| 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 | 39 | Very low | 42.5 | Very low | 239 Ų | 239 | 123.7 Ų | 123.7 | 100% | 1.177 | 81% | 0.805 | S | S | * | * | 0 | 84.6 | 0 | -59.1 | 171.7 | -176.2 | 0 | 0 | 105.2 | |||||
| 2 | A | 37.9 | Very low | 41.8 | Very low | 83 Ų | 83 | 121.8 Ų | 121.8 | 69% | 0.686 | 81% | 0.808 | S | S | * | * | cis | 75.2 | 108.6 | 36.6 | 0 | 0 | 0 | 0 | 0 | 113.5 | ||||
| 3 | E | 41.4 | Very low | 41.2 | Very low | 191 Ų | 191 | 121.2 Ų | 121.2 | 89% | 0.893 | 81% | 0.807 | S | S | * | * | trans | 64.9 | 161.7 | 149.8 | -67.9 | -173.8 | 93.3 | 0 | 0 | 118.9 | ||||
| 4 | S | 39.4 | Very low | 40.5 | Very low | 89 Ų | 89 | 124.4 Ų | 124.4 | 62% | 0.622 | 81% | 0.811 | S | S | * | * | cis | -174.2 | 163.9 | -22.7 | 172.7 | 0 | 0 | 0 | 0 | 108 | ||||
| 5 | S | 36.8 | Very low | 40 | Very low | 114 Ų | 114 | 125.2 Ų | 125.2 | 80% | 0.797 | 81% | 0.805 | S | S | * | * | trans | 68.9 | 159.1 | 160.1 | -64.8 | 0 | 0 | 0 | 0 | 117.5 | ||||
| 6 | A | 39.4 | Very low | 39.6 | Very low | 88 Ų | 88 | 127.1 Ų | 127.1 | 73% | 0.727 | 80% | 0.804 | S | S | * | * | cis | -157.8 | 167.2 | -8.5 | 0 | 0 | 0 | 0 | 0 | 110.7 | ||||
| 7 | P | 62.2 | Low | 39 | Very low | 118 Ų | 118 | 123.9 Ų | 123.9 | 77% | 0.766 | 80% | 0.802 | S | S | * | * | trans | -94 | -179.6 | -175.8 | 41.8 | -39.1 | 0 | 0 | 0 | 113.4 | ||||
| 8 | P | 52.9 | Low | 38.8 | Very low | 126 Ų | 126 | 127.2 Ų | 127.2 | 82% | 0.818 | 80% | 0.804 | S | S | * | * | -136.3 | -162.5 | 84.8 | 41.5 | -26.1 | 0 | 0 | 0 | 111.2 | |||||
| 9 | A | 32.7 | Very low | 38.3 | Very low | 96 Ų | 96 | 126.5 Ų | 126.5 | 79% | 0.793 | 80% | 0.803 | S | S | * | * | cis | -155.1 | 174.7 | 8 | 0 | 0 | 0 | 0 | 0 | 112.3 | ||||
| 10 | A | 33.6 | Very low | 38.1 | Very low | 96 Ų | 96 | 129.6 Ų | 129.6 | 79% | 0.793 | 80% | 0.804 | S | S | * | * | trans | -155.9 | -172.6 | 168.3 | 0 | 0 | 0 | 0 | 0 | 108.5 | ||||
| 11 | P | 52.3 | Low | 37.8 | Very low | 121 Ų | 121 | 132.8 Ų | 132.8 | 79% | 0.786 | 81% | 0.81 | S | S | * | * | cis | -127.1 | 178.7 | -22.2 | 40.6 | -26.3 | 0 | 0 | 0 | 113 | ||||
| 12 | A | 34.2 | Very low | 37.5 | Very low | 101 Ų | 101 | 129.8 Ų | 129.8 | 84% | 0.835 | 79% | 0.793 | S | S | * | * | trans | -156.8 | 135.5 | 157.4 | 0 | 0 | 0 | 0 | 0 | 112.2 | ||||
| 13 | S | 34.2 | Very low | 37.3 | Very low | 113 Ų | 113 | 130.8 Ų | 130.8 | 79% | 0.79 | 80% | 0.801 | S | S | * | * | trans | -142 | 141.3 | 179.2 | -54.7 | 0 | 0 | 0 | 0 | 110.9 | ||||
| 14 | L | 31 | Very low | 36.8 | Very low | 167 Ų | 167 | 126.5 Ų | 126.5 | 87% | 0.874 | 79% | 0.792 | S | S | * | * | trans | 165.6 | 148.5 | 160.8 | -90.6 | 145.8 | 0 | 0 | 0 | 107.3 | ||||
| 15 | L | 33.5 | Very low | 36.6 | Very low | 136 Ų | 136 | 130.8 Ų | 130.8 | 71% | 0.712 | 81% | 0.807 | S | S | * | * | cis | 168.5 | 125.9 | -40.1 | -101.6 | 166.9 | 0 | 0 | 0 | 106.5 | ||||
| 16 | I | 33.8 | Very low | 36.3 | Very low | 155 Ų | 155 | 132.9 Ų | 132.9 | 80% | 0.795 | 81% | 0.81 | S | S | * | * | trans | 70.1 | 129 | 152.9 | -57.9 | 167.3 | 0 | 0 | 0 | 119.9 | ||||
| 17 | G | 28.9 | Very low | 35.9 | Very low | 74 Ų | 74 | 135 Ų | 135 | 76% | 0.763 | 81% | 0.814 | S | S | * | * | trans | -169.8 | 128.4 | 159.4 | 0 | 0 | 0 | 0 | 0 | 110.8 | ||||
| 18 | H | 35.2 | Very low | 34.6 | Very low | 183 Ų | 183 | 139 Ų | 139 | 85% | 0.847 | 82% | 0.822 | S | S | * | * | trans | -112.9 | 163 | -169.7 | -101.8 | -98.3 | 0 | 0 | 0 | 114.1 | ||||
| 19 | S | 29.8 | Very low | 33.8 | Very low | 113 Ų | 113 | 140.6 Ų | 140.6 | 79% | 0.79 | 82% | 0.822 | S | S | * | * | trans | 106.3 | 130.1 | 163.5 | -46 | 0 | 0 | 0 | 0 | 114.2 | ||||
| 20 | K | 33.6 | Very low | 33.6 | Very low | 189 Ų | 189 | 147 Ų | 147 | 82% | 0.822 | 83% | 0.826 | S | S | * | * | cis | 106.6 | 102.2 | 20.1 | -176.7 | -159 | 175.7 | -172.7 | 0 | 112.1 | ||||
| 21 | E | 32.8 | Very low | 33.5 | Very low | 197 Ų | 197 | 146.9 Ų | 146.9 | 92% | 0.921 | 82% | 0.819 | S | S | * | * | trans | -159.1 | 168.8 | 145.2 | -125.2 | 172.4 | 155.5 | 0 | 0 | 111.5 | ||||
| 22 | E | 32.7 | Very low | 32.7 | Very low | 175 Ų | 175 | 150.5 Ų | 150.5 | 82% | 0.818 | 82% | 0.823 | S | S | * | * | trans | -111.8 | 160.9 | -167.1 | -58.6 | 178.4 | 142.7 | 0 | 0 | 112.9 | ||||
| 23 | A | 33.7 | Very low | 32.4 | Very low | 105 Ų | 105 | 155.1 Ų | 155.1 | 87% | 0.868 | 83% | 0.827 | S | S | * | * | trans | -151.8 | 96.6 | 163.2 | 0 | 0 | 0 | 0 | 0 | 111.5 | ||||
| 24 | S | 30.2 | Very low | 32.4 | Very low | 100 Ų | 100 | 157.9 Ų | 157.9 | 70% | 0.699 | 83% | 0.829 | S | S | * | * | trans | -97.2 | 138.8 | 175.8 | -57.5 | 0 | 0 | 0 | 0 | 111.5 | ||||
| 25 | L | 35 | Very low | 32.4 | Very low | 180 Ų | 180 | 156.9 Ų | 156.9 | 94% | 0.942 | 83% | 0.825 | S | S | * | * | trans | -136.7 | 124.3 | 160.1 | -77.8 | 178.7 | 0 | 0 | 0 | 109.9 | ||||
| 26 | N | 30.8 | Very low | 32.2 | Very low | 158 Ų | 158 | 156.7 Ų | 156.7 | 85% | 0.845 | 83% | 0.825 | S | S | * | * | P | Polyproline II helix | trans | -93.9 | 155.6 | -178.5 | -79.4 | -23.4 | 0 | 0 | 0 | 112.1 | ||
| 27 | T | 31.4 | Very low | 32 | Very low | 133 Ų | 133 | 153.3 Ų | 153.3 | 82% | 0.816 | 82% | 0.815 | S | S | * | * | P | Polyproline II helix | trans | -68.8 | 144.1 | 158.8 | 31.1 | 0 | 0 | 0 | 0 | 111.5 | ||
| 28 | E | 33.7 | Very low | 32.2 | Very low | 200 Ų | 200 | 155.8 Ų | 155.8 | 94% | 0.935 | 82% | 0.815 | S | S | * | * | P | Polyproline II helix | trans | -100.7 | 149.3 | 162.8 | -85.9 | -163.6 | 118.1 | 0 | 0 | 111.2 | ||
| 29 | I | 35.8 | Very low | 32 | Very low | 160 Ų | 160 | 154.1 Ų | 154.1 | 82% | 0.821 | 81% | 0.811 | S | S | * | * | trans | -126.6 | 138.9 | 177.8 | -63.7 | 170.7 | 0 | 0 | 0 | 107.8 | ||||
| 30 | R | 29.9 | Very low | 32.1 | Very low | 232 Ų | 232 | 154.7 Ų | 154.7 | 88% | 0.875 | 81% | 0.81 | S | S | * | * | trans | -150.4 | 117.8 | 165.7 | -158.8 | 163.5 | -175.7 | 159.3 | 1.1 | 115.4 | ||||
| 31 | S | 31.9 | Very low | 31.9 | Very low | 93 Ų | 93 | 153.8 Ų | 153.8 | 65% | 0.65 | 81% | 0.814 | S | S | * | * | trans | 48.3 | 118 | 150.8 | -57.4 | 0 | 0 | 0 | 0 | 119.7 | ||||
| 32 | K | 33.7 | Very low | 31.8 | Very low | 197 Ų | 197 | 147.3 Ų | 147.3 | 86% | 0.857 | 80% | 0.8 | S | S | * | * | 59.9 | 116.9 | 75.3 | -79.2 | -167.9 | 170.1 | -169.8 | 0 | 114.5 | |||||
| 33 | E | 29.9 | Very low | 31.8 | Very low | 197 Ų | 197 | 144 Ų | 144 | 92% | 0.921 | 80% | 0.797 | S | S | * | * | -161.1 | 173.8 | 92.5 | -103.6 | 179.8 | 164.1 | 0 | 0 | 111.6 | |||||
| 34 | M | 33.6 | Very low | 31.8 | Very low | 171 Ų | 171 | 144.2 Ų | 144.2 | 84% | 0.842 | 78% | 0.783 | S | S | * | * | trans | -154.9 | 142.7 | -169.9 | -177.8 | 173.6 | 80 | 0 | 0 | 109.6 | ||||
| 35 | N | 29.5 | Very low | 31.9 | Very low | 147 Ų | 147 | 149.2 Ų | 149.2 | 79% | 0.786 | 79% | 0.787 | S | S | * | * | trans | 145.8 | 153.5 | 166 | -84.7 | 6.9 | 0 | 0 | 0 | 110.6 | ||||
