicContact CG1-CD1 4.19Å; V340-L344 WeakPolarHBondContact O-CG 3.41Å; V340-L344 PolarHBondContact O-N 3.4Å; K341-L344 PolarHBondContact O-N 2.89Å; L344-H347 PolarHBondContact O-N 2.62Å; L344-F348 VanDerWaalsContact O-CB 3.3Å; L344-F348 WeakPolarHBondContact O-CB 3.31Å; L344-F348 PolarHBondContact O-N 3.31Å; L344-L366 HydrophobicContact CD2-CD1 3.63Å; L344-L366 HydrophobicContact CG-CD1 3.76Å; L344-L368 HydrophobicContact CD1-CD1 4.24Å; L344-V373 HydrophobicContact CD2-CG1 4.09Å; L344-W376 VanDerWaalsContact C-CH2 3.47Å; L344-W376 HydrophobicContact CB-CD2 3.98Å; L344-W376 HydrophobicContact CB-CE3 3.88Å; L344-W376 HydrophobicContact CB-CH2 3.72Å; L344-W376 HydrophobicContact CB-CZ2 3.79Å; L344-W376 HydrophobicContact CB-CZ3 3.76Å; L344-W376 HydrophobicContact CD1-CD2 3.94Å; L344-W376 HydrophobicContact CD1-CE3 4.41Å; L344-W376 HydrophobicContact CD1-CG 3.97Å; L344-W376 HydrophobicContact CD2-CE3 4.35Å; L344-W376 HydrophobicContact CG-CD2 4.42Å; L344-W376 HydrophobicContact CG-CE3 4.45Å; L344-W376 WeakPolarHBondContact O-CH2 2.94Å; L344-W376 WeakPolarHBondContact O-CZ3 3.37Å; L344-F377 HydrophobicContact CD2-CE2 3.79Å; L344-F377 HydrophobicContact CD2-CZ 4.41Å |
| 345 | E | 94.6 | Very high | 91 | Very high | 60 Ų | 60 | 71 Ų | 71 | 28% | 0.28 | 40% | 0.399 | S | S | . | . | H | α-helix | trans | -69 | -37.1 | 175.5 | -72.7 | 177 | 154.8 | 0 | 0 | 112.3 | K341 G342 F348 L349 W376 | K341-E345 VanDerWaalsContact CE-OE1 3.27Å; K341-E345 WeakPolarHBondContact CE-OE1 3.25Å; K341-E345 HydrophobicContact CG-CG 4.49Å; K341-E345 IonicContact NZ-OE1 3.67Å; K341-E345 PolarHBondContact NZ-OE1 3.26Å; K341-E345 IonicContact NZ-OE2 2.7Å; K341-E345 PolarHBondContact NZ-OE2 3.13Å; K341-E345 WeakPolarHBondContact O-CG 3.1Å; K341-E345 PolarHBondContact O-N 3.28Å; G342-E345 PolarHBondContact O-N 3.17Å; E345-F348 PolarHBondContact O-N 3.4Å; E345-L349 WeakPolarHBondContact O-CG 3.41Å; E345-L349 PolarHBondContact O-N 2.87Å; E345-W376 HydrophobicContact CG-CH2 3.8Å; E345-W376 HydrophobicContact CG-CZ2 3.6Å |
| 346 | S | 94.1 | Very high | 91.8 | Very high | 64 Ų | 64 | 69.4 Ų | 69.4 | 45% | 0.448 | 39% | 0.392 | S | S | . | . | H | α-helix | trans | -62.4 | -45 | 172.3 | -177.4 | 0 | 0 | 0 | 0 | 112.2 | G342 A343 L349 | G342-S346 WeakPolarHBondContact O-CB 3.24Å; G342-S346 PolarHBondContact O-N 3.39Å; A343-S346 PolarHBondContact O-N 3.42Å; S346-L349 PolarHBondContact O-N 3.37Å |
| 347 | H | 93.2 | Very high | 92.4 | Very high | 47 Ų | 47 | 74.5 Ų | 74.5 | 22% | 0.218 | 42% | 0.415 | C | S | . | . | H | α-helix | trans | -68 | -34.9 | 175.3 | -162.9 | -67.9 | 0 | 0 | 0 | 112.4 | A343 L344 L349 K350 C351 E358 L362 F377 | A343-H347 PolarHBondContact O-N 3.42Å; L344-H347 PolarHBondContact O-N 2.62Å; H347-L349 VanDerWaalsContact C-N 3.3Å; H347-L349 PolarHBondContact O-N 3.35Å; H347-K350 PolarHBondContact O-N 2.9Å; H347-K350 VanDerWaalsContact O-N 3.15Å; H347-C351 PolarHBondContact O-N 3.35Å; H347-E358 IonicContact CE1-OE1 2.62Å; H347-L362 HydrophobicContact CB-CD1 4.43Å; H347-L362 HydrophobicContact CB-CD2 4.4Å; H347-F377 HydrophobicContact CB-CZ 4.32Å |
| 348 | F | 94.7 | Very high | 92.7 | Very high | 3 Ų | 3 | 71 Ų | 71 | 1% | 0.013 | 40% | 0.399 | C | S | . | . | H | α-helix | trans | -60.9 | -37.7 | 177.7 | -176.3 | -84.3 | 0 | 0 | 0 | 112.7 | L344 E345 K350 C351 P352 W376 F377 R380 R381 E384 | L344-F348 VanDerWaalsContact O-CB 3.3Å; L344-F348 WeakPolarHBondContact O-CB 3.31Å; L344-F348 PolarHBondContact O-N 3.31Å; E345-F348 PolarHBondContact O-N 3.4Å; F348-K350 VanDerWaalsContact C-N 3.3Å; F348-K350 PolarHBondContact O-N 3.39Å; F348-C351 CarbonylContact O-C 3.37Å; F348-P352 HydrophobicContact CE1-CB 4.26Å; F348-P352 HydrophobicContact CE2-CB 4.04Å; F348-P352 HydrophobicContact CZ-CB 3.88Å; F348-P352 WeakPolarHBondContact O-CD 3.31Å; F348-P352 WeakPolarHBondContact O-CG 3.39Å; F348-W376 HydrophobicContact CB-CH2 4.04Å; F348-W376 HydrophobicContact CB-CZ3 4.05Å; F348-W376 HydrophobicContact CD2-CZ3 4.14Å; F348-W376 HydrophobicContact CG-CH2 4.47Å; F348-W376 HydrophobicContact CG-CZ3 4.43Å; F348-F377 HydrophobicContact CB-CE1 4.05Å; F348-F377 AromaticContact CD2-CD1 3.76Å; F348-F377 HydrophobicContact CD2-CD1 3.76Å; F348-F377 AromaticContact CD2-CE1 3.97Å; F348-F377 HydrophobicContact CD2-CE1 3.97Å; F348-R380 HydrophobicContact CD1-CG 4.02Å; F348-R380 HydrophobicContact CD2-CB 4.01Å; F348-R380 HydrophobicContact CD2-CG 3.47Å; F348-R380 VanDerWaalsContact CD2-CG 3.47Å; F348-R380 HydrophobicContact CE1-CG 4.1Å; F348-R380 HydrophobicContact CE2-CB 3.96Å; F348-R380 HydrophobicContact CE2-CG 3.54Å; F348-R380 HydrophobicContact CG-CG 3.73Å; F348-R380 HydrophobicContact CZ-CG 3.87Å; F348-R381 HydrophobicContact CE2-CB 4.18Å; F348-R381 HydrophobicContact CZ-CB 4.41Å; F348-E384 WeakPolarHBondContact CE1-OE1 3.19Å; F348-E384 WeakPolarHBondContact CZ-OE2 2.76Å |
| 349 | L | 92.5 | Very high | 93.1 | Very high | 142 Ų | 142 | 65.7 Ų | 65.7 | 74% | 0.743 | 37% | 0.366 | S | S | * | . | H | α-helix | trans | -65.5 | -31.5 | 176.2 | -68.5 | 169.4 | 0 | 0 | 0 | 112.8 | E345 S346 H347 | E345-L349 WeakPolarHBondContact O-CG 3.41Å; E345-L349 PolarHBondContact O-N 2.87Å; S346-L349 PolarHBondContact O-N 3.37Å; H347-L349 VanDerWaalsContact C-N 3.3Å; H347-L349 PolarHBondContact O-N 3.35Å |
| 350 | K | 92.7 | Very high | 93.5 | Very high | 175 Ų | 175 | 63.6 Ų | 63.6 | 76% | 0.761 | 35% | 0.351 | S | S | * | . | H | α-helix | trans | -81.3 | -42.2 | 176.2 | -61.3 | -178.2 | -179 | -174.7 | 0 | 112.3 | H347 F348 | H347-K350 PolarHBondContact O-N 2.9Å; H347-K350 VanDerWaalsContact O-N 3.15Å; F348-K350 VanDerWaalsContact C-N 3.3Å; F348-K350 PolarHBondContact O-N 3.39Å |