| 36 | D | 29.9 | Very low | 31.7 | Very low | 132 Ų | 132 | 148.8 Ų | 148.8 | 71% | 0.706 | 78% | 0.78 | S | S | * | * | cis | -166.3 | 164.5 | -20.3 | -175 | 27.3 | 0 | 0 | 0 | 109.8 | ||||
| 37 | S | 31 | Very low | 31.7 | Very low | 84 Ų | 84 | 145.2 Ų | 145.2 | 59% | 0.587 | 77% | 0.772 | S | S | * | * | trans | 50.4 | 127.2 | 146.8 | 55.9 | 0 | 0 | 0 | 0 | 124.9 | ||||
| 38 | V | 31.5 | Very low | 31.7 | Very low | 125 Ų | 125 | 147.5 Ų | 147.5 | 76% | 0.758 | 77% | 0.771 | S | S | * | * | 94 | 106.5 | 121.8 | 162.1 | 0 | 0 | 0 | 0 | 122.9 | |||||
| 39 | L | 31.7 | Very low | 31.7 | Very low | 148 Ų | 148 | 144.6 Ų | 144.6 | 78% | 0.775 | 77% | 0.766 | S | S | * | * | trans | 73.4 | 140.1 | 132.2 | -65.5 | -178.9 | 0 | 0 | 0 | 126.4 | ||||
| 40 | T | 31.2 | Very low | 31.5 | Very low | 125 Ų | 125 | 144 Ų | 144 | 77% | 0.767 | 76% | 0.76 | S | S | * | * | trans | 83.7 | 113 | 139.6 | 39.2 | 0 | 0 | 0 | 0 | 124.6 | ||||
| 41 | D | 29.5 | Very low | 31.4 | Very low | 171 Ų | 171 | 139.6 Ų | 139.6 | 91% | 0.914 | 75% | 0.754 | S | S | * | * | 81.3 | 160 | 125.8 | -158.9 | 27.7 | 0 | 0 | 0 | 121.1 | |||||
| 42 | G | 30.4 | Very low | 31.4 | Very low | 61 Ų | 61 | 142.6 Ų | 142.6 | 63% | 0.629 | 76% | 0.761 | S | S | * | * | trans | 133 | 27.6 | 148.8 | 0 | 0 | 0 | 0 | 0 | 124.5 | ||||
| 43 | S | 33.5 | Very low | 31.2 | Very low | 106 Ų | 106 | 138.4 Ų | 138.4 | 74% | 0.741 | 76% | 0.757 | S | S | * | * | trans | 47.2 | 153.1 | 152.2 | -138.1 | 0 | 0 | 0 | 0 | 125.9 | ||||
| 44 | D | 32.8 | Very low | 31.2 | Very low | 108 Ų | 108 | 134.7 Ų | 134.7 | 58% | 0.578 | 75% | 0.753 | S | S | * | * | trans | 66.1 | 119.2 | 146.9 | -73.3 | -60 | 0 | 0 | 0 | 125.5 | ||||
| 45 | R | 33.5 | Very low | 30.9 | Very low | 206 Ų | 206 | 135.2 Ų | 135.2 | 78% | 0.777 | 75% | 0.75 | S | S | * | * | trans | 66.5 | 161.2 | 131.8 | -58.4 | 175.9 | -156.5 | -154.3 | 2.9 | 118.9 | ||||
| 46 | E | 30.8 | Very low | 31.1 | Very low | 171 Ų | 171 | 136.5 Ų | 136.5 | 80% | 0.799 | 75% | 0.751 | S | S | * | * | cis | -156.8 | -171.3 | 14.7 | -148.4 | 162.2 | -141 | 0 | 0 | 113.1 | ||||
| 47 | A | 31.1 | Very low | 32 | Very low | 82 Ų | 82 | 134.2 Ų | 134.2 | 68% | 0.678 | 74% | 0.744 | S | S | * | * | trans | 76.3 | 74.7 | 148.6 | 0 | 0 | 0 | 0 | 0 | 122.5 | ||||
| 48 | K | 31 | Very low | 32.4 | Very low | 181 Ų | 181 | 138 Ų | 138 | 79% | 0.787 | 75% | 0.752 | S | S | * | * | trans | -14.8 | 133.4 | 136 | 173.7 | -173.6 | 179.1 | -179.4 | 0 | 117.9 | ||||
| 49 | V | 33.5 | Very low | 32.9 | Very low | 140 Ų | 140 | 140 Ų | 140 | 85% | 0.848 | 75% | 0.753 | S | S | * | * | trans | -137 | 154.7 | 161 | 179.8 | 0 | 0 | 0 | 0 | 110.7 | ||||
| 50 | Q | 32.7 | Very low | 33 | Very low | 146 Ų | 146 | 141.2 Ų | 141.2 | 68% | 0.682 | 76% | 0.76 | S | S | * | * | trans | -123.1 | 139.7 | -176.5 | -56.8 | 164.5 | -94.4 | 0 | 0 | 111.6 | ||||
| 51 | N | 26.9 | Very low | 33.6 | Very low | 140 Ų | 140 | 142.7 Ų | 142.7 | 75% | 0.749 | 76% | 0.764 | S | S | * | * | 173.9 | 116.6 | 112.3 | -102.2 | 1.1 | 0 | 0 | 0 | 116.7 | |||||
| 52 | I | 32.2 | Very low | 33.9 | Very low | 157 Ų | 157 | 143 Ų | 143 | 81% | 0.805 | 76% | 0.76 | S | S | * | * | trans | 3.4 | 131.6 | 142.3 | 21.9 | 172.5 | 0 | 0 | 0 | 123.8 | ||||
| 53 | S | 29.6 | Very low | 34.1 | Very low | 109 Ų | 109 | 144.2 Ų | 144.2 | 76% | 0.762 | 76% | 0.764 | S | S | * | * | 101.6 | 109.5 | 118 | -161.8 | 0 | 0 | 0 | 0 | 122.1 | |||||
| 54 | S | 28.7 | Very low | 34.1 | Very low | 119 Ų | 119 | 145.1 Ų | 145.1 | 83% | 0.832 | 77% | 0.765 | S | S | * | * | trans | -178.3 | 150.8 | 148.4 | -79.6 | 0 | 0 | 0 | 0 | 110.3 | ||||
| 55 | K | 28.7 | Very low | 34.7 | Very low | 182 Ų | 182 | 145.9 Ų | 145.9 | 79% | 0.791 | 78% | 0.776 | S | S | * | * | cis | -166.6 | 132.6 | -22.3 | -174 | -119.4 | 171.6 | -141.6 | 0 | 109.8 | ||||
| 56 | E | 32 | Very low | 34.8 | Very low | 173 Ų | 173 | 142.2 Ų | 142.2 | 81% | 0.808 | 78% | 0.776 | S | S | * | * | trans | -83.5 | -178.1 | 174.5 | -71.3 | 177.2 | 139.2 | 0 | 0 | 111.9 | ||||
| 57 | P | 49.1 | Very low | 36.1 | Very low | 84 Ų | 84 | 139.5 Ų | 139.5 | 55% | 0.545 | 77% | 0.774 | S | S | . | * | cis | -141.4 | -168.9 | 11.8 | 47.3 | -27.7 | 0 | 0 | 0 | 116.2 | ||||
| 58 | E | 39.2 | Very low | 37.3 | Very low | 165 Ų | 165 | 140.7 Ų | 140.7 | 77% | 0.771 | 77% | 0.774 | S | S | * | * | trans | 27.8 | 160.9 | 130.7 | -64.9 | 160.9 | 173.1 | 0 | 0 | 121.2 | ||||
| 59 | E | 42.5 | Very low | 37.1 | Very low | 166 Ų | 166 | 140.7 Ų | 140.7 | 78% | 0.776 | 78% | 0.777 | S | S | * | * | cis | -161.7 | -178.9 | -0.8 | -125.5 | 175.4 | 175.7 | 0 | 0 | 108.6 | ||||
| 60 | D | 34.2 | Very low | 36.9 | Very low | 173 Ų | 173 | 139.2 Ų | 139.2 | 93% | 0.925 | 77% | 0.773 | S | S | * | * | trans | 173.6 | 165.7 | 133.1 | -98.7 | -28.4 | 0 | 0 | 0 | 114.8 | ||||
| 61 | D | 43.8 | Very low | 37 | Very low | 157 Ų | 157 | 137.9 Ų | 137.9 | 84% | 0.84 | 78% | 0.78 | S | S | * | * | trans | -122.2 | -174.2 | -156.2 | -145.2 | -23.4 | 0 | 0 | 0 | 114.5 | ||||
| 62 | E | 35.7 | Very low | 37.8 | Very low | 178 Ų | 178 | 136.7 Ų | 136.7 | 83% | 0.832 | 78% | 0.78 | S | S | * | * | 158.1 | 114.3 | 127.6 | -169.7 | 162.3 | -175 | 0 | 0 | 118.6 | |||||
| 63 | A | 35.5 | Very low | 37.7 | Very low | 86 Ų | 86 | 133.9 Ų | 133.9 | 71% | 0.711 | 77% | 0.774 | S | S | * | * | trans | 60.5 | 159.8 | 140.9 | 0 | 0 | 0 | 0 | 0 | 126.6 | ||||
| 64 | T | 32.6 | Very low | 37.7 | Very low | 125 Ų | 125 | 136.3 Ų | 136.3 | 77% | 0.767 | 78% | 0.778 | S | S | * | * | trans | -124.2 | 167.4 | -176.9 | -24.2 | 0 | 0 | 0 | 0 | 111.4 | ||||
| 65 | P | 46.2 | Very low | 37.9 | Very low | 124 Ų | 124 | 136 Ų | 136 | 81% | 0.805 | 78% | 0.775 | S | S | * | * | -153.4 | 179.9 | 103.5 | 38.2 | -18.7 | 0 | 0 | 0 | 117.3 | |||||
| 66 | T | 35.3 | Very low | 38.2 | Very low | 128 Ų | 128 | 135.3 Ų | 135.3 | 79% | 0.785 | 78% | 0.775 | S | S | * | * | trans | -137.4 | -173.1 | -179.2 | 27 | 0 | 0 | 0 | 0 | 110.7 | ||||
| 67 | P | 58.6 | Low | 38.3 | Very low | 115 Ų | 115 | 135 Ų | 135 | 75% | 0.747 | 78% | 0.779 | S | S | * | * | cis | -116.8 | -117.7 | -12.9 | 21.2 | 6.4 | 0 | 0 | 0 | 109.3 | ||||
| 68 | P | 54.9 | Low | 37.6 | Very low | 107 Ų | 107 | 139.2 Ų | 139.2 | 70% | 0.695 | 79% | 0.791 | S | S | * | * | cis | -140.9 | -179.2 | -27.6 | 42 | -22.3 | 0 | 0 | 0 | 118.3 | ||||
| 69 | E | 28.4 | Very low | 37.2 | Very low | 180 Ų | 180 | 136.9 Ų | 136.9 | 84% | 0.841 | 79% | 0.789 | S | S | * | * | trans | 84.3 | 138.3 | 149.1 | -63.9 | -131.4 | 121 | 0 | 0 | 125.6 | ||||
| 70 | S | 28.9 | Very low | 36.6 | Very low | 109 Ų | 109 | 136.7 Ų | 136.7 | 76% | 0.762 | 79% | 0.789 | S | S | * | * | trans | 81.7 | 135.1 | 150.3 | -67.9 | 0 | 0 | 0 | 0 | 123.7 | ||||
| 71 | S | 33.2 | Very low | 36.4 | Very low | 118 Ų | 118 | 134 Ų | 134 | 83% | 0.825 | 78% | 0.779 | S | S | * | * | trans | -99.3 | -173.2 | 171.4 | -30.7 | 0 | 0 | 0 | 0 | 110.6 | ||||