| 351 | C | 87.9 | Confident | 93.6 | Very high | 33 Ų | 33 | 65.8 Ų | 65.8 | 22% | 0.223 | 37% | 0.365 | C | S | . | . | trans | -143.4 | 98 | -177.3 | -173.6 | 0 | 0 | 0 | 0 | 110.6 | H347 F348 K353 P354 | H347-C351 PolarHBondContact O-N 3.35Å; F348-C351 CarbonylContact O-C 3.37Å; C351-K353 PolarHBondContact O-N 3.46Å; C351-K353 VanDerWaalsContact SG-C 3.58Å; C351-P354 WeakPolarHBondContact O-CD 3.43Å | ||
| 352 | P | 90.8 | Very high | 93.8 | Very high | 55 Ų | 55 | 62.6 Ų | 62.6 | 36% | 0.357 | 35% | 0.352 | S | S | . | . | S | Bend | trans | -72.1 | -6.7 | 177.9 | -21.2 | 33.1 | 0 | 0 | 0 | 115.2 | F348 R381 | F348-P352 HydrophobicContact CE1-CB 4.26Å; F348-P352 HydrophobicContact CE2-CB 4.04Å; F348-P352 HydrophobicContact CZ-CB 3.88Å; F348-P352 WeakPolarHBondContact O-CD 3.31Å; F348-P352 WeakPolarHBondContact O-CG 3.39Å; P352-R381 PolarHBondContact O-NH1 2.86Å; P352-R381 VanDerWaalsContact O-NH1 3.12Å |
| 353 | K | 92.8 | Very high | 93.9 | Very high | 164 Ų | 164 | 61 Ų | 61 | 71% | 0.713 | 34% | 0.335 | S | S | * | . | S | Bend | trans | -139.3 | 64 | -179.3 | -63.8 | 179.9 | -174.7 | 170.3 | 0 | 110.5 | C351 | C351-K353 PolarHBondContact O-N 3.46Å; C351-K353 VanDerWaalsContact SG-C 3.58Å |
| 354 | P | 93.2 | Very high | 94.1 | Very high | 13 Ų | 13 | 64.4 Ų | 64.4 | 8% | 0.084 | 35% | 0.347 | C | S | . | . | trans | -60.8 | 144.2 | 178.4 | 27.9 | -35.5 | 0 | 0 | 0 | 111 | C351 E358 I359 F377 | C351-P354 WeakPolarHBondContact O-CD 3.43Å; P354-E358 HydrophobicContact CB-CB 3.74Å; P354-I359 HydrophobicContact CB-CG1 4.03Å; P354-I359 HydrophobicContact CG-CD1 4.16Å; P354-I359 HydrophobicContact CG-CG1 3.76Å; P354-I359 WeakPolarHBondContact O-CD1 3.38Å; P354-F377 VanDerWaalsContact CD-CD1 3.44Å; P354-F377 HydrophobicContact CG-CD1 3.58Å; P354-F377 HydrophobicContact CG-CD2 3.91Å; P354-F377 HydrophobicContact CG-CE1 3.62Å; P354-F377 HydrophobicContact CG-CE2 3.96Å; P354-F377 HydrophobicContact CG-CG 3.75Å; P354-F377 HydrophobicContact CG-CZ 3.83Å | ||
| 355 | S | 96.1 | Very high | 94 | Very high | 53 Ų | 53 | 70.3 Ų | 70.3 | 37% | 0.371 | 38% | 0.379 | S | S | . | . | trans | -64.6 | 167.4 | 175.5 | 66.1 | 0 | 0 | 0 | 0 | 112.6 | Q357 E358 I359 | S355-Q357 PolarHBondContact O-N 2.92Å; S355-Q357 VanDerWaalsContact O-N 3.14Å; S355-E358 WeakPolarHBondContact CB-OE2 3.23Å; S355-E358 PolarHBondContact N-OE2 3.19Å; S355-E358 PolarHBondContact O-N 2.76Å; S355-E358 PolarHBondContact OG-N 3.27Å; S355-E358 PolarHBondContact OG-OE2 3.17Å; S355-I359 WeakPolarHBondContact O-CB 3.36Å; S355-I359 VanDerWaalsContact O-CG1 3.25Å; S355-I359 WeakPolarHBondContact O-CG1 3.24Å; S355-I359 PolarHBondContact O-N 3Å | ||
| 356 | A | 94.7 | Very high | 93.9 | Very high | 72 Ų | 72 | 69.1 Ų | 69.1 | 60% | 0.595 | 38% | 0.375 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -63.1 | -17.5 | 175.7 | 0 | 0 | 0 | 0 | 0 | 113.8 | K370 | A356-K370 WeakPolarHBondContact O-CE 3.23Å; A356-K370 PolarHBondContact O-NZ 3.23Å |
| 357 | Q | 95.5 | Very high | 93.8 | Very high | 152 Ų | 152 | 74.9 Ų | 74.9 | 71% | 0.71 | 39% | 0.394 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -86.1 | -49.5 | 175.3 | -174.8 | 171.3 | -13.5 | 0 | 0 | 111.1 | S355 I359 S360 T361 | S355-Q357 PolarHBondContact O-N 2.92Å; S355-Q357 VanDerWaalsContact O-N 3.14Å; Q357-I359 PolarHBondContact O-N 3.47Å; Q357-S360 WeakPolarHBondContact O-CA 3.31Å; Q357-S360 VanDerWaalsContact O-CB 3.26Å; Q357-S360 WeakPolarHBondContact O-CB 3.47Å; Q357-S360 PolarHBondContact O-N 3.02Å; Q357-T361 PolarHBondContact O-N 3.43Å; Q357-T361 PolarHBondContact O-OG1 3.1Å |
| 358 | E | 94.6 | Very high | 93.8 | Very high | 62 Ų | 62 | 74 Ų | 74 | 29% | 0.29 | 39% | 0.391 | S | S | . | . | H | α-helix | trans | -55.5 | -40 | 171.9 | -73.1 | 158.3 | 86.2 | 0 | 0 | 111.8 | H347 P354 S355 S360 T361 L362 | H347-E358 IonicContact CE1-OE1 2.62Å; P354-E358 HydrophobicContact CB-CB 3.74Å; S355-E358 WeakPolarHBondContact CB-OE2 3.23Å; S355-E358 PolarHBondContact N-OE2 3.19Å; S355-E358 PolarHBondContact O-N 2.76Å; S355-E358 PolarHBondContact OG-N 3.27Å; S355-E358 PolarHBondContact OG-OE2 3.17Å; E358-S360 VanDerWaalsContact C-N 3.29Å; E358-S360 PolarHBondContact O-N 3.05Å; E358-T361 PolarHBondContact O-N 2.83Å; E358-L362 VanDerWaalsContact O-CB 3.32Å; E358-L362 WeakPolarHBondContact O-CB 3.48Å; E358-L362 WeakPolarHBondContact O-CG 3.36Å; E358-L362 PolarHBondContact O-N 3.09Å |
| 359 | I | 95.4 | Very high | 93.7 | Very high | 18 Ų | 18 | 80.1 Ų | 80.1 | 9% | 0.092 | 42% | 0.42 | C | S | . | . | H | α-helix | trans | -65 | -31 | 175.7 | -68.5 | 170.1 | 0 | 0 | 0 | 111.9 | P354 S355 Q357 A363 K370 V373 R374 | P354-I359 HydrophobicContact CB-CG1 4.03Å; P354-I359 HydrophobicContact CG-CD1 4.16Å; P354-I359 HydrophobicContact CG-CG1 3.76Å; P354-I359 WeakPolarHBondContact O-CD1 3.38Å; S355-I359 WeakPolarHBondContact O-CB 3.36Å; S355-I359 VanDerWaalsContact O-CG1 3.25Å; S355-I359 WeakPolarHBondContact O-CG1 3.24Å; S355-I359 PolarHBondContact O-N 3Å; Q357-I359 PolarHBondContact O-N 3.47Å; I359-A363 VanDerWaalsContact O-CB 3.26Å; I359-A363 WeakPolarHBondContact O-CB 3.49Å; I359-A363 PolarHBondContact O-N 2.86Å; I359-K370 HydrophobicContact CG2-CG 3.93Å; I359-V373 HydrophobicContact CG2-CB 4.27Å; I359-V373 HydrophobicContact CG2-CG1 4.1Å; I359-R374 HydrophobicContact CD1-CG 4.32Å; I359-R374 HydrophobicContact CG2-CB 4.12Å |
| 360 | S | 96 | Very high | 93.8 | Very high | 35 Ų | 35 | 77.8 Ų | 77.8 | 25% | 0.245 | 40% | 0.403 | C | S | . | . | H | α-helix | trans | -67.9 | -56.7 | 169.6 | -105.6 | 0 | 0 | 0 | 0 | 110.4 | Q357 E358 L362 A363 D364 K370 | Q357-S360 WeakPolarHBondContact O-CA 3.31Å; Q357-S360 VanDerWaalsContact O-CB 3.26Å; Q357-S360 WeakPolarHBondContact O-CB 3.47Å; Q357-S360 PolarHBondContact O-N 3.02Å; E358-S360 VanDerWaalsContact C-N 3.29Å; E358-S360 PolarHBondContact O-N 3.05Å; S360-L362 PolarHBondContact O-N 2.93Å; S360-A363 WeakPolarHBondContact O-CA 3.34Å; S360-A363 VanDerWaalsContact O-CB 3.31Å; S360-A363 WeakPolarHBondContact O-CB 3.44Å; S360-A363 PolarHBondContact O-N 3.41Å; S360-D364 VanDerWaalsContact O-CG 3.28Å; S360-D364 PolarHBondContact O-N 3.02Å; S360-D364 VanDerWaalsContact O-OD2 3.06Å; S360-K370 WeakPolarHBondContact OG-CE 3.42Å; S360-K370 PolarHBondContact OG-NZ 3.28Å |
| 361 | T | 95.9 | Very high | 93.8 | Very high | 68 Ų | 68 | 73.4 Ų | 73.4 | 42% | 0.417 | 39% | 0.386 | S | S | . | . | H | α-helix | trans | -57.1 | -37.3 | -177.6 | -51.6 | 0 | 0 | 0 | 0 | 112.6 | Q357 E358 N365 | Q357-T361 PolarHBondContact O-N 3.43Å; Q357-T361 PolarHBondContact O-OG1 3.1Å; E358-T361 PolarHBondContact O-N 2.83Å; T361-N365 WeakPolarHBondContact O-CB 3.43Å; T361-N365 PolarHBondContact O-N 2.94Å; T361-N365 PolarHBondContact O-ND2 2.87Å |
| 362 | L | 94.8 | Very high | 94.1 | Very high | 20 Ų | 20 | 72.9 Ų | 72.9 | 11% | 0.105 | 38% | 0.381 | C | S | . | . | H | α-helix | trans | -69.2 | -35.8 | 172.6 | -75.6 | 170.5 | 0 | 0 | 0 | 113.4 | H347 E358 S360 L366 V373 F377 | H347-L362 HydrophobicContact CB-CD1 4.43Å; H347-L362 HydrophobicContact CB-CD2 4.4Å; E358-L362 VanDerWaalsContact O-CB 3.32Å; E358-L362 WeakPolarHBondContact O-CB 3.48Å; E358-L362 WeakPolarHBondContact O-CG 3.36Å; E358-L362 PolarHBondContact O-N 3.09Å; S360-L362 PolarHBondContact O-N 2.93Å; L362-L366 HydrophobicContact CD2-CD1 4.39Å; L362-L366 WeakPolarHBondContact O-CB 3.29Å; L362-L366 WeakPolarHBondContact O-CD1 3.39Å; L362-L366 WeakPolarHBondContact O-CG 3.37Å; L362-L366 PolarHBondContact O-N 2.87Å; L362-L366 VanDerWaalsContact O-N 3.1Å; L362-V373 HydrophobicContact CB-CG1 4.15Å; L362-F377 HydrophobicContact CD1-CE2 3.82Å; L362-F377 HydrophobicContact CD1-CZ 3.9Å |
| 363 | A | 95.3 | Very high | 94.4 | Very high | 3 Ų | 3 | 70.2 Ų | 70.2 | 3% | 0.025 | 36% | 0.364 | C | S | . | . | H | α-helix | trans | -66.5 | -45.7 | 176.1 | 0 | 0 | 0 | 0 | 0 | 110.9 | I359 S360 L366 Q367 L368 K370 V373 | I359-A363 VanDerWaalsContact O-CB 3.26Å; I359-A363 WeakPolarHBondContact O-CB 3.49Å; I359-A363 PolarHBondContact O-N 2.86Å; S360-A363 WeakPolarHBondContact O-CA 3.34Å; S360-A363 VanDerWaalsContact O-CB 3.31Å; S360-A363 WeakPolarHBondContact O-CB 3.44Å; S360-A363 PolarHBondContact O-N 3.41Å; A363-L366 PolarHBondContact O-N 3.11Å; A363-Q367 WeakPolarHBondContact O-CA 3.36Å; A363-Q367 PolarHBondContact O-N 3.49Å; A363-L368 WeakPolarHBondContact CB-O 3.09Å; A363-L368 PolarHBondContact O-N 3.02Å; A363-K370 HydrophobicContact CB-CB 4.26Å; A363-V373 HydrophobicContact CB-CG2 3.92Å |
| 364 | D | 95.6 | Very high | 94.5 | Very high | 113 Ų | 113 | 67.7 Ų | 67.7 | 60% | 0.604 | 35% | 0.35 | S | S | * | . | H | α-helix | trans | -64.9 | -50.1 | 178.7 | -54.9 | -39.3 | 0 | 0 | 0 | 111 | S360 L366 Q367 | S360-D364 VanDerWaalsContact O-CG 3.28Å; S360-D364 PolarHBondContact O-N 3.02Å; S360-D364 VanDerWaalsContact O-OD2 3.06Å; D364-L366 VanDerWaalsContact C-N 3.28Å; D364-L366 PolarHBondContact O-N 2.88Å; D364-Q367 PolarHBondContact O-N 2.84Å |
| 365 | N | 94 | Very high | 94.6 | Very high | 125 Ų | 125 | 69.6 Ų | 69.6 | 67% | 0.668 | 36% | 0.362 | S | S | * | . | H | α-helix | trans | -64.9 | -27.1 | 179.8 | -72.2 | -9.7 | 0 | 0 | 0 | 114.1 | T361 | T361-N365 WeakPolarHBondContact O-CB 3.43Å; T361-N365 PolarHBondContact O-N 2.94Å; T361-N365 PolarHBondContact O-ND2 2.87Å |
| 366 | L | 92.8 | Very high | 94.6 | Very high | 35 Ų | 35 | 68.6 Ų | 68.6 | 18% | 0.183 | 35% | 0.35 | C | S | . | . | T | Hydrogen-bonded Turn | trans | -103.9 | 4.6 | -179.6 | -59.5 | 172.3 | 0 | 0 | 0 | 113 | V340 A343 L344 L362 A363 D364 L368 | V340-L366 HydrophobicContact CG1-CB 4.01Å; V340-L366 HydrophobicContact CG1-CD1 4.18Å; V340-L366 HydrophobicContact CG1-CD2 4.36Å; V340-L366 HydrophobicContact CG1-CG 4.42Å; A343-L366 HydrophobicContact CB-CD2 3.77Å; L344-L366 HydrophobicContact CD2-CD1 3.63Å; L344-L366 HydrophobicContact CG-CD1 3.76Å; L362-L366 HydrophobicContact CD2-CD1 4.39Å; L362-L366 WeakPolarHBondContact O-CB 3.29Å; L362-L366 WeakPolarHBondContact O-CD1 3.39Å; L362-L366 WeakPolarHBondContact O-CG 3.37Å; L362-L366 PolarHBondContact O-N 2.87Å; L362-L366 VanDerWaalsContact O-N 3.1Å; A363-L366 PolarHBondContact O-N 3.11Å; D364-L366 VanDerWaalsContact C-N 3.28Å; D364-L366 PolarHBondContact O-N 2.88Å; L366-L368 HydrophobicContact CB-CG 4.32Å; L366-L368 PolarHBondContact O-N 2.94Å |
| 367 | Q | 92.1 | Very high | 94.6 | Very high | 185 Ų | 185 | 65.3 Ų | 65.3 | 86% | 0.864 | 32% | 0.322 | S | S | * | . | T | Hydrogen-bonded Turn | trans | 52.4 | 38.2 | -178.4 | -57.4 | 178.7 | 1.3 | 0 | 0 | 113 | A363 D364 | A363-Q367 WeakPolarHBondContact O-CA 3.36Å; A363-Q367 PolarHBondContact O-N 3.49Å; D364-Q367 PolarHBondContact O-N 2.84Å |