| 72 | P | 45.6 | Very low | 35.7 | Very low | 116 Ų | 116 | 133.7 Ų | 133.7 | 75% | 0.753 | 78% | 0.776 | S | S | * | * | cis | -153.7 | -158.8 | 34.7 | 43.9 | -19.2 | 0 | 0 | 0 | 117.9 | ||||
| 73 | S | 29.4 | Very low | 35.3 | Very low | 98 Ų | 98 | 129.6 Ų | 129.6 | 69% | 0.685 | 77% | 0.773 | S | S | * | * | trans | 76.5 | 102.5 | 145.4 | 61.7 | 0 | 0 | 0 | 0 | 124.4 | ||||
| 74 | L | 30.3 | Very low | 35 | Very low | 160 Ų | 160 | 131.7 Ų | 131.7 | 84% | 0.838 | 78% | 0.777 | S | S | * | * | 38.2 | 123.6 | 113.9 | -62.5 | 172.1 | 0 | 0 | 0 | 123.2 | |||||
| 75 | S | 32.9 | Very low | 35 | Very low | 111 Ų | 111 | 132.2 Ų | 132.2 | 78% | 0.776 | 78% | 0.78 | S | S | * | * | -167.7 | 109.7 | 124.3 | 53.5 | 0 | 0 | 0 | 0 | 108.9 | |||||
| 76 | E | 34.2 | Very low | 34.4 | Very low | 169 Ų | 169 | 136 Ų | 136 | 79% | 0.79 | 79% | 0.787 | S | S | * | * | 60.9 | 108.3 | 78.2 | -68.2 | -166.9 | 141.7 | 0 | 0 | 115.7 | |||||
| 77 | N | 34.8 | Very low | 34.3 | Very low | 166 Ų | 166 | 137.2 Ų | 137.2 | 89% | 0.888 | 79% | 0.789 | S | S | * | * | trans | -160 | 148.1 | 133.7 | -103.2 | -21 | 0 | 0 | 0 | 111.1 | ||||
| 78 | E | 32.7 | Very low | 33.2 | Very low | 173 Ų | 173 | 139.5 Ų | 139.5 | 81% | 0.808 | 79% | 0.79 | S | S | * | * | trans | -79.8 | 139.8 | -160.2 | -68.1 | -177.2 | 100.2 | 0 | 0 | 115 | ||||
| 79 | T | 30.9 | Very low | 32.1 | Very low | 116 Ų | 116 | 140 Ų | 140 | 71% | 0.712 | 79% | 0.79 | S | S | * | * | 79.3 | 136.2 | 98.1 | -55 | 0 | 0 | 0 | 0 | 114 | |||||
| 80 | M | 30.2 | Very low | 32.2 | Very low | 161 Ų | 161 | 138.3 Ų | 138.3 | 79% | 0.793 | 79% | 0.787 | S | S | * | * | cis | -142.1 | 139.2 | 17.6 | -137.2 | 156.7 | -178.8 | 0 | 0 | 108.7 | ||||
| 81 | T | 30.3 | Very low | 32.3 | Very low | 116 Ų | 116 | 137.9 Ų | 137.9 | 71% | 0.712 | 78% | 0.783 | S | S | * | * | 51.1 | 131.9 | 93.2 | -21.3 | 0 | 0 | 0 | 0 | 113.5 | |||||
| 82 | I | 29.3 | Very low | 32.1 | Very low | 152 Ų | 152 | 137.9 Ų | 137.9 | 78% | 0.779 | 78% | 0.778 | S | S | * | * | cis | -138.4 | 138.3 | 43.6 | -62 | 156.5 | 0 | 0 | 0 | 113.1 | T84 | I82-T84 HydrophobicContact CG2-CG2 4.23Š| ||
| 83 | A | 27.1 | Very low | 31.4 | Very low | 92 Ų | 92 | 139.5 Ų | 139.5 | 76% | 0.76 | 78% | 0.776 | S | S | * | * | trans | -140.7 | 143.1 | 150.7 | 0 | 0 | 0 | 0 | 0 | 108 | ||||
| 84 | T | 28.5 | Very low | 31.3 | Very low | 129 Ų | 129 | 141.9 Ų | 141.9 | 79% | 0.791 | 78% | 0.78 | S | S | * | * | trans | -119.8 | 111.7 | -179.8 | 50.9 | 0 | 0 | 0 | 0 | 110.9 | I82 | I82-T84 HydrophobicContact CG2-CG2 4.23Š| ||
| 85 | T | 34.1 | Very low | 31.5 | Very low | 136 Ų | 136 | 143.4 Ų | 143.4 | 83% | 0.834 | 78% | 0.775 | S | S | * | * | trans | -137.9 | 122.9 | 167.7 | 50.2 | 0 | 0 | 0 | 0 | 107.3 | ||||
| 86 | E | 32.4 | Very low | 31.4 | Very low | 205 Ų | 205 | 146 Ų | 146 | 96% | 0.958 | 77% | 0.774 | S | S | * | * | trans | -130.7 | 140.6 | 170.2 | -67.6 | -173.3 | 169.7 | 0 | 0 | 108.1 | ||||
| 87 | D | 34.5 | Very low | 31.3 | Very low | 153 Ų | 153 | 145.2 Ų | 145.2 | 82% | 0.818 | 77% | 0.774 | S | S | * | * | trans | -144.7 | 156.7 | -173.6 | -162.9 | -0.1 | 0 | 0 | 0 | 109.5 | ||||
| 88 | E | 35.6 | Very low | 31.1 | Very low | 163 Ų | 163 | 144.9 Ų | 144.9 | 76% | 0.762 | 76% | 0.764 | S | S | * | * | trans | 55.7 | 138.8 | 179.5 | -56.3 | -157.1 | 86.4 | 0 | 0 | 117.4 | ||||
| 89 | T | 30.8 | Very low | 30.9 | Very low | 116 Ų | 116 | 141.8 Ų | 141.8 | 71% | 0.712 | 76% | 0.757 | S | S | * | * | -176.7 | 152.2 | 72 | 22.7 | 0 | 0 | 0 | 0 | 114.9 | |||||
| 90 | L | 30.7 | Very low | 30.7 | Very low | 146 Ų | 146 | 143.7 Ų | 143.7 | 76% | 0.764 | 76% | 0.758 | S | S | * | * | trans | 74.5 | 99.6 | 143.7 | -65.7 | 164.7 | 0 | 0 | 0 | 124 | ||||
| 91 | S | 30 | Very low | 30.6 | Very low | 99 Ų | 99 | 140 Ų | 140 | 69% | 0.692 | 76% | 0.761 | S | S | * | * | 75.3 | 135.9 | 116.4 | -53.6 | 0 | 0 | 0 | 0 | 124.6 | |||||
| 92 | V | 29.6 | Very low | 30.5 | Very low | 119 Ų | 119 | 138 Ų | 138 | 72% | 0.721 | 76% | 0.764 | S | S | * | * | 156.1 | 118.5 | 117.5 | 162.3 | 0 | 0 | 0 | 0 | 114.8 | |||||
| 93 | Q | 30.6 | Very low | 30.5 | Very low | 150 Ų | 150 | 136.3 Ų | 136.3 | 70% | 0.701 | 77% | 0.773 | S | S | * | * | trans | 50.8 | 139.9 | 152.1 | -62.7 | 175.4 | 61.7 | 0 | 0 | 121.3 | ||||
| 94 | L | 28.7 | Very low | 30.5 | Very low | 147 Ų | 147 | 135.7 Ų | 135.7 | 77% | 0.77 | 78% | 0.775 | S | S | * | * | -164.8 | 126.9 | 62.9 | -125.7 | 115.4 | 0 | 0 | 0 | 116.4 | |||||
| 95 | R | 33.3 | Very low | 30.6 | Very low | 192 Ų | 192 | 141.6 Ų | 141.6 | 73% | 0.725 | 78% | 0.783 | S | S | * | * | trans | 28.8 | 134.6 | 146 | -57.9 | -173.8 | -171.1 | 177.9 | 3.6 | 125.7 | ||||
| 96 | H | 31.6 | Very low | 30.2 | Very low | 166 Ų | 166 | 138.6 Ų | 138.6 | 77% | 0.769 | 78% | 0.779 | S | S | * | * | trans | 73.6 | 145.5 | 142.6 | -71.9 | -44.5 | 0 | 0 | 0 | 119.5 | ||||
| 97 | I | 31 | Very low | 30.1 | Very low | 152 Ų | 152 | 133.8 Ų | 133.8 | 78% | 0.779 | 78% | 0.775 | S | S | * | * | cis | -142.1 | 163.7 | 17 | -119.4 | 145.3 | 0 | 0 | 0 | 113.7 | ||||
| 98 | K | 30.5 | Very low | 30 | Very low | 159 Ų | 159 | 135 Ų | 135 | 69% | 0.691 | 78% | 0.776 | S | S | * | * | trans | -37.2 | 155.3 | 168.2 | -127.6 | -163.9 | 163.5 | -167.6 | 0 | 115 | E100 | K98-E100 WeakPolarHBondContact CE-OE2 3.45Å; K98-E100 IonicContact NZ-OE2 3.68Å | ||
| 99 | T | 28.4 | Very low | 30.3 | Very low | 108 Ų | 108 | 133.1 Ų | 133.1 | 66% | 0.663 | 78% | 0.777 | S | S | * | * | -165.7 | 167 | 51.6 | -43.7 | 0 | 0 | 0 | 0 | 113.8 | |||||
| 100 | E | 28.3 | Very low | 30.5 | Very low | 156 Ų | 156 | 131.4 Ų | 131.4 | 73% | 0.729 | 78% | 0.775 | S | S | * | * | trans | -47.2 | 162 | 165.7 | -55.4 | 120.6 | 114.1 | 0 | 0 | 113.6 | K98 | K98-E100 WeakPolarHBondContact CE-OE2 3.45Å; K98-E100 IonicContact NZ-OE2 3.68Å | ||
| 101 | G | 28 | Very low | 31.3 | Very low | 83 Ų | 83 | 130.5 Ų | 130.5 | 86% | 0.856 | 78% | 0.778 | S | S | * | * | cis | 159.1 | 173.4 | 8 | 0 | 0 | 0 | 0 | 0 | 107.5 | ||||
| 102 | G | 27.3 | Very low | 31.5 | Very low | 75 Ų | 75 | 132.9 Ų | 132.9 | 77% | 0.773 | 78% | 0.783 | S | S | * | * | cis | 167.8 | 130.6 | -5.5 | 0 | 0 | 0 | 0 | 0 | 110.3 | ||||
| 103 | A | 29.7 | Very low | 32.6 | Very low | 116 Ų | 116 | 131.9 Ų | 131.9 | 96% | 0.959 | 78% | 0.779 | S | S | * | * | trans | 56.8 | 141 | 168.2 | 0 | 0 | 0 | 0 | 0 | 121.1 | ||||
| 104 | G | 27.7 | Very low | 32.6 | Very low | 79 Ų | 79 | 131.4 Ų | 131.4 | 81% | 0.814 | 78% | 0.781 | S | S | * | * | trans | 160.6 | 82 | 159.3 | 0 | 0 | 0 | 0 | 0 | 118.9 | ||||
| 105 | R | 29.4 | Very low | 32.9 | Very low | 254 Ų | 254 | 131.6 Ų | 131.6 | 96% | 0.958 | 78% | 0.782 | S | S | * | * | trans | -13.8 | 125 | 162.2 | -72 | 168.4 | 153.8 | -118.5 | -1.4 | 119.1 | ||||