| 368 | L | 92.9 | Very high | 94.6 | Very high | 29 Ų | 29 | 59.8 Ų | 59.8 | 15% | 0.152 | 30% | 0.3 | C | S | . | . | trans | -107.7 | 155.6 | 177.5 | -71.2 | -174.9 | 0 | 0 | 0 | 111.5 | V340 L344 A363 L366 V372 V373 | V340-L368 HydrophobicContact CG1-CD1 3.64Å; V340-L368 HydrophobicContact CG1-CG 4.13Å; L344-L368 HydrophobicContact CD1-CD1 4.24Å; A363-L368 WeakPolarHBondContact CB-O 3.09Å; A363-L368 PolarHBondContact O-N 3.02Å; L366-L368 HydrophobicContact CB-CG 4.32Å; L366-L368 PolarHBondContact O-N 2.94Å; L368-V372 HydrophobicContact CD1-CG1 4.35Å; L368-V373 HydrophobicContact CB-CG2 3.83Å; L368-V373 HydrophobicContact CD1-CG2 3.94Å | ||
| 369 | E | 92.5 | Very high | 94.5 | Very high | 130 Ų | 130 | 60.9 Ų | 60.9 | 61% | 0.607 | 31% | 0.307 | S | S | * | . | trans | -65 | 134.9 | 167 | -177.9 | -177.8 | -161.8 | 0 | 0 | 110.5 | E371 V372 V373 | E369-E371 HydrophobicContact CG-CB 4.23Å; E369-E371 PolarHBondContact O-N 3.41Å; E369-E371 VanDerWaalsContact O-N 3.11Å; E369-V372 HydrophobicContact CB-CB 4.36Å; E369-V372 HydrophobicContact CB-CG2 3.94Å; E369-V372 WeakPolarHBondContact O-CA 3.21Å; E369-V372 WeakPolarHBondContact O-CB 3.45Å; E369-V372 PolarHBondContact O-N 3.43Å; E369-V373 PolarHBondContact O-N 3.24Å | ||
| 370 | K | 93.6 | Very high | 94.5 | Very high | 93 Ų | 93 | 62.7 Ų | 62.7 | 40% | 0.404 | 31% | 0.313 | S | S | . | . | H | α-helix | trans | -50.9 | -38.1 | 179.5 | -171.2 | 174.3 | -176.7 | 156.4 | 0 | 113.4 | A356 I359 S360 A363 V373 R374 | A356-K370 WeakPolarHBondContact O-CE 3.23Å; A356-K370 PolarHBondContact O-NZ 3.23Å; I359-K370 HydrophobicContact CG2-CG 3.93Å; S360-K370 WeakPolarHBondContact OG-CE 3.42Å; S360-K370 PolarHBondContact OG-NZ 3.28Å; A363-K370 HydrophobicContact CB-CB 4.26Å; K370-V373 PolarHBondContact O-N 3.37Å; K370-R374 WeakPolarHBondContact O-CB 3.47Å; K370-R374 PolarHBondContact O-N 3.43Å |
| 371 | E | 93.9 | Very high | 94.3 | Very high | 84 Ų | 84 | 64.4 Ų | 64.4 | 39% | 0.393 | 31% | 0.314 | S | S | . | . | H | α-helix | trans | -67.2 | -36.7 | 176.7 | 178.3 | 59.1 | -171.9 | 0 | 0 | 112.6 | E369 R374 V375 | E369-E371 HydrophobicContact CG-CB 4.23Å; E369-E371 PolarHBondContact O-N 3.41Å; E369-E371 VanDerWaalsContact O-N 3.11Å; E371-R374 VanDerWaalsContact CD-NH2 3.29Å; E371-R374 PolarHBondContact O-N 3.28Å; E371-R374 IonicContact OE1-CZ 2.59Å; E371-R374 IonicContact OE1-NE 2.67Å; E371-R374 IonicContact OE1-NH2 3.18Å; E371-R374 PolarHBondContact OE1-NH2 3.45Å; E371-R374 IonicContact OE2-CZ 3.82Å; E371-R374 VanDerWaalsContact OE2-CZ 3.29Å; E371-R374 IonicContact OE2-NE 2.81Å; E371-R374 PolarHBondContact OE2-NE 3.5Å; E371-R374 IonicContact OE2-NH2 3.04Å; E371-R374 PolarHBondContact OE2-NH2 3.08Å; E371-V375 HydrophobicContact CG-CG2 4.3Å; E371-V375 VanDerWaalsContact O-CB 3.26Å; E371-V375 WeakPolarHBondContact O-CB 3.28Å; E371-V375 VanDerWaalsContact O-CG2 3.24Å; E371-V375 WeakPolarHBondContact O-CG2 3.42Å; E371-V375 PolarHBondContact O-N 2.81Å; E371-V375 WeakPolarHBondContact OE1-CG2 3.24Å |
| 372 | V | 94.4 | Very high | 93.9 | Very high | 21 Ų | 21 | 65.6 Ų | 65.6 | 13% | 0.127 | 32% | 0.315 | C | S | . | . | H | α-helix | trans | -64.8 | -43.4 | 176.6 | 174.4 | 0 | 0 | 0 | 0 | 110.5 | T334 I336 L368 E369 W376 | T334-V372 HydrophobicContact CG2-CG1 4.3Å; T334-V372 HydrophobicContact CG2-CG2 4.15Å; I336-V372 HydrophobicContact CD1-CG1 3.78Å; I336-V372 HydrophobicContact CG1-CG1 4.07Å; L368-V372 HydrophobicContact CD1-CG1 4.35Å; E369-V372 HydrophobicContact CB-CB 4.36Å; E369-V372 HydrophobicContact CB-CG2 3.94Å; E369-V372 WeakPolarHBondContact O-CA 3.21Å; E369-V372 WeakPolarHBondContact O-CB 3.45Å; E369-V372 PolarHBondContact O-N 3.43Å; V372-W376 VanDerWaalsContact O-CB 3.29Å; V372-W376 WeakPolarHBondContact O-CB 3.45Å; V372-W376 PolarHBondContact O-N 3.47Å |
| 373 | V | 95.5 | Very high | 93.6 | Very high | 0 Ų | 0 | 70.7 Ų | 70.7 | 0% | 0 | 34% | 0.336 | C | S | . | . | H | α-helix | trans | -63.3 | -49.2 | 174.6 | -179.9 | 0 | 0 | 0 | 0 | 110.8 | L344 I359 L362 A363 L368 E369 K370 V375 W376 F377 | L344-V373 HydrophobicContact CD2-CG1 4.09Å; I359-V373 HydrophobicContact CG2-CB 4.27Å; I359-V373 HydrophobicContact CG2-CG1 4.1Å; L362-V373 HydrophobicContact CB-CG1 4.15Å; A363-V373 HydrophobicContact CB-CG2 3.92Å; L368-V373 HydrophobicContact CB-CG2 3.83Å; L368-V373 HydrophobicContact CD1-CG2 3.94Å; E369-V373 PolarHBondContact O-N 3.24Å; K370-V373 PolarHBondContact O-N 3.37Å; V373-V375 PolarHBondContact O-N 3.15Å; V373-W376 WeakPolarHBondContact O-CB 3.28Å; V373-W376 PolarHBondContact O-N 3.13Å; V373-W376 VanDerWaalsContact O-N 3.12Å; V373-F377 HydrophobicContact CG1-CD2 3.91Å; V373-F377 HydrophobicContact CG1-CE2 3.87Å; V373-F377 WeakPolarHBondContact O-CD2 3.43Å; V373-F377 PolarHBondContact O-N 2.91Å |
| 374 | R | 96 | Very high | 93.3 | Very high | 111 Ų | 111 | 73.6 Ų | 73.6 | 42% | 0.419 | 35% | 0.35 | S | S | . | . | H | α-helix | trans | -57.1 | -46.3 | 178.1 | -168 | -167.9 | 70.3 | 88.1 | 2.9 | 112.2 | I359 K370 E371 W376 F377 C378 | I359-R374 HydrophobicContact CD1-CG 4.32Å; I359-R374 HydrophobicContact CG2-CB 4.12Å; K370-R374 WeakPolarHBondContact O-CB 3.47Å; K370-R374 PolarHBondContact O-N 3.43Å; E371-R374 VanDerWaalsContact CD-NH2 3.29Å; E371-R374 PolarHBondContact O-N 3.28Å; E371-R374 IonicContact OE1-CZ 2.59Å; E371-R374 IonicContact OE1-NE 2.67Å; E371-R374 IonicContact OE1-NH2 3.18Å; E371-R374 PolarHBondContact OE1-NH2 3.45Å; E371-R374 IonicContact OE2-CZ 3.82Å; E371-R374 VanDerWaalsContact OE2-CZ 3.29Å; E371-R374 IonicContact OE2-NE 2.81Å; E371-R374 PolarHBondContact OE2-NE 3.5Å; E371-R374 IonicContact OE2-NH2 3.04Å; E371-R374 PolarHBondContact OE2-NH2 3.08Å; R374-W376 VanDerWaalsContact C-N 3.35Å; R374-F377 PolarHBondContact O-N 3.31Å; R374-C378 PolarHBondContact O-N 3.5Å; R374-C378 VanDerWaalsContact O-N 3.13Å; R374-C378 PolarHBondContact O-SG 3.11Å; R374-C378 VanDerWaalsContact O-SG 3.4Å |