| 106 | G | 26.4 | Very low | 32.9 | Very low | 73 Ų | 73 | 130.6 Ų | 130.6 | 75% | 0.753 | 79% | 0.785 | S | S | * | * | 97.1 | 169.3 | 104.3 | 0 | 0 | 0 | 0 | 0 | 120.6 | |||||
| 107 | A | 29.7 | Very low | 32.9 | Very low | 104 Ų | 104 | 131.1 Ų | 131.1 | 86% | 0.86 | 79% | 0.788 | S | S | * | * | trans | 76.6 | 119.7 | 174 | 0 | 0 | 0 | 0 | 0 | 118.9 | ||||
| 108 | E | 33.5 | Very low | 33.1 | Very low | 179 Ų | 179 | 129.4 Ų | 129.4 | 84% | 0.836 | 79% | 0.79 | S | S | * | * | trans | -50.1 | 155.2 | 147.1 | -84.2 | -142.5 | 128.3 | 0 | 0 | 112.3 | ||||
| 109 | P | 42 | Very low | 33.1 | Very low | 122 Ų | 122 | 127.1 Ų | 127.1 | 79% | 0.792 | 79% | 0.794 | S | S | * | * | -149.2 | 167.3 | 66.3 | 42.7 | -23.9 | 0 | 0 | 0 | 118.6 | |||||
| 110 | A | 34.2 | Very low | 33.2 | Very low | 80 Ų | 80 | 127.8 Ų | 127.8 | 66% | 0.661 | 80% | 0.803 | S | S | * | * | trans | -73 | 162.7 | 158.1 | 0 | 0 | 0 | 0 | 0 | 111 | ||||
| 111 | P | 47.6 | Very low | 33.1 | Very low | 128 Ų | 128 | 124.2 Ų | 124.2 | 83% | 0.831 | 81% | 0.807 | S | S | * | * | -144.7 | 168.1 | 75.9 | 40.1 | -23.3 | 0 | 0 | 0 | 116.7 | |||||
| 112 | D | 34.1 | Very low | 33.3 | Very low | 149 Ų | 149 | 129 Ų | 129 | 80% | 0.797 | 81% | 0.81 | S | S | * | * | trans | -59.3 | 174.1 | 158.4 | -82.1 | -52.1 | 0 | 0 | 0 | 113.2 | ||||
| 113 | P | 53.7 | Low | 33.4 | Very low | 98 Ų | 98 | 132.6 Ų | 132.6 | 64% | 0.636 | 82% | 0.817 | S | S | * | * | cis | -146.1 | -162.2 | 24.9 | 41.5 | -18.9 | 0 | 0 | 0 | 117.6 | ||||
| 114 | D | 29.2 | Very low | 33.5 | Very low | 139 Ų | 139 | 133.6 Ų | 133.6 | 74% | 0.743 | 81% | 0.811 | S | S | * | * | trans | 83.9 | 102.3 | 142.1 | -80.5 | -1.7 | 0 | 0 | 0 | 121 | ||||
| 115 | L | 35.1 | Very low | 33.5 | Very low | 151 Ų | 151 | 134 Ų | 134 | 79% | 0.791 | 81% | 0.807 | S | S | * | * | 168.6 | 135.3 | 99.9 | -86.9 | 168.3 | 0 | 0 | 0 | 116.4 | |||||
| 116 | E | 33.7 | Very low | 33.3 | Very low | 172 Ų | 172 | 128.9 Ų | 128.9 | 80% | 0.804 | 80% | 0.798 | S | S | * | * | trans | 65.1 | 136 | 145.1 | -58.9 | -61 | 87.9 | 0 | 0 | 125.1 | ||||
| 117 | E | 32.4 | Very low | 33.6 | Very low | 177 Ų | 177 | 129.6 Ų | 129.6 | 83% | 0.827 | 79% | 0.792 | S | S | * | * | trans | -81.4 | 157 | 161.1 | -56.4 | 175.7 | 71.7 | 0 | 0 | 112.5 | ||||
| 118 | S | 33.3 | Very low | 33.5 | Very low | 116 Ų | 116 | 132.1 Ų | 132.1 | 81% | 0.811 | 79% | 0.791 | S | S | * | * | 169.4 | 125.6 | 118.6 | -81.6 | 0 | 0 | 0 | 0 | 115.7 | |||||
| 119 | S | 30.9 | Very low | 33.4 | Very low | 111 Ų | 111 | 132.2 Ų | 132.2 | 78% | 0.776 | 79% | 0.791 | S | S | * | * | trans | 36.8 | 117.2 | 136.1 | -168.7 | 0 | 0 | 0 | 0 | 121.2 | ||||
| 120 | S | 31.1 | Very low | 32.9 | Very low | 122 Ų | 122 | 134 Ų | 134 | 85% | 0.853 | 79% | 0.789 | S | S | * | * | 162.7 | 158.8 | 101.8 | 54.3 | 0 | 0 | 0 | 0 | 113.9 | |||||
| 121 | G | 27.2 | Very low | 32.8 | Very low | 80 Ų | 80 | 139.7 Ų | 139.7 | 83% | 0.825 | 79% | 0.793 | S | S | * | * | trans | 120.9 | 95 | 157.8 | 0 | 0 | 0 | 0 | 0 | 117.5 | ||||
| 122 | M | 31.1 | Very low | 31.9 | Very low | 185 Ų | 185 | 142.6 Ų | 142.6 | 91% | 0.911 | 80% | 0.795 | S | S | * | * | trans | -88.5 | 137.3 | 165.2 | -69.8 | 154.4 | 50.8 | 0 | 0 | 111.4 | ||||
| 123 | T | 30.4 | Very low | 31.7 | Very low | 149 Ų | 149 | 140 Ų | 140 | 91% | 0.914 | 79% | 0.789 | S | S | * | * | trans | -152.1 | 168.4 | 150.1 | 22.7 | 0 | 0 | 0 | 0 | 110 | ||||
| 124 | V | 30.3 | Very low | 30.6 | Very low | 138 Ų | 138 | 140.4 Ų | 140.4 | 84% | 0.836 | 79% | 0.794 | S | S | * | * | trans | -131.1 | 158.1 | -159.6 | 178.2 | 0 | 0 | 0 | 0 | 111.7 | ||||
| 125 | A | 28.2 | Very low | 30.5 | Very low | 88 Ų | 88 | 140.3 Ų | 140.3 | 73% | 0.727 | 79% | 0.794 | S | S | * | * | trans | 81.3 | 154.6 | 171.2 | 0 | 0 | 0 | 0 | 0 | 115.7 | ||||
| 126 | D | 26.1 | Very low | 30.5 | Very low | 145 Ų | 145 | 139 Ų | 139 | 78% | 0.775 | 80% | 0.797 | S | S | * | * | cis | -154.5 | 159.6 | 6.3 | -149 | -18.7 | 0 | 0 | 0 | 113.9 | ||||
| 127 | S | 31.3 | Very low | 30.3 | Very low | 89 Ų | 89 | 134.9 Ų | 134.9 | 62% | 0.622 | 79% | 0.792 | S | S | * | * | trans | 66.9 | 146.9 | 145.2 | -74.3 | 0 | 0 | 0 | 0 | 125.9 | ||||
| 128 | D | 28.5 | Very low | 30.1 | Very low | 156 Ų | 156 | 131.6 Ų | 131.6 | 83% | 0.834 | 79% | 0.789 | S | S | * | * | trans | 72.8 | 102.8 | 151 | -65.4 | -21.2 | 0 | 0 | 0 | 122.9 | ||||
| 129 | E | 31.6 | Very low | 29.8 | Very low | 182 Ų | 182 | 135 Ų | 135 | 85% | 0.85 | 79% | 0.79 | S | S | * | * | trans | -78.3 | 139.6 | 149.3 | -56.1 | 175.1 | 89 | 0 | 0 | 110.8 | ||||
| 130 | H | 30.3 | Very low | 29.8 | Very low | 158 Ų | 158 | 135 Ų | 135 | 73% | 0.731 | 79% | 0.789 | S | S | * | * | trans | -158.9 | 117.2 | 147.6 | -111.7 | 38.2 | 0 | 0 | 0 | 114.8 | ||||
| 131 | R | 31.6 | Very low | 29.7 | Very low | 200 Ų | 200 | 136.8 Ų | 136.8 | 76% | 0.755 | 79% | 0.788 | S | S | * | * | trans | 47.5 | 124.7 | 143 | -63.5 | -173.2 | 166.2 | 97.5 | 2.5 | 121.6 | ||||
| 132 | E | 30 | Very low | 29.9 | Very low | 189 Ų | 189 | 137.9 Ų | 137.9 | 88% | 0.883 | 78% | 0.781 | S | S | * | * | 158.3 | 152.7 | 121.7 | -87.5 | 175.8 | 175 | 0 | 0 | 109.3 | |||||
| 133 | S | 30.2 | Very low | 29.8 | Very low | 94 Ų | 94 | 135 Ų | 135 | 66% | 0.657 | 78% | 0.778 | S | S | * | * | cis | -173.7 | 145.6 | -28.9 | 54.2 | 0 | 0 | 0 | 0 | 109.1 | ||||
| 134 | S | 30.6 | Very low | 29.8 | Very low | 107 Ų | 107 | 135.7 Ų | 135.7 | 75% | 0.748 | 78% | 0.776 | S | S | * | * | trans | 62.8 | 161.5 | 165.6 | -74.3 | 0 | 0 | 0 | 0 | 117 | ||||
| 135 | D | 27.1 | Very low | 29.6 | Very low | 137 Ų | 137 | 137 Ų | 137 | 73% | 0.733 | 78% | 0.778 | S | S | * | * | cis | -160.9 | 146.4 | -25.7 | -110.4 | -53.5 | 0 | 0 | 0 | 108 | ||||
| 136 | S | 33.8 | Very low | 29.7 | Very low | 124 Ų | 124 | 141.2 Ų | 141.2 | 87% | 0.867 | 79% | 0.787 | S | S | * | * | trans | -168.7 | 122.5 | 154.3 | -88 | 0 | 0 | 0 | 0 | 113.4 | ||||
| 137 | A | 30.2 | Very low | 29.8 | Very low | 85 Ų | 85 | 140.3 Ų | 140.3 | 70% | 0.702 | 79% | 0.792 | S | S | * | * | trans | -42.4 | 131.1 | -176.4 | 0 | 0 | 0 | 0 | 0 | 117.2 | F139 | A137-F139 HydrophobicContact CB-CD2 4.48Å; A137-F139 HydrophobicContact CB-CE2 4.23Å | ||
| 138 | S | 28.8 | Very low | 29.7 | Very low | 108 Ų | 108 | 143.8 Ų | 143.8 | 76% | 0.755 | 80% | 0.804 | S | S | * | * | trans | -92.8 | 139.9 | 152.4 | -176.5 | 0 | 0 | 0 | 0 | 109.6 | ||||
| 139 | F | 27.1 | Very low | 29.6 | Very low | 189 Ų | 189 | 139.3 Ų | 139.3 | 83% | 0.829 | 80% | 0.795 | S | S | * | * | trans | -110.4 | 120.5 | 173.2 | -85.7 | -84.9 | 0 | 0 | 0 | 110.2 | A137 | A137-F139 HydrophobicContact CB-CD2 4.48Å; A137-F139 HydrophobicContact CB-CE2 4.23Å | ||
| 140 | S | 29.7 | Very low | 29.6 | Very low | 109 Ų | 109 | 136.7 Ų | 136.7 | 76% | 0.762 | 79% | 0.791 | S | S | * | * | trans | -120.2 | 131.5 | 176.6 | -54.2 | 0 | 0 | 0 | 0 | 110.7 | ||||
| 141 | I | 30.7 | Very low | 29.6 | Very low | 160 Ų | 160 | 134.4 Ų | 134.4 | 82% | 0.821 | 79% | 0.788 | S | S | * | * | trans | -143.8 | 155.3 | 168 | 1.8 | 179.2 | 0 | 0 | 0 | 107.6 | ||||
| 142 | P | 29.5 | Very low | 29.6 | Very low | 104 Ų | 104 | 130.8 Ų | 130.8 | 68% | 0.675 | 79% | 0.789 | S | S | * | * | -119.1 | 152.6 | -97.7 | 36.3 | -25 | 0 | 0 | 0 | 113.8 | |||||
| 143 | S | 29.4 | Very low | 29.8 | Very low | 124 Ų | 124 | 128 Ų | 128 | 87% | 0.867 | 79% | 0.785 | S | S | * | * | trans | -61.6 | 139.8 | 163 | -51.4 | 0 | 0 | 0 | 0 | 110.5 | ||||
| 144 | L | 30.1 | Very low | 29.7 | Very low | 163 Ų | 163 | 126.6 Ų | 126.6 | 85% | 0.853 | 78% | 0.784 | S | S | * | * | trans | -111.8 | 136 | 166.8 | -72 | 175.6 | 0 | 0 | 0 | 109.1 | ||||
| 145 | D | 27.2 | Very low | 29.8 | Very low | 166 Ų | 166 | 130 Ų | 130 | 89% | 0.888 | 79% | 0.794 | S | S | * | * | P | Polyproline II helix | trans | -68 | 146.7 | -174.5 | -75.2 | -57.7 | 0 | 0 | 0 | 113.6 | ||
| 146 | L | 29.2 | Very low | 29.9 | Very low | 176 Ų | 176 | 128 Ų | 128 | 92% | 0.921 | 79% | 0.791 | S | S | * | * | P | Polyproline II helix | trans | -77.4 | 136.7 | 162.1 | -67.7 | 167.3 | 0 | 0 | 0 | 109.4 | ||
| 147 | S | 28.5 | Very low | 29.8 | Very low | 126 Ų | 126 | 129.6 Ų | 129.6 | 88% | 0.881 | 79% | 0.789 | S | S | * | * | P | Polyproline II helix | trans | -95.7 | 118 | 166.3 | -175.8 | 0 | 0 | 0 | 0 | 109.8 | ||
| 148 | D | 30.1 | Very low | 29.9 | Very low | 162 Ų | 162 | 131.9 Ų | 131.9 | 87% | 0.866 | 79% | 0.79 | S | S | * | * | P | Polyproline II helix | trans | -69.3 | 158 | 180 | -131.2 | -37.5 | 0 | 0 | 0 | 113.4 | ||
| 149 | G | 26.7 | Very low | 30.1 | Very low | 62 Ų | 62 | 133.8 Ų | 133.8 | 64% | 0.639 | 79% | 0.79 | S | S | * | * | trans | 179.5 | 44.2 | -171.8 | 0 | 0 | 0 | 0 | 0 | 122.2 | ||||
| 150 | V | 31.1 | Very low | 30.4 | Very low | 127 Ų | 127 | 133.5 Ų | 133.5 | 77% | 0.77 | 79% | 0.791 | S | S | * | * | trans | 54.1 | 121.8 | 135 | 165.7 | 0 | 0 | 0 | 0 | 118.3 | ||||
| 151 | T | 31.1 | Very low | 30.5 | Very low | 111 Ų | 111 | 135.6 Ų | 135.6 | 68% | 0.681 | 79% | 0.794 | S | S | * | * | cis | -175.3 | 165.5 | 14.6 | 18.8 | 0 | 0 | 0 | 0 | 111.3 | ||||
| 152 | T | 30.9 | Very low | 30.4 | Very low | 124 Ų | 124 | 131.2 Ų | 131.2 | 76% | 0.761 | 79% | 0.788 | S | S | * | * | trans | 66.8 | 129.3 | 147.4 | -66.4 | 0 | 0 | 0 | 0 | 117.4 | ||||
| 153 | T | 33.5 | Very low | 30.4 | Very low | 131 Ų | 131 | 134.1 Ų | 134.1 | 80% | 0.804 | 80% | 0.797 | S | S | * | * | cis | -157.7 | 157 | -2.8 | 19.5 | 0 | 0 | 0 | 0 | 105.6 | ||||
| 154 | G | 29 | Very low | 30.4 | Very low | 63 Ų | 63 | 134 Ų | 134 | 65% | 0.649 | 80% | 0.796 | S | S | * | * | cis | 123 | 105.6 | 14.5 | 0 | 0 | 0 | 0 | 0 | 110.5 | ||||
| 155 | N | 32.2 | Very low | 30.3 | Very low | 179 Ų | 179 | 131.9 Ų | 131.9 | 96% | 0.957 | 80% | 0.795 | S | S | * | * | trans | -169.2 | 158.2 | 152.5 | -108.9 | 0.5 | 0 | 0 | 0 | 111.4 | ||||
| 156 | S | 28.5 | Very low | 30.5 | Very low | 95 Ų | 95 | 128.5 Ų | 128.5 | 66% | 0.664 | 79% | 0.79 | S | S | * | * | trans | -104.9 | 148.9 | -179.4 | 177.7 | 0 | 0 | 0 | 0 | 110.8 | ||||
| 157 | L | 32.8 | Very low | 30.3 | Very low | 157 Ų | 157 | 126.1 Ų | 126.1 | 82% | 0.822 | 79% | 0.787 | S | S | * | * | 177.4 | 155.1 | 115.9 | -92.4 | 166 | 0 | 0 | 0 | 112.2 | |||||
| 158 | D | 31.5 | Very low | 30.4 | Very low | 134 Ų | 134 | 126.2 Ų | 126.2 | 72% | 0.717 | 79% | 0.788 | S | S | * | * | trans | -69.4 | 161.3 | 174.1 | -41.3 | -105.9 | 0 | 0 | 0 | 112.6 | ||||
| 159 | I | 34.3 | Very low | 30.3 | Very low | 148 Ų | 148 | 123.1 Ų | 123.1 | 76% | 0.759 | 79% | 0.785 | S | S | * | * | -176.4 | 119.8 | 127 | -98.3 | 164.5 | 0 | 0 | 0 | 113.2 | |||||
| 160 | E | 33.4 | Very low | 30.9 | Very low | 182 Ų | 182 | 126.3 Ų | 126.3 | 85% | 0.85 | 79% | 0.794 | S | S | * | * | trans | 61.1 | 153.9 | 139 | -55.7 | -180 | 136.4 | 0 | 0 | 124.5 | ||||
| 161 | D | 32 | Very low | 30.8 | Very low | 154 Ų | 154 | 124.1 Ų | 124.1 | 82% | 0.824 | 80% | 0.797 | S | S | * | * | trans | -86.1 | 164.4 | 178.1 | -170.8 | -3.4 | 0 | 0 | 0 | 111 | ||||
| 162 | G | 26.8 | Very low | 30.8 | Very low | 68 Ų | 68 | 125.7 Ų | 125.7 | 70% | 0.701 | 81% | 0.806 | S | S | * | * | trans | 178.1 | 44.7 | -173.8 | 0 | 0 | 0 | 0 | 0 | 117.9 | ||||
| 163 | L | 30.7 | Very low | 30.7 | Very low | 164 Ų | 164 | 129.2 Ų | 129.2 | 86% | 0.859 | 81% | 0.814 | S | S | * | * | trans | -61.5 | 139.9 | 167.8 | -68.4 | 175.2 | 0 | 0 | 0 | 111.6 | ||||
| 164 | S | 28.6 | Very low | 30.4 | Very low | 122 Ų | 122 | 126.7 Ų | 126.7 | 85% | 0.853 | 81% | 0.814 | S | S | * | * | trans | -152.4 | 97.6 | 169.2 | -81.3 | 0 | 0 | 0 | 0 | 112.1 | ||||
| 165 | S | 29.2 | Very low | 30.2 | Very low | 119 Ų | 119 | 127.3 Ų | 127.3 | 83% | 0.832 | 82% | 0.82 | S | S | * | * | trans | -84.8 | 147 | 162.6 | -179.2 | 0 | 0 | 0 | 0 | 110 | ||||
| 166 | A | 29.7 | Very low | 30.1 | Very low | 95 Ų | 95 | 124.4 Ų | 124.4 | 79% | 0.785 | 81% | 0.814 | S | S | * | * | trans | -143.8 | 99.6 | 178.5 | 0 | 0 | 0 | 0 | 0 | 111.7 | ||||
| 167 | C | 26.7 | Very low | 30.8 | Very low | 126 Ų | 126 | 125.4 Ų | 125.4 | 85% | 0.851 | 82% | 0.818 | S | S | * | * | trans | -111.5 | 127.6 | 163.2 | -66.2 | 0 | 0 | 0 | 0 | 109.3 | ||||
| 168 | S | 30.9 | Very low | 30.5 | Very low | 128 Ų | 128 | 123.4 Ų | 123.4 | 90% | 0.895 | 82% | 0.818 | S | S | * | * | trans | -87.3 | 137.8 | -171.7 | -58.1 | 0 | 0 | 0 | 0 | 113.4 | ||||
| 169 | A | 26.8 | Very low | 30.3 | Very low | 97 Ų | 97 | 121.3 Ų | 121.3 | 80% | 0.802 | 82% | 0.818 | S | S | * | * | trans | -128.6 | 136.9 | 170.8 | 0 | 0 | 0 | 0 | 0 | 111.1 | ||||
| 170 | P | 40.5 | Very low | 29.9 | Very low | 128 Ų | 128 | 123.4 Ų | 123.4 | 83% | 0.831 | 83% | 0.825 | S | S | * | * | trans | -99.9 | 125.4 | -176.4 | 35 | -31.7 | 0 | 0 | 0 | 115 | ||||
| 171 | G | 27.2 | Very low | 29.7 | Very low | 82 Ų | 82 | 119.2 Ų | 119.2 | 85% | 0.845 | 82% | 0.822 | S | S | * | * | trans | 47 | 122.7 | 136.6 | 0 | 0 | 0 | 0 | 0 | 121.9 | ||||
| 172 | V | 31.1 | Very low | 29.9 | Very low | 143 Ų | 143 | 118.2 Ų | 118.2 | 87% | 0.867 | 82% | 0.824 | S | S | * | * | trans | -118.3 | 129 | 167.8 | 171.2 | 0 | 0 | 0 | 0 | 111.3 | ||||
| 173 | E | 30 | Very low | 29.8 | Very low | 199 Ų | 199 | 118.1 Ų | 118.1 | 93% | 0.93 | 82% | 0.823 | S | S | * | * | trans | -146.9 | 149.7 | 146.6 | -70.7 | -159.8 | 132.3 | 0 | 0 | 107.4 | ||||
| 174 | G | 27.5 | Very low | 29.7 | Very low | 78 Ų | 78 | 118.1 Ų | 118.1 | 80% | 0.804 | 82% | 0.823 | S | S | * | * | cis | 155.3 | 97.5 | -4 | 0 | 0 | 0 | 0 | 0 | 111.2 | ||||
| 175 | G | 24.2 | Very low | 29.6 | Very low | 75 Ų | 75 | 121.6 Ų | 121.6 | 77% | 0.773 | 82% | 0.823 | S | S | * | * | trans | 167.6 | 140.4 | 175.3 | 0 | 0 | 0 | 0 | 0 | 116.8 | ||||