| 375 | V | 95.2 | Very high | 92.7 | Very high | 53 Ų | 53 | 76.5 Ų | 76.5 | 32% | 0.321 | 36% | 0.357 | S | S | . | . | H | α-helix | trans | -67.2 | -35.7 | 177.5 | 168.3 | 0 | 0 | 0 | 0 | 111.2 | E371 V373 C378 N379 | E371-V375 HydrophobicContact CG-CG2 4.3Å; E371-V375 VanDerWaalsContact O-CB 3.26Å; E371-V375 WeakPolarHBondContact O-CB 3.28Å; E371-V375 VanDerWaalsContact O-CG2 3.24Å; E371-V375 WeakPolarHBondContact O-CG2 3.42Å; E371-V375 PolarHBondContact O-N 2.81Å; E371-V375 WeakPolarHBondContact OE1-CG2 3.24Å; V373-V375 PolarHBondContact O-N 3.15Å; V375-C378 PolarHBondContact O-N 3.27Å; V375-N379 VanDerWaalsContact CG1-ND2 3.34Å; V375-N379 WeakPolarHBondContact CG1-ND2 3.41Å; V375-N379 WeakPolarHBondContact O-CB 3.45Å; V375-N379 VanDerWaalsContact O-CG 3.24Å; V375-N379 PolarHBondContact O-N 3.37Å; V375-N379 PolarHBondContact O-ND2 2.99Å; V375-N379 VanDerWaalsContact O-ND2 3.09Å |
| 376 | W | 95.6 | Very high | 92.1 | Very high | 32 Ų | 32 | 79 Ų | 79 | 12% | 0.121 | 36% | 0.357 | C | S | . | . | H | α-helix | trans | -60.8 | -50.8 | 174.2 | -174.5 | 97.2 | 0 | 0 | 0 | 111.8 | I336 L344 E345 F348 V372 V373 R374 C378 N379 R380 | I336-W376 HydrophobicContact CD1-CB 4.45Å; I336-W376 HydrophobicContact CD1-CG 4.36Å; L344-W376 VanDerWaalsContact C-CH2 3.47Å; L344-W376 HydrophobicContact CB-CD2 3.98Å; L344-W376 HydrophobicContact CB-CE3 3.88Å; L344-W376 HydrophobicContact CB-CH2 3.72Å; L344-W376 HydrophobicContact CB-CZ2 3.79Å; L344-W376 HydrophobicContact CB-CZ3 3.76Å; L344-W376 HydrophobicContact CD1-CD2 3.94Å; L344-W376 HydrophobicContact CD1-CE3 4.41Å; L344-W376 HydrophobicContact CD1-CG 3.97Å; L344-W376 HydrophobicContact CD2-CE3 4.35Å; L344-W376 HydrophobicContact CG-CD2 4.42Å; L344-W376 HydrophobicContact CG-CE3 4.45Å; L344-W376 WeakPolarHBondContact O-CH2 2.94Å; L344-W376 WeakPolarHBondContact O-CZ3 3.37Å; E345-W376 HydrophobicContact CG-CH2 3.8Å; E345-W376 HydrophobicContact CG-CZ2 3.6Å; F348-W376 HydrophobicContact CB-CH2 4.04Å; F348-W376 HydrophobicContact CB-CZ3 4.05Å; F348-W376 HydrophobicContact CD2-CZ3 4.14Å; F348-W376 HydrophobicContact CG-CH2 4.47Å; F348-W376 HydrophobicContact CG-CZ3 4.43Å; V372-W376 VanDerWaalsContact O-CB 3.29Å; V372-W376 WeakPolarHBondContact O-CB 3.45Å; V372-W376 PolarHBondContact O-N 3.47Å; V373-W376 WeakPolarHBondContact O-CB 3.28Å; V373-W376 PolarHBondContact O-N 3.13Å; V373-W376 VanDerWaalsContact O-N 3.12Å; R374-W376 VanDerWaalsContact C-N 3.35Å; W376-C378 VanDerWaalsContact C-N 3.33Å; W376-C378 PolarHBondContact O-N 2.92Å; W376-N379 PolarHBondContact O-N 3.48Å; W376-N379 VanDerWaalsContact O-N 3.11Å; W376-R380 HydrophobicContact CD2-CB 4.47Å; W376-R380 HydrophobicContact CE3-CB 4.21Å; W376-R380 HydrophobicContact CH2-CB 3.84Å; W376-R380 HydrophobicContact CH2-CG 3.63Å; W376-R380 HydrophobicContact CZ2-CB 4.14Å; W376-R380 HydrophobicContact CZ2-CG 4.11Å; W376-R380 HydrophobicContact CZ3-CB 3.89Å; W376-R380 HydrophobicContact CZ3-CG 4.03Å; W376-R380 WeakPolarHBondContact O-CB 3.49Å; W376-R380 PolarHBondContact O-N 3.39Å |
| 377 | F | 95.9 | Very high | 91 | Very high | 3 Ų | 3 | 83.5 Ų | 83.5 | 1% | 0.013 | 38% | 0.378 | C | S | . | . | H | α-helix | trans | -61.9 | -39.3 | 178.2 | -85.7 | -86.6 | 0 | 0 | 0 | 112.3 | L344 H347 F348 P354 L362 V373 R374 R380 R381 | L344-F377 HydrophobicContact CD2-CE2 3.79Å; L344-F377 HydrophobicContact CD2-CZ 4.41Å; H347-F377 HydrophobicContact CB-CZ 4.32Å; F348-F377 HydrophobicContact CB-CE1 4.05Å; F348-F377 AromaticContact CD2-CD1 3.76Å; F348-F377 HydrophobicContact CD2-CD1 3.76Å; F348-F377 AromaticContact CD2-CE1 3.97Å; F348-F377 HydrophobicContact CD2-CE1 3.97Å; P354-F377 VanDerWaalsContact CD-CD1 3.44Å; P354-F377 HydrophobicContact CG-CD1 3.58Å; P354-F377 HydrophobicContact CG-CD2 3.91Å; P354-F377 HydrophobicContact CG-CE1 3.62Å; P354-F377 HydrophobicContact CG-CE2 3.96Å; P354-F377 HydrophobicContact CG-CG 3.75Å; P354-F377 HydrophobicContact CG-CZ 3.83Å; L362-F377 HydrophobicContact CD1-CE2 3.82Å; L362-F377 HydrophobicContact CD1-CZ 3.9Å; V373-F377 HydrophobicContact CG1-CD2 3.91Å; V373-F377 HydrophobicContact CG1-CE2 3.87Å; V373-F377 WeakPolarHBondContact O-CD2 3.43Å; V373-F377 PolarHBondContact O-N 2.91Å; R374-F377 PolarHBondContact O-N 3.31Å; F377-R380 PolarHBondContact O-N 3.06Å; F377-R381 WeakPolarHBondContact O-CB 3.45Å; F377-R381 PolarHBondContact O-N 3.42Å; F377-R381 VanDerWaalsContact O-N 3.12Å |
| 378 | C | 93.5 | Very high | 89.6 | Confident | 36 Ų | 36 | 79.6 Ų | 79.6 | 24% | 0.243 | 37% | 0.367 | C | S | . | . | H | α-helix | trans | -60.5 | -44.8 | 172.4 | -75.4 | 0 | 0 | 0 | 0 | 112.4 | R374 V375 W376 Q382 | R374-C378 PolarHBondContact O-N 3.5Å; R374-C378 VanDerWaalsContact O-N 3.13Å; R374-C378 PolarHBondContact O-SG 3.11Å; R374-C378 VanDerWaalsContact O-SG 3.4Å; V375-C378 PolarHBondContact O-N 3.27Å; W376-C378 VanDerWaalsContact C-N 3.33Å; W376-C378 PolarHBondContact O-N 2.92Å; C378-Q382 WeakPolarHBondContact O-CG 3.44Å; C378-Q382 PolarHBondContact O-N 2.79Å; C378-Q382 VanDerWaalsContact O-N 3.09Å |
| 379 | N | 94.1 | Very high | 87.8 | Confident | 84 Ų | 84 | 82.3 Ų | 82.3 | 45% | 0.449 | 39% | 0.386 | S | S | . | . | H | α-helix | trans | -69.2 | -39.1 | 177.9 | -72.5 | -34.1 | 0 | 0 | 0 | 112.7 | V375 W376 Q382 K383 | V375-N379 VanDerWaalsContact CG1-ND2 3.34Å; V375-N379 WeakPolarHBondContact CG1-ND2 3.41Å; V375-N379 WeakPolarHBondContact O-CB 3.45Å; V375-N379 VanDerWaalsContact O-CG 3.24Å; V375-N379 PolarHBondContact O-N 3.37Å; V375-N379 PolarHBondContact O-ND2 2.99Å; V375-N379 VanDerWaalsContact O-ND2 3.09Å; W376-N379 PolarHBondContact O-N 3.48Å; W376-N379 VanDerWaalsContact O-N 3.11Å; N379-Q382 PolarHBondContact O-N 2.89Å; N379-K383 PolarHBondContact O-N 3.41Å |