| 176 | S | 30.6 | Very low | 29.6 | Very low | 119 Ų | 119 | 119.3 Ų | 119.3 | 83% | 0.832 | 81% | 0.811 | S | S | * | * | trans | -154.3 | 158.2 | 167.6 | -51.5 | 0 | 0 | 0 | 0 | 107.3 | ||||
| 177 | P | 41.6 | Very low | 29.5 | Very low | 115 Ų | 115 | 121.8 Ų | 121.8 | 75% | 0.747 | 81% | 0.811 | S | S | * | * | -153.1 | 168 | 78.8 | 41 | -22.2 | 0 | 0 | 0 | 117.6 | |||||
| 178 | S | 26.5 | Very low | 29.6 | Very low | 116 Ų | 116 | 124.3 Ų | 124.3 | 81% | 0.811 | 81% | 0.81 | S | S | * | * | trans | 67.9 | 111.3 | 143.4 | -70.1 | 0 | 0 | 0 | 0 | 122.6 | ||||
| 179 | A | 29 | Very low | 29.4 | Very low | 89 Ų | 89 | 122.6 Ų | 122.6 | 74% | 0.736 | 80% | 0.804 | S | S | * | * | 118 | 148.1 | 106.6 | 0 | 0 | 0 | 0 | 0 | 120.4 | |||||
| 180 | E | 25.4 | Very low | 29.5 | Very low | 192 Ų | 192 | 126.3 Ų | 126.3 | 90% | 0.897 | 81% | 0.809 | S | S | * | * | trans | 63.4 | 114.3 | 163.8 | -67.7 | -178.3 | 105.1 | 0 | 0 | 120.9 | ||||
| 181 | A | 29.5 | Very low | 28.9 | Very low | 95 Ų | 95 | 127.7 Ų | 127.7 | 79% | 0.785 | 80% | 0.804 | S | S | * | * | trans | -103.1 | 147.2 | 148.3 | 0 | 0 | 0 | 0 | 0 | 108 | ||||
| 182 | P | 36.3 | Very low | 29.5 | Very low | 133 Ų | 133 | 129.3 Ų | 129.3 | 86% | 0.864 | 80% | 0.8 | S | S | * | * | -137.5 | -176.3 | 77.2 | 28.8 | -8.1 | 0 | 0 | 0 | 112.4 | |||||
| 183 | G | 23.5 | Very low | 29.3 | Very low | 66 Ų | 66 | 126.8 Ų | 126.8 | 68% | 0.68 | 79% | 0.794 | S | S | * | * | cis | 140.1 | 142.7 | -4.9 | 0 | 0 | 0 | 0 | 0 | 113 | ||||
| 184 | L | 28.7 | Very low | 29.2 | Very low | 163 Ų | 163 | 121.3 Ų | 121.3 | 85% | 0.853 | 79% | 0.791 | S | S | * | * | trans | 81 | 124.4 | 170.6 | -55.5 | 176.3 | 0 | 0 | 0 | 120.6 | ||||
| 185 | K | 27.2 | Very low | 29 | Very low | 196 Ų | 196 | 121.4 Ų | 121.4 | 85% | 0.852 | 79% | 0.792 | S | S | * | * | trans | 66.8 | 162.6 | 146.3 | -67.5 | -177.4 | 178.8 | -169 | 0 | 119.5 | ||||
| 186 | A | 28.2 | Very low | 29.2 | Very low | 71 Ų | 71 | 122.3 Ų | 122.3 | 59% | 0.587 | 79% | 0.792 | S | S | * | * | cis | -176.4 | 168.9 | -32.6 | 0 | 0 | 0 | 0 | 0 | 108.6 | ||||
| 187 | D | 28 | Very low | 29.1 | Very low | 147 Ų | 147 | 123.2 Ų | 123.2 | 79% | 0.786 | 79% | 0.792 | S | S | * | * | trans | 76 | 125.7 | 157 | -56.1 | -41.2 | 0 | 0 | 0 | 122 | ||||
| 188 | E | 29 | Very low | 28.4 | Very low | 179 Ų | 179 | 122.6 Ų | 122.6 | 84% | 0.836 | 80% | 0.797 | S | S | * | * | trans | 57 | 101.7 | 140.2 | -58.3 | -165.9 | 112.1 | 0 | 0 | 123.2 | ||||
| 189 | A | 27.4 | Very low | 28.6 | Very low | 92 Ų | 92 | 122.1 Ų | 122.1 | 76% | 0.76 | 80% | 0.8 | S | S | * | * | 27.9 | 127.8 | 120.4 | 0 | 0 | 0 | 0 | 0 | 121.5 | |||||
| 190 | L | 28.1 | Very low | 28.5 | Very low | 174 Ų | 174 | 123 Ų | 123 | 91% | 0.911 | 81% | 0.808 | S | S | * | * | -170.2 | 123.4 | 126.5 | -104.6 | 158.1 | 0 | 0 | 0 | 112.9 | |||||
| 191 | E | 28.4 | Very low | 28.7 | Very low | 157 Ų | 157 | 118.3 Ų | 118.3 | 73% | 0.734 | 80% | 0.802 | S | S | * | * | trans | -71.5 | 148.1 | 153.4 | -95.1 | -69.3 | 138.5 | 0 | 0 | 108.7 | A193 | E191-A193 PolarHBondContact OE2-N 2.72Š| ||
| 192 | P | 39.6 | Very low | 28.7 | Very low | 117 Ų | 117 | 120.8 Ų | 120.8 | 76% | 0.76 | 81% | 0.807 | S | S | * | * | -151.7 | 143.6 | 73.2 | 38.3 | -18 | 0 | 0 | 0 | 118.7 | |||||
| 193 | A | 27.3 | Very low | 28.5 | Very low | 90 Ų | 90 | 120.5 Ų | 120.5 | 74% | 0.744 | 80% | 0.802 | S | S | * | * | trans | 41.5 | 122.1 | 130.4 | 0 | 0 | 0 | 0 | 0 | 121.3 | E191 | E191-A193 PolarHBondContact OE2-N 2.72Š| ||
| 194 | G | 26.3 | Very low | 28.9 | Very low | 84 Ų | 84 | 122.9 Ų | 122.9 | 87% | 0.866 | 81% | 0.805 | S | S | * | * | trans | 172.9 | 98.6 | 161.1 | 0 | 0 | 0 | 0 | 0 | 113.6 | ||||
| 195 | G | 25.3 | Very low | 28.9 | Very low | 79 Ų | 79 | 119.9 Ų | 119.9 | 81% | 0.814 | 80% | 0.804 | S | S | * | * | trans | -86.5 | 156.8 | -174.6 | 0 | 0 | 0 | 0 | 0 | 115.2 | ||||
| 196 | A | 27.5 | Very low | 29 | Very low | 95 Ų | 95 | 115 Ų | 115 | 79% | 0.785 | 80% | 0.801 | S | S | * | * | 165.3 | 152.8 | 119.7 | 0 | 0 | 0 | 0 | 0 | 114.6 | |||||
| 197 | V | 28.5 | Very low | 29.2 | Very low | 137 Ų | 137 | 116.3 Ų | 116.3 | 83% | 0.83 | 81% | 0.811 | S | S | * | * | trans | 50.7 | 93 | 162.1 | -79.2 | 0 | 0 | 0 | 0 | 121.7 | ||||
| 198 | A | 27.2 | Very low | 29.4 | Very low | 102 Ų | 102 | 114 Ų | 114 | 84% | 0.843 | 81% | 0.812 | S | S | * | * | 57.8 | 115.1 | 111.3 | 0 | 0 | 0 | 0 | 0 | 122 | |||||
| 199 | A | 30.2 | Very low | 29.7 | Very low | 107 Ų | 107 | 109.6 Ų | 109.6 | 88% | 0.884 | 81% | 0.807 | S | S | * | * | trans | -142.1 | 143.4 | 135.8 | 0 | 0 | 0 | 0 | 0 | 108.8 | ||||
| 200 | A | 26.7 | Very low | 30 | Very low | 108 Ų | 108 | 109.8 Ų | 109.8 | 89% | 0.893 | 81% | 0.808 | S | S | * | * | trans | -94.8 | 137.8 | -174.3 | 0 | 0 | 0 | 0 | 0 | 112.6 | ||||
| 201 | A | 29.7 | Very low | 30.4 | Very low | 93 Ų | 93 | 109.7 Ų | 109.7 | 77% | 0.769 | 80% | 0.803 | S | S | * | * | trans | -129.4 | 135.9 | 164.9 | 0 | 0 | 0 | 0 | 0 | 108.7 | ||||
| 202 | V | 28.9 | Very low | 31.1 | Very low | 146 Ų | 146 | 108 Ų | 108 | 89% | 0.885 | 81% | 0.806 | S | S | * | * | trans | -87.5 | 128.2 | -174.1 | 178.2 | 0 | 0 | 0 | 0 | 110.2 | ||||
| 203 | V | 32.6 | Very low | 30.8 | Very low | 128 Ų | 128 | 105 Ų | 105 | 78% | 0.776 | 80% | 0.797 | S | S | * | * | trans | -112.3 | 134 | 167.8 | -172.6 | 0 | 0 | 0 | 0 | 107.4 | ||||
| 204 | P | 32 | Very low | 31.4 | Very low | 115 Ų | 115 | 106.9 Ų | 106.9 | 75% | 0.747 | 80% | 0.801 | S | S | * | * | P | Polyproline II helix | trans | -65.4 | 156.4 | -177.4 | 27.3 | -35.3 | 0 | 0 | 0 | 112.1 | A206 | P204-A206 PolarHBondContact O-N 2.85Š|
| 205 | A | 28.2 | Very low | 32.5 | Very low | 100 Ų | 100 | 107.9 Ų | 107.9 | 83% | 0.826 | 80% | 0.795 | S | S | * | * | P | Polyproline II helix | trans | -57.8 | 130.8 | -177.2 | 0 | 0 | 0 | 0 | 0 | 111.7 | A207 | A205-A207 PolarHBondContact O-N 3.28Š|
| 206 | A | 30 | Very low | 33.5 | Very low | 94 Ų | 94 | 111.8 Ų | 111.8 | 78% | 0.777 | 79% | 0.794 | S | S | * | * | P | Polyproline II helix | trans | -57.8 | 132.1 | 163.2 | 0 | 0 | 0 | 0 | 0 | 108.5 | P204 A208 | P204-A206 PolarHBondContact O-N 2.85Å; A206-A208 PolarHBondContact O-N 3.44Å |
| 207 | A | 31.3 | Very low | 35.1 | Very low | 98 Ų | 98 | 109.3 Ų | 109.3 | 81% | 0.81 | 77% | 0.77 | S | S | * | * | P | Polyproline II helix | trans | -59.3 | 123.8 | 168.5 | 0 | 0 | 0 | 0 | 0 | 107.6 | A205 A209 | A205-A207 PolarHBondContact O-N 3.28Å; A207-A209 PolarHBondContact O-N 3.04Å; A207-A209 VanDerWaalsContact O-N 3.08Å |
| 208 | A | 33.4 | Very low | 37.4 | Very low | 98 Ų | 98 | 105.1 Ų | 105.1 | 81% | 0.81 | 75% | 0.75 | S | S | * | * | P | Polyproline II helix | trans | -58.8 | 118.9 | 173.5 | 0 | 0 | 0 | 0 | 0 | 107.6 | A206 A210 | A206-A208 PolarHBondContact O-N 3.44Å; A208-A210 PolarHBondContact O-N 2.97Å |