| 380 | R | 94.1 | Very high | 86.1 | Confident | 56 Ų | 56 | 82.9 Ų | 82.9 | 21% | 0.211 | 40% | 0.401 | C | S | . | . | H | α-helix | trans | -65.9 | -39.8 | -179.9 | 179.9 | 58.8 | -174.2 | 70.1 | 3.1 | 112.1 | F348 W376 F377 K383 E384 | F348-R380 HydrophobicContact CD1-CG 4.02Å; F348-R380 HydrophobicContact CD2-CB 4.01Å; F348-R380 HydrophobicContact CD2-CG 3.47Å; F348-R380 VanDerWaalsContact CD2-CG 3.47Å; F348-R380 HydrophobicContact CE1-CG 4.1Å; F348-R380 HydrophobicContact CE2-CB 3.96Å; F348-R380 HydrophobicContact CE2-CG 3.54Å; F348-R380 HydrophobicContact CG-CG 3.73Å; F348-R380 HydrophobicContact CZ-CG 3.87Å; W376-R380 HydrophobicContact CD2-CB 4.47Å; W376-R380 HydrophobicContact CE3-CB 4.21Å; W376-R380 HydrophobicContact CH2-CB 3.84Å; W376-R380 HydrophobicContact CH2-CG 3.63Å; W376-R380 HydrophobicContact CZ2-CB 4.14Å; W376-R380 HydrophobicContact CZ2-CG 4.11Å; W376-R380 HydrophobicContact CZ3-CB 3.89Å; W376-R380 HydrophobicContact CZ3-CG 4.03Å; W376-R380 WeakPolarHBondContact O-CB 3.49Å; W376-R380 PolarHBondContact O-N 3.39Å; F377-R380 PolarHBondContact O-N 3.06Å; R380-K383 PolarHBondContact O-N 2.83Å; R380-E384 IonicContact CZ-OE1 2.86Å; R380-E384 IonicContact NH1-OE1 2.7Å; R380-E384 PolarHBondContact NH1-OE1 3.45Å; R380-E384 IonicContact NH2-OE1 3.61Å; R380-E384 PolarHBondContact O-N 3.47Å; R380-E384 VanDerWaalsContact O-N 3.13Å |
| 381 | R | 92.8 | Very high | 84 | Confident | 72 Ų | 72 | 81.8 Ų | 81.8 | 27% | 0.272 | 42% | 0.417 | S | S | . | . | H | α-helix | trans | -70.7 | -31.6 | 173.2 | -172.6 | 171.9 | 59.7 | -104.8 | -4.3 | 112.9 | F348 P352 F377 K385 | F348-R381 HydrophobicContact CE2-CB 4.18Å; F348-R381 HydrophobicContact CZ-CB 4.41Å; P352-R381 PolarHBondContact O-NH1 2.86Å; P352-R381 VanDerWaalsContact O-NH1 3.12Å; F377-R381 WeakPolarHBondContact O-CB 3.45Å; F377-R381 PolarHBondContact O-N 3.42Å; F377-R381 VanDerWaalsContact O-N 3.12Å; R381-K385 PolarHBondContact O-N 2.75Å |
| 382 | Q | 87.3 | Confident | 81.8 | Confident | 92 Ų | 92 | 83.7 Ų | 83.7 | 43% | 0.43 | 43% | 0.434 | S | S | . | . | H | α-helix | trans | -70.2 | -36.2 | 169.8 | -77.9 | -176.2 | 38.4 | 0 | 0 | 112.8 | C378 N379 R386 | C378-Q382 WeakPolarHBondContact O-CG 3.44Å; C378-Q382 PolarHBondContact O-N 2.79Å; C378-Q382 VanDerWaalsContact O-N 3.09Å; N379-Q382 PolarHBondContact O-N 2.89Å; Q382-R386 WeakPolarHBondContact O-CG 3.24Å; Q382-R386 PolarHBondContact O-N 2.83Å; Q382-R386 VanDerWaalsContact OE1-NH2 3.08Å |
| 383 | K | 88.4 | Confident | 79.1 | Confident | 127 Ų | 127 | 86.6 Ų | 86.6 | 55% | 0.552 | 46% | 0.46 | S | S | * | . | H | α-helix | trans | -62.9 | -48.4 | 176.2 | -173.6 | -172.2 | 175.8 | -169.4 | 0 | 110.3 | N379 R380 K385 R386 M387 | N379-K383 PolarHBondContact O-N 3.41Å; R380-K383 PolarHBondContact O-N 2.83Å; K383-K385 PolarHBondContact O-N 3.05Å; K383-R386 CarbonylContact O-C 3.6Å; K383-R386 WeakPolarHBondContact O-CA 3.29Å; K383-R386 PolarHBondContact O-N 3.5Å; K383-M387 HydrophobicContact CG-CG 4.04Å; K383-M387 WeakPolarHBondContact O-CG 3.41Å; K383-M387 PolarHBondContact O-N 3.03Å |
| 384 | E | 88.1 | Confident | 76.4 | Confident | 65 Ų | 65 | 95.1 Ų | 95.1 | 30% | 0.304 | 50% | 0.5 | S | S | . | . | H | α-helix | trans | -50.4 | -55.5 | 176.9 | -171.3 | 156.2 | -84.4 | 0 | 0 | 112.9 | F348 R380 R386 M387 T388 | F348-E384 WeakPolarHBondContact CE1-OE1 3.19Å; F348-E384 WeakPolarHBondContact CZ-OE2 2.76Å; R380-E384 IonicContact CZ-OE1 2.86Å; R380-E384 IonicContact NH1-OE1 2.7Å; R380-E384 PolarHBondContact NH1-OE1 3.45Å; R380-E384 IonicContact NH2-OE1 3.61Å; R380-E384 PolarHBondContact O-N 3.47Å; R380-E384 VanDerWaalsContact O-N 3.13Å; E384-R386 PolarHBondContact O-N 3.24Å; E384-M387 PolarHBondContact O-N 2.74Å; E384-T388 PolarHBondContact O-N 2.72Å; E384-T388 VanDerWaalsContact O-N 3.14Å |
| 385 | K | 83.7 | Confident | 73.9 | Confident | 173 Ų | 173 | 94 Ų | 94 | 75% | 0.752 | 51% | 0.506 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -62.9 | -4.3 | 176.3 | -69.9 | -164.9 | 170.2 | -152.2 | 0 | 115.5 | R381 K383 | R381-K385 PolarHBondContact O-N 2.75Å; K383-K385 PolarHBondContact O-N 3.05Å |
| 386 | R | 81.1 | Confident | 71.6 | Confident | 179 Ų | 179 | 97 Ų | 97 | 68% | 0.675 | 53% | 0.527 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -109.5 | -6.7 | 172.4 | -67.6 | 179.5 | -169.9 | 145.5 | 12.9 | 113.4 | Q382 K383 E384 | Q382-R386 WeakPolarHBondContact O-CG 3.24Å; Q382-R386 PolarHBondContact O-N 2.83Å; Q382-R386 VanDerWaalsContact OE1-NH2 3.08Å; K383-R386 CarbonylContact O-C 3.6Å; K383-R386 WeakPolarHBondContact O-CA 3.29Å; K383-R386 PolarHBondContact O-N 3.5Å; E384-R386 PolarHBondContact O-N 3.24Å |
| 387 | M | 69.4 | Low | 69.2 | Low | 129 Ų | 129 | 103.3 Ų | 103.3 | 64% | 0.635 | 56% | 0.557 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -111 | -19.4 | -177.7 | -56.8 | -84.4 | 76.4 | 0 | 0 | 112.4 | K383 E384 P389 | K383-M387 HydrophobicContact CG-CG 4.04Å; K383-M387 WeakPolarHBondContact O-CG 3.41Å; K383-M387 PolarHBondContact O-N 3.03Å; E384-M387 PolarHBondContact O-N 2.74Å; M387-P389 VanDerWaalsContact O-CD 3.27Å; M387-P389 WeakPolarHBondContact O-CD 3.42Å |