| 209 | A | 35.8 | Very low | 40.3 | Very low | 88 Ų | 88 | 106.7 Ų | 106.7 | 73% | 0.727 | 74% | 0.735 | S | S | * | * | P | Polyproline II helix | trans | -54.7 | 128.8 | 165.3 | 0 | 0 | 0 | 0 | 0 | 106.8 | A207 E211 | A207-A209 PolarHBondContact O-N 3.04Å; A207-A209 VanDerWaalsContact O-N 3.08Å; A209-E211 PolarHBondContact O-N 2.88Å; A209-E211 VanDerWaalsContact O-N 3.07Å |
| 210 | A | 33.8 | Very low | 43.3 | Very low | 95 Ų | 95 | 102.2 Ų | 102.2 | 79% | 0.785 | 70% | 0.695 | S | S | * | * | trans | -63.7 | 116 | 174 | 0 | 0 | 0 | 0 | 0 | 107.2 | A208 | A208-A210 PolarHBondContact O-N 2.97Š| ||
| 211 | E | 36.1 | Very low | 46.5 | Very low | 172 Ų | 172 | 99.5 Ų | 99.5 | 80% | 0.804 | 67% | 0.665 | S | S | * | * | trans | -45.8 | 128.5 | 165 | -67.7 | -75 | 116.1 | 0 | 0 | 107.6 | A209 G213 | A209-E211 PolarHBondContact O-N 2.88Å; A209-E211 VanDerWaalsContact O-N 3.07Å; E211-G213 PolarHBondContact O-N 2.93Å | ||
| 212 | P | 42.4 | Very low | 49.6 | Very low | 121 Ų | 121 | 95.5 Ų | 95.5 | 79% | 0.786 | 63% | 0.631 | S | S | * | * | trans | -60.2 | 110.1 | 172 | 25.4 | -31.7 | 0 | 0 | 0 | 107.2 | ||||
| 213 | G | 34 | Very low | 52.8 | Low | 56 Ų | 56 | 88.9 Ų | 88.9 | 58% | 0.577 | 59% | 0.591 | S | S | * | * | trans | -53.5 | 146.7 | 174.9 | 0 | 0 | 0 | 0 | 0 | 109.4 | E211 S215 | E211-G213 PolarHBondContact O-N 2.93Å; G213-S215 PolarHBondContact O-N 2.57Å | ||
| 214 | P | 40 | Very low | 55.8 | Low | 128 Ų | 128 | 85.6 Ų | 85.6 | 83% | 0.831 | 57% | 0.565 | S | S | * | * | trans | -51.1 | 112.3 | -168 | 20.5 | -33.4 | 0 | 0 | 0 | 110 | M216 | P214-M216 PolarHBondContact O-N 3.32Š| ||
| 215 | S | 48.6 | Very low | 58.8 | Low | 106 Ų | 106 | 80.3 Ų | 80.3 | 74% | 0.741 | 53% | 0.53 | S | S | * | . | trans | -60.3 | 113.9 | -178.7 | 50 | 0 | 0 | 0 | 0 | 107.7 | G213 P217 | G213-S215 PolarHBondContact O-N 2.57Å; S215-P217 WeakPolarHBondContact O-CD 3.19Å | ||
| 216 | M | 46.6 | Very low | 62 | Low | 160 Ų | 160 | 78.5 Ų | 78.5 | 79% | 0.788 | 51% | 0.509 | S | S | * | . | trans | -51.6 | 115.1 | 171.8 | -69.3 | -71 | -71.7 | 0 | 0 | 106.7 | P214 A218 | P214-M216 PolarHBondContact O-N 3.32Å; M216-A218 PolarHBondContact O-N 2.92Å | ||
| 217 | P | 60.1 | Low | 65.1 | Low | 43 Ų | 43 | 74.2 Ų | 74.2 | 28% | 0.279 | 47% | 0.472 | S | S | . | . | trans | -62 | 137.2 | -167.8 | 23 | -32.8 | 0 | 0 | 0 | 109 | S215 Y219 | S215-P217 WeakPolarHBondContact O-CD 3.19Å; P217-Y219 HydrophobicContact CG-CE1 4.37Å; P217-Y219 HydrophobicContact CG-CE2 3.99Å; P217-Y219 WeakPolarHBondContact O-CD2 3.27Å; P217-Y219 VanDerWaalsContact O-CE2 3.31Å; P217-Y219 WeakPolarHBondContact O-CE2 3.33Å; P217-Y219 PolarHBondContact O-N 3.12Å | ||
| 218 | A | 78.6 | Confident | 68 | Low | 50 Ų | 50 | 74.9 Ų | 74.9 | 41% | 0.413 | 46% | 0.457 | S | S | . | . | trans | -66.9 | 113.7 | -177.8 | 0 | 0 | 0 | 0 | 0 | 109.4 | M216 Y220 T269 | M216-A218 PolarHBondContact O-N 2.92Å; A218-Y220 WeakPolarHBondContact CB-OH 3.44Å; A218-T269 WeakPolarHBondContact CB-OG1 3.47Å; A218-T269 PolarHBondContact O-N 3.17Å; A218-T269 PolarHBondContact O-OG1 2.92Å | ||
| 219 | Y | 88 | Confident | 70.7 | Confident | 134 Ų | 134 | 79.3 Ų | 79.3 | 53% | 0.525 | 46% | 0.461 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -96.6 | 142.6 | 178.7 | -63.6 | -78.1 | 0 | 0 | 0 | 110 | P217 V266 V267 T268 | P217-Y219 HydrophobicContact CG-CE1 4.37Å; P217-Y219 HydrophobicContact CG-CE2 3.99Å; P217-Y219 WeakPolarHBondContact O-CD2 3.27Å; P217-Y219 VanDerWaalsContact O-CE2 3.31Å; P217-Y219 WeakPolarHBondContact O-CE2 3.33Å; P217-Y219 PolarHBondContact O-N 3.12Å; Y219-V266 HydrophobicContact CD1-CG1 3.74Å; Y219-V266 HydrophobicContact CG-CG1 4.1Å; Y219-V267 WeakPolarHBondContact CA-O 3.37Å; Y219-T268 HydrophobicContact CD1-CG2 3.61Å; Y219-T268 HydrophobicContact CE1-CG2 3.51Å |
| 220 | Y | 92.3 | Very high | 73.5 | Confident | 14 Ų | 14 | 80.6 Ų | 80.6 | 6% | 0.055 | 45% | 0.45 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -125.2 | 143.2 | 176.6 | -50.7 | -68.9 | 0 | 0 | 0 | 110.2 | A218 V235 P242 L246 V266 V267 T269 L272 | A218-Y220 WeakPolarHBondContact CB-OH 3.44Å; Y220-V235 HydrophobicContact CD2-CG1 4.47Å; Y220-V235 HydrophobicContact CG-CG1 4.03Å; Y220-P242 HydrophobicContact CE1-CG 4.33Å; Y220-P242 WeakPolarHBondContact OH-CD 3.21Å; Y220-P242 WeakPolarHBondContact OH-CG 3.44Å; Y220-L246 HydrophobicContact CD1-CD2 4.35Å; Y220-L246 HydrophobicContact CD2-CD1 4.42Å; Y220-L246 HydrophobicContact CE1-CD1 4.49Å; Y220-L246 HydrophobicContact CE2-CD1 4.36Å; Y220-L246 HydrophobicContact CG-CD1 4.49Å; Y220-V266 WeakPolarHBondContact O-CA 3.02Å; Y220-V267 PolarHBondContact N-O 3.35Å; Y220-V267 PolarHBondContact O-N 3.44Å; Y220-T269 WeakPolarHBondContact CE2-OG1 3.43Å; Y220-T269 PolarHBondContact OH-OG1 3.44Å; Y220-T269 VanDerWaalsContact OH-OG1 3.11Å; Y220-L272 HydrophobicContact CD2-CD1 3.64Å; Y220-L272 HydrophobicContact CE2-CD1 4.01Å |
| 221 | L | 93.8 | Very high | 76.4 | Confident | 50 Ų | 50 | 80.9 Ų | 80.9 | 26% | 0.262 | 43% | 0.434 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -87.5 | 138.1 | -179.6 | -55.7 | -175.6 | 0 | 0 | 0 | 110.9 | T236 V266 Q443 L446 | L221-T236 PolarHBondContact O-N 3.02Å; L221-T236 PolarHBondContact O-OG1 2.94Å; L221-V266 HydrophobicContact CD2-CG1 4.46Å; L221-V266 HydrophobicContact CD2-CG2 3.85Å; L221-Q443 HydrophobicContact CD1-CG 4.09Å; L221-L446 HydrophobicContact CB-CD1 4.3Å; L221-L446 HydrophobicContact CB-CD2 3.84Å; L221-L446 HydrophobicContact CD1-CD2 3.51Å; L221-L446 HydrophobicContact CG-CD2 4.31Å |
| 222 | V | 95.6 | Very high | 79.2 | Confident | 9 Ų | 9 | 72.8 Ų | 72.8 | 6% | 0.055 | 40% | 0.396 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -103.7 | 120.7 | -172.8 | -180 | 0 | 0 | 0 | 0 | 110.2 | P233 I234 L260 T264 E265 V267 | V222-P233 HydrophobicContact CG1-CB 3.59Å; V222-I234 WeakPolarHBondContact CA-O 3.21Å; V222-L260 HydrophobicContact CG1-CD1 4.04Å; V222-L260 HydrophobicContact CG2-CD1 3.97Å; V222-T264 WeakPolarHBondContact CB-O 3.28Å; V222-T264 WeakPolarHBondContact CG1-O 3.49Å; V222-T264 HydrophobicContact CG2-CG2 4.27Å; V222-E265 PolarHBondContact N-O 3.14Å; V222-V267 HydrophobicContact CG2-CB 4Å; V222-V267 HydrophobicContact CG2-CG1 3.72Å |
| 223 | K | 95.5 | Very high | 81.8 | Confident | 7 Ų | 7 | 67.5 Ų | 67.5 | 3% | 0.03 | 36% | 0.362 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -98.3 | 128.7 | 177.3 | -171.5 | 175.6 | -177.3 | 176.4 | 0 | 110.3 | I225 I234 T236 F445 L446 E448 M451 | K223-I225 HydrophobicContact CD-CG2 4.45Å; K223-I225 HydrophobicContact CG-CG2 4.24Å; K223-I234 HydrophobicContact CB-CG1 3.9Å; K223-I234 HydrophobicContact CD-CD1 4.43Å; K223-I234 PolarHBondContact N-O 3.38Å; K223-I234 PolarHBondContact O-N 3.03Å; K223-T236 HydrophobicContact CB-CG2 4.09Å; K223-F445 WeakPolarHBondContact CE-O 3.44Å; K223-F445 PolarHBondContact NZ-O 2.95Å; K223-L446 HydrophobicContact CB-CD1 3.88Å; K223-L446 HydrophobicContact CG-CD1 4.36Å; K223-E448 VanDerWaalsContact CE-O 3.27Å; K223-E448 WeakPolarHBondContact CE-O 3.31Å; K223-E448 PolarHBondContact NZ-O 3.41Å; K223-M451 PolarHBondContact NZ-O 3.05Å |
| 224 | W | 95.5 | Very high | 84.8 | Confident | 60 Ų | 60 | 64.9 Ų | 64.9 | 23% | 0.227 | 33% | 0.334 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -100.4 | 86.7 | -175.4 | -77.3 | 87.8 | 0 | 0 | 0 | 112.7 | K231 P233 P261 T264 | W224-K231 HydrophobicContact CE3-CB 4.23Å; W224-K231 WeakPolarHBondContact O-CD 3.41Å; W224-K231 PolarHBondContact O-NZ 3.3Å; W224-P233 HydrophobicContact CD2-CB 4.4Å; W224-P233 HydrophobicContact CE3-CB 4.44Å; W224-P233 HydrophobicContact CH2-CB 4.14Å; W224-P233 HydrophobicContact CH2-CG 4.14Å; W224-P233 HydrophobicContact CZ2-CB 4.06Å; W224-P233 HydrophobicContact CZ2-CG 4.5Å; W224-P233 HydrophobicContact CZ3-CB 4.33Å; W224-P233 HydrophobicContact CZ3-CG 4.34Å; W224-P261 WeakPolarHBondContact CH2-O 3.31Å; W224-P261 WeakPolarHBondContact CZ2-O 3.45Å; W224-T264 PolarHBondContact NE1-O 3.36Å |
| 225 | I | 95.1 | Very high | 87.4 | Confident | 3 Ų | 3 | 58.8 Ų | 58.8 | 2% | 0.015 | 30% | 0.295 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -82.2 | 157.9 | -178.8 | 64.4 | 163.2 | 0 | 0 | 0 | 112.4 | K223 W227 K231 T232 I234 L254 V452 | K223-I225 HydrophobicContact CD-CG2 4.45Å; K223-I225 HydrophobicContact CG-CG2 4.24Å; I225-W227 HydrophobicContact CD1-CB 3.99Å; I225-W227 HydrophobicContact CG1-CB 4.23Å; I225-W227 PolarHBondContact O-N 2.96Å; I225-K231 CarbonylContact O-C 3.59Å; I225-K231 VanDerWaalsContact O-CA 3.32Å; I225-K231 WeakPolarHBondContact O-CA 3.33Å; I225-T232 WeakPolarHBondContact CG1-O 3.46Å; I225-T232 PolarHBondContact N-O 3.12Å; I225-T232 VanDerWaalsContact N-O 3.08Å; I225-T232 PolarHBondContact O-N 2.8Å; I225-I234 HydrophobicContact CD1-CD1 4.43Å; I225-I234 HydrophobicContact CD1-CG2 3.87Å; I225-I234 HydrophobicContact CG1-CG2 4.2Å; I225-I234 HydrophobicContact CG2-CD1 3.89Å; I225-I234 HydrophobicContact CG2-CG1 4.21Å; I225-L254 HydrophobicContact CD1-CD2 3.82Å; I225-V452 HydrophobicContact CB-CG1 4.39Å; I225-V452 HydrophobicContact CB-CG2 4.28Å; I225-V452 HydrophobicContact CD1-CG1 3.66Å; I225-V452 HydrophobicContact CG2-CG1 4.03Å; I225-V452 HydrophobicContact CG2-CG2 3.68Å |
| 226 | T | 94.9 | Very high | 89.6 | Confident | 63 Ų | 63 | 53.8 Ų | 53.8 | 39% | 0.387 | 26% | 0.26 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -94.5 | 72.3 | 177.4 | -51.9 | 0 | 0 | 0 | 0 | 110 | K231 S468 | T226-K231 PolarHBondContact OG1-NZ 2.85Å; T226-S468 VanDerWaalsContact O-CB 3.25Å; T226-S468 WeakPolarHBondContact O-CB 3.37Å |
| 227 | W | 95.2 | Very high | 91.7 | Very high | 3 Ų | 3 | 47.5 Ų | 47.5 | 1% | 0.011 | 23% | 0.229 | C | C | . | . | E | Extended strand (participates in β ladder) | trans | -84.6 | 118.5 | -176 | -179.6 | -124 | 0 | 0 | 0 | 111.8 | I225 E229 K230 T232 L254 I417 I430 W453 F470 | I225-W227 HydrophobicContact CD1-CB 3.99Å; I225-W227 HydrophobicContact CG1-CB 4.23Å; I225-W227 PolarHBondContact O-N 2.96Å; W227-E229 PolarHBondContact O-N 3.27Å; W227-K230 PolarHBondContact N-O 3.26Å; W227-K230 PolarHBondContact O-N 3.07Å; W227-T232 HydrophobicContact CB-CG2 4.48Å; W227-L254 HydrophobicContact CB-CD2 4.35Å; W227-L254 HydrophobicContact CD2-CD2 3.97Å; W227-L254 HydrophobicContact CG-CD2 3.8Å; W227-L254 PolarHBondContact NE1-O 2.95Å; W227-I417 HydrophobicContact CZ2-CD1 4.02Å; W227-I430 HydrophobicContact CH2-CD1 3.71Å; W227-I430 HydrophobicContact CZ2-CD1 4.09Å; W227-W453 HydrophobicContact CE3-CZ2 4.48Å; W227-W453 AromaticContact CH2-CZ2 3.88Å; W227-W453 HydrophobicContact CH2-CZ2 3.88Å; W227-W453 AromaticContact CZ3-CZ2 3.87Å; W227-W453 HydrophobicContact CZ3-CZ2 3.87Å; W227-W453 AromaticContact CZ3-NE1 3.68Å; W227-F470 HydrophobicContact CH2-CE2 4.08Å; W227-F470 AromaticContact CH2-CZ 3.9Å; W227-F470 HydrophobicContact CH2-CZ 3.9Å; W227-F470 AromaticContact CZ3-CE2 3.85Å; W227-F470 HydrophobicContact CZ3-CE2 3.85Å; W227-F470 AromaticContact CZ3-CZ 3.83Å; W227-F470 HydrophobicContact CZ3-CZ 3.83Å |
| 228 | K | 92.3 | Very high | 92.8 | Very high | 113 Ų | 113 | 48.4 Ų | 48.4 | 49% | 0.491 | 24% | 0.236 | S | C | . | . | T | Hydrogen-bonded Turn | trans | 47.9 | 57.8 | 178.9 | -62.6 | 178.5 | 179 | 177.2 | 0 | 111.7 | K230 W256 | K228-K230 PolarHBondContact O-N 2.82Å; K228-K230 VanDerWaalsContact O-N 3.1Å; K228-W256 HydrophobicContact CB-CH2 3.88Å; K228-W256 HydrophobicContact CB-CZ2 4.06Å; K228-W256 HydrophobicContact CD-CH2 4.34Å |
| 229 | E | 91.6 | Very high | 92.2 | Very high | 191 Ų | 191 | 55 Ų | 55 | 89% | 0.893 | 26% | 0.258 | S | S | * | . | T | Hydrogen-bonded Turn | trans | 64.6 | 0.7 | -177.6 | -54 | 177.5 | 170.3 | 0 | 0 | 116 | W227 | W227-E229 PolarHBondContact O-N 3.27Š|
| 230 | K | 93.6 | Very high | 91.1 | Very high | 114 Ų | 114 | 55.7 Ų | 55.7 | 50% | 0.496 | 27% | 0.271 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -119.4 | 128.6 | -176.1 | -63.1 | 176.4 | -167.5 | 164.3 | 0 | 111.8 | W227 K228 T232 W256 | W227-K230 PolarHBondContact N-O 3.26Å; W227-K230 PolarHBondContact O-N 3.07Å; K228-K230 PolarHBondContact O-N 2.82Å; K228-K230 VanDerWaalsContact O-N 3.1Å; K230-T232 PolarHBondContact O-N 3.38Å; K230-T232 PolarHBondContact O-OG1 3.31Å; K230-W256 HydrophobicContact CB-CZ2 4.19Å; K230-W256 HydrophobicContact CD-CH2 3.99Å; K230-W256 HydrophobicContact CD-CZ2 3.75Å; K230-W256 HydrophobicContact CG-CZ2 4.37Å |
| 231 | K | 94.4 | Very high | 89.8 | Confident | 101 Ų | 101 | 55.9 Ų | 55.9 | 44% | 0.439 | 28% | 0.277 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -58.5 | 115.3 | 167.6 | -80.4 | -61.3 | -161.3 | -178.6 | 0 | 108.9 | W224 I225 T226 E449 | W224-K231 HydrophobicContact CE3-CB 4.23Å; W224-K231 WeakPolarHBondContact O-CD 3.41Å; W224-K231 PolarHBondContact O-NZ 3.3Å; I225-K231 CarbonylContact O-C 3.59Å; I225-K231 VanDerWaalsContact O-CA 3.32Å; I225-K231 WeakPolarHBondContact O-CA 3.33Å; T226-K231 PolarHBondContact OG1-NZ 2.85Å; K231-E449 IonicContact NZ-OE1 2.77Å; K231-E449 PolarHBondContact NZ-OE1 3.48Å; K231-E449 IonicContact NZ-OE2 2.64Å |
| 232 | T | 96 | Very high | 89.2 | Confident | 3 Ų | 3 | 54 Ų | 54 | 2% | 0.018 | 27% | 0.268 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -130.5 | 132.4 | -172.1 | -58.6 | 0 | 0 | 0 | 0 | 107.6 | I225 W227 K230 F253 W256 | I225-T232 WeakPolarHBondContact CG1-O 3.46Å; I225-T232 PolarHBondContact N-O 3.12Å; I225-T232 VanDerWaalsContact N-O 3.08Å; I225-T232 PolarHBondContact O-N 2.8Å; W227-T232 HydrophobicContact CB-CG2 4.48Å; K230-T232 PolarHBondContact O-N 3.38Å; K230-T232 PolarHBondContact O-OG1 3.31Å; T232-F253 WeakPolarHBondContact CG2-O 3.45Å; T232-W256 PolarHBondContact OG1-NE1 2.72Å |
| 233 | P | 96.5 | Very high | 88.9 | Confident | 10 Ų | 10 | 54.3 Ų | 54.3 | 7% | 0.065 | 27% | 0.271 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -75 | 143.5 | 178.1 | 31.3 | -33.7 | 0 | 0 | 0 | 110.8 | V222 W224 F253 L260 | V222-P233 HydrophobicContact CG1-CB