| 388 | T | 63.6 | Low | 66.7 | Low | 102 Ų | 102 | 108.1 Ų | 108.1 | 63% | 0.626 | 58% | 0.583 | S | S | * | * | S | Bend | trans | -87.3 | 107.4 | 165.8 | -49.2 | 0 | 0 | 0 | 0 | 109.3 | E384 | E384-T388 PolarHBondContact O-N 2.72Å; E384-T388 VanDerWaalsContact O-N 3.14Å |
| 389 | P | 55.9 | Low | 64.5 | Low | 86 Ų | 86 | 112 Ų | 112 | 56% | 0.558 | 61% | 0.606 | S | S | * | * | trans | -73.5 | 145.4 | 175.8 | 30.6 | -34.8 | 0 | 0 | 0 | 111.3 | M387 G391 | M387-P389 VanDerWaalsContact O-CD 3.27Å; M387-P389 WeakPolarHBondContact O-CD 3.42Å; P389-G391 PolarHBondContact O-N 3.31Å | ||
| 390 | P | 55.2 | Low | 62.2 | Low | 142 Ų | 142 | 117.8 Ų | 117.8 | 92% | 0.922 | 62% | 0.623 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -73.1 | 94.5 | 168.4 | 31 | -32 | 0 | 0 | 0 | 108.9 | ||
| 391 | G | 49.8 | Very low | 59.6 | Low | 71 Ų | 71 | 119.3 Ų | 119.3 | 73% | 0.732 | 64% | 0.642 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -179.7 | -23.5 | -176.7 | 0 | 0 | 0 | 0 | 0 | 116 | P389 A393 | P389-G391 PolarHBondContact O-N 3.31Å; G391-A393 PolarHBondContact O-N 3.16Å; G391-A393 VanDerWaalsContact O-N 3.13Å |
| 392 | V | 47.4 | Very low | 57 | Low | 123 Ų | 123 | 124.8 Ų | 124.8 | 75% | 0.745 | 67% | 0.67 | S | S | * | * | trans | -77.4 | 99.3 | 165.8 | -175.9 | 0 | 0 | 0 | 0 | 107.8 | Q394 | V392-Q394 PolarHBondContact O-N 3Š| ||
| 393 | A | 37.8 | Very low | 54.7 | Low | 83 Ų | 83 | 126.9 Ų | 126.9 | 69% | 0.686 | 69% | 0.689 | S | S | * | * | trans | -62.4 | 123 | 164.9 | 0 | 0 | 0 | 0 | 0 | 108.2 | G391 T395 | G391-A393 PolarHBondContact O-N 3.16Å; G391-A393 VanDerWaalsContact O-N 3.13Å; A393-T395 PolarHBondContact O-N 2.99Å | ||
| 394 | Q | 38.4 | Very low | 52.6 | Low | 178 Ų | 178 | 123.7 Ų | 123.7 | 83% | 0.832 | 69% | 0.693 | S | S | * | * | trans | -69.2 | 103.5 | 170.6 | -70.3 | 179.4 | -41.5 | 0 | 0 | 107.7 | V392 | V392-Q394 PolarHBondContact O-N 3Š| ||
| 395 | T | 44.6 | Very low | 50 | Low | 89 Ų | 89 | 128.6 Ų | 128.6 | 55% | 0.546 | 72% | 0.721 | S | S | . | * | trans | -63.7 | 144.6 | 168 | 40.4 | 0 | 0 | 0 | 0 | 108.8 | A393 E397 | A393-T395 PolarHBondContact O-N 2.99Å; T395-E397 PolarHBondContact O-N 2.67Å | ||
| 396 | P | 46.1 | Very low | 48.3 | Very low | 116 Ų | 116 | 124.4 Ų | 124.4 | 75% | 0.753 | 73% | 0.727 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -61.6 | -9.7 | -173.3 | -27.6 | 36.6 | 0 | 0 | 0 | 116.5 | V399 | P396-V399 WeakPolarHBondContact O-CG2 3.35Š|
| 397 | E | 45.8 | Very low | 46.4 | Very low | 163 Ų | 163 | 123.4 Ų | 123.4 | 76% | 0.762 | 73% | 0.729 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -70.9 | -28.8 | -176.9 | -63 | -146.5 | 104.5 | 0 | 0 | 114.5 | T395 V399 Y400 | T395-E397 PolarHBondContact O-N 2.67Å; E397-V399 PolarHBondContact O-N 3.01Å; E397-Y400 PolarHBondContact O-N 3.31Å |
| 398 | D | 42.8 | Very low | 44.9 | Very low | 104 Ų | 104 | 127.1 Ų | 127.1 | 56% | 0.556 | 74% | 0.742 | S | S | * | * | H | α-helix | trans | -64.4 | -14.3 | 179.3 | -90.2 | -47.6 | 0 | 0 | 0 | 113.4 | Y400 | D398-Y400 PolarHBondContact O-N 3.33Å |
| 399 | V | 48.3 | Very low | 43.8 | Very low | 119 Ų | 119 | 130 Ų | 130 | 72% | 0.721 | 75% | 0.753 | S | S | * | * | H | α-helix | trans | -62.6 | -28.9 | 172.6 | 179.8 | 0 | 0 | 0 | 0 | 111.8 | P396 E397 | P396-V399 WeakPolarHBondContact O-CG2 3.35Å; E397-V399 PolarHBondContact O-N 3.01Å |
| 400 | Y | 45.1 | Very low | 43 | Very low | 205 Ų | 205 | 131.1 Ų | 131.1 | 80% | 0.804 | 76% | 0.758 | S | S | * | * | H | α-helix | trans | -89.8 | -28.2 | -177.2 | -137 | -95.7 | 0 | 0 | 0 | 113.5 | E397 D398 Q402 | E397-Y400 PolarHBondContact O-N 3.31Å; D398-Y400 PolarHBondContact O-N 3.33Å; Y400-Q402 VanDerWaalsContact C-N 3.32Å; Y400-Q402 PolarHBondContact O-N 3.28Å |
| 401 | S | 39.9 | Very low | 42 | Very low | 88 Ų | 88 | 131.4 Ų | 131.4 | 62% | 0.615 | 75% | 0.752 | S | S | * | * | H | α-helix | trans | -70.9 | -22.4 | -178.5 | -64.5 | 0 | 0 | 0 | 0 | 114.1 | V403 G404 | S401-V403 VanDerWaalsContact C-N 3.27Å; S401-V403 PolarHBondContact O-N 2.98Å; S401-G404 PolarHBondContact O-N 3.29Å |
| 402 | Q | 39.3 | Very low | 41.2 | Very low | 186 Ų | 186 | 138.6 Ų | 138.6 | 87% | 0.869 | 76% | 0.759 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -82.6 | 2.2 | -178.5 | -165.2 | 151.9 | -15.7 | 0 | 0 | 114.3 | Y400 | Y400-Q402 VanDerWaalsContact C-N 3.32Å; Y400-Q402 PolarHBondContact O-N 3.28Å |
| 403 | V | 38.3 | Very low | 40.9 | Very low | 136 Ų | 136 | 141.1 Ų | 141.1 | 82% | 0.824 | 77% | 0.767 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -103.5 | 25.9 | 168 | -157.1 | 0 | 0 | 0 | 0 | 111.1 | S401 | S401-V403 VanDerWaalsContact C-N 3.27Å; S401-V403 PolarHBondContact O-N 2.98Å |
| 404 | G | 43.8 | Very low | 40.8 | Very low | 61 Ų | 61 | 146.3 Ų | 146.3 | 63% | 0.629 | 77% | 0.774 | S | S | * | * | trans | -112.8 | 22 | -168.2 | 0 | 0 | 0 | 0 | 0 | 116.9 | S401 | S401-G404 PolarHBondContact O-N 3.29Š| ||
| 405 | N | 34.5 | Very low | 40.7 | Very low | 168 Ų | 168 | 145.8 Ų | 145.8 | 90% | 0.898 | 78% | 0.777 | S | S | * | * | trans | -136.6 | 68 | -179.2 | -127.5 | -3.4 | 0 | 0 | 0 | 112.4 | H407 | N405-H407 PolarHBondContact O-N 3.49Š| ||
| 406 | G | 46.9 | Very low | 40.3 | Very low | 85 Ų | 85 | 151.1 Ų | 151.1 | 88% | 0.876 | 80% | 0.796 | S | S | * | * | trans | -77 | 100.7 | -179 | 0 | 0 | 0 | 0 | 0 | 113 | ||||
| 407 | H | 41.8 | Very low | 39.8 | Very low | 157 Ų | 157 | 150.5 Ų | 150.5 | 73% | 0.727 | 80% | 0.8 | S | S | * | * | trans | -149.5 | 48.9 | 164.9 | -151.3 | 155.3 | 0 | 0 | 0 | 112.9 | N405 | N405-H407 PolarHBondContact O-N 3.49Š| ||
| 408 | F | 37.1 | Very low | 39.3 | Very low | 207 Ų | 207 | 148.4 Ų | 148.4 | 91% | 0.908 | 80% | 0.804 | S | S | * | * | S | Bend | trans | -150.9 | 37.3 | 169.8 | -145.1 | -97.8 | 0 | 0 | 0 | 114.2 | ||
| 409 | L | 40.3 | Very low | 39 | Very low | 163 Ų | 163 | 150 Ų | 150 | 85% | 0.853 | 81% | 0.813 | S | S | * | * | S | Bend | trans | -143.7 | 38 | 173 | -155.3 | 77 | 0 | 0 | 0 | 112.8 | ||
| 410 | V | 39.7 | Very low | 38.3 | Very low | 110 Ų | 110 | 153.5 Ų | 153.5 | 67% | 0.667 | 82% | 0.821 | S | S | * | * | S | Bend | trans | -131.5 | 18.6 | 178.1 | -71.9 | 0 | 0 | 0 | 0 | 113.8 | ||
| 411 | D | 34.4 | Very low | 37.8 | Very low | 147 Ų | 147 | 154.5 Ų | 154.5 | 79% | 0.786 | 82% | 0.823 | S | S | * | * | S | Bend | trans | -130.9 | 21.1 | 177.9 | -78.1 | -59.6 | 0 | 0 | 0 | 113.5 | ||
| 412 | Y | 33.2 | Very low | 37.5 | Very low | 223 Ų | 223 | 156.4 Ų | 156.4 | 88% | 0.875 | 83% | 0.831 | S | S | * | * | S | Bend | trans | -135 | 22.4 | 179 | -132.6 | -86.5 | 0 | 0 | 0 | 114.4 | ||
| 413 | L | 40.9 | Very low | 37.2 | Very low | 176 Ų | 176 | 153.7 Ų | 153.7 | 92% | 0.921 | 83% | 0.827 | S | S | * | * | S | Bend | trans | -140 | 38.9 | 179.8 | -104.2 | 166.8 | 0 | 0 | 0 | 111.4 | ||
| 414 | K | 36.3 | Very low | 37 | Very low | 192 Ų | 192 | 153.1 Ų | 153.1 | 84% | 0.835 | 82% | 0.824 | S | S | * | * | S | Bend | trans | -145.7 | 35.7 | 179.9 | -151.9 | -179.1 | 175.2 | 178.9 | 0 | 114.8 | ||
| 415 | D | 35.9 | Very low | 36.6 | Very low | 166 Ų | 166 | 156.7 Ų | 156.7 | 89% | 0.888 | 83% | 0.834 | S | S | * | * | S | Bend | trans | -154.7 | 68.5 | 162.4 | -103.3 | -34.6 | 0 | 0 | 0 | 110.8 | ||
| 416 | E | 37 | Very low | 36.4 | Very low | 201 Ų | 201 | 153.9 Ų | 153.9 | 94% | 0.939 | 83% | 0.827 | S | S | * | * | trans | -170.4 | 86.7 | 148.4 | -106.1 | -159.2 | 118.5 | 0 | 0 | 108.7 | ||||
| 417 | A | 34.6 | Very low | 35.9 | Very low | 103 Ų | 103 | 154.8 Ų | 154.8 | 85% | 0.851 | 82% | 0.82 | S | S | * | * | trans | -148.9 | 41.3 | 179.5 | 0 | 0 | 0 | 0 | 0 | 112.2 | ||||
| 418 | S | 35.8 | Very low | 35.6 | Very low | 119 Ų | 119 | 155.5 Ų | 155.5 | 83% | 0.832 | 82% | 0.821 | S | S | * | * | trans | -142.5 | 132.6 | 171.5 | -77.6 | 0 | 0 | 0 | 0 | 110.8 | ||||
| 419 | D | 35.6 | Very low | 35.5 | Very low | 139 Ų | 139 | 152.7 Ų | 152.7 | 74% | 0.743 | 81% | 0.811 | S | S | * | * | trans | 63.4 | 89.1 | 167.1 | -151 | 8.2 | 0 | 0 | 0 | 119 | ||||
| 420 | Q | 34.2 | Very low | 35.5 | Very low | 191 Ų | 191 | 152.5 Ų | 152.5 | 89% | 0.893 | 81% | 0.806 | S | S | * | * | -159.7 | 147.2 | 108.9 | -104.8 | 148.9 | 104.3 | 0 | 0 | 113.7 | |||||
| 421 | R | 34.5 | Very low | 35.6 | Very low | 227 Ų | 227 | 153.3 Ų | 153.3 | 86% | 0.857 | 81% | 0.811 | S | S | * | * | trans | -111 | 145.6 | 172.2 | -91.9 | -174.1 | 173.7 | -141.2 | 2.5 | 109.5 | ||||
| 422 | V | 33.5 | Very low | 35.8 | Very low | 128 Ų | 128 | 153.1 Ų | 153.1 | 78% | 0.776 | 81% | 0.808 | S | S | * | * | trans | 70.4 | 132.8 | 161.7 | 177.6 | 0 | 0 | 0 | 0 | 111.8 | ||||
| 423 | T | 33 | Very low | 36 | Very low | 128 Ų | 128 | 150 Ų | 150 | 79% | 0.785 | 81% | 0.806 | S | S | * | * | cis | -149.7 | 163.8 | 47.5 | -35.8 | 0 | 0 | 0 | 0 | 113.3 | ||||
| 424 | T | 34.6 | Very low | 35.8 | Very low | 124 Ų | 124 | 145.9 Ų | 145.9 | 76% | 0.761 | 80% | 0.797 | S | S | * | * | trans | -69.5 | -178.5 | 174.5 | -30 | 0 | 0 | 0 | 0 | 113.9 | ||||
| 425 | T | 34.4 | Very low | 36 | Very low | 136 Ų | 136 | 149.2 Ų | 149.2 | 83% | 0.834 | 82% | 0.815 | S | S | * | * | trans | 94 | 140.9 | 171.6 | 72.1 | 0 | 0 | 0 | 0 | 115.8 | ||||
| 426 | S | 31.6 | Very low | 36 | Very low | 109 Ų | 109 | 148.4 Ų | 148.4 | 76% | 0.762 | 81% | 0.811 | S | S | * | * | cis | -163 | 165.2 | -19.7 | -171.6 | 0 | 0 | 0 | 0 | 110.3 | ||||
| 427 | S | 36.6 | Very low | 35.9 | Very low | 104 Ų | 104 | 145.6 Ų | 145.6 | 73% | 0.727 | 81% | 0.805 | S | S | * | * | trans | 68.3 | 149.4 | 163.7 | -166.2 | 0 | 0 | 0 | 0 | 117.8 | ||||
| 428 | F | 34.9 | Very low | 36 | Very low | 172 Ų | 172 | 148 Ų | 148 | 75% | 0.754 | 80% | 0.802 | S | S | * | * | cis | 173.8 | 148.5 | -38.7 | -128.3 | -79.2 | 0 | 0 | 0 | 104.9 | ||||
| 429 | H | 35.2 | Very low | 36 | Very low | 148 Ų | 148 | 149.7 Ų | 149.7 | 69% | 0.685 | 80% | 0.8 | S | S | * | * | trans | 62.2 | 131.4 | 179.4 | -63.9 | -75.6 | 0 | 0 | 0 | 117.5 | ||||
| 430 | Q | 39.4 | Very low | 36.1 | Very low | 160 Ų | 160 | 150.4 Ų | 150.4 | 75% | 0.748 | 80% | 0.804 | S | S | * | * | cis | 90.8 | 113.1 | 23.5 | -170.7 | -171.1 | 30.2 | 0 | 0 | 115 | ||||
| 431 | V | 41.4 | Very low | 36.2 | Very low | 127 Ų | 127 | 147.7 Ų | 147.7 | 77% | 0.77 | 80% | 0.798 | S | S | * | * | trans | -163.8 | 107.5 | 151.5 | 140.6 | 0 | 0 | 0 | 0 | 105.4 | ||||
| 432 | I | 39.6 | Very low | 36.3 | Very low | 142 Ų | 142 | 142 Ų | 142 | 73% | 0.728 | 79% | 0.794 | S | S | * | * | 61.7 | 107.9 | 107.9 | -59.3 | 168.9 | 0 | 0 | 0 | 112.7 | |||||
| 433 | L | 38.1 | Very low | 36.5 | Very low | 158 Ų | 158 | 143.1 Ų | 143.1 | 83% | 0.827 | 80% | 0.795 | S | S | * | * | 79.5 | 115.9 | 53.7 | -127.1 | 179.4 | 0 | 0 | 0 | 115 | |||||
| 434 | A | 35.9 | Very low | 36.8 | Very low | 90 Ų | 90 | 144.3 Ų | 144.3 | 74% | 0.744 | 80% | 0.796 | S | S | * | * | trans | 54.8 | 113.1 | 159.2 | 0 | 0 | 0 | 0 | 0 | 121.2 | ||||
| 435 | H | 40 | Very low | 37 | Very low | 262 Ų | 262 | 146.2 Ų | 146.2 | 100% | 1.213 | 80% | 0.799 | S | S | * | * | -147.9 | 0 | 101.4 | -159.9 | -52.7 | 0 | 0 | 0 | 109.3 |
Retrieved 435 of 435 residues in 420.1 ms
(Link to these results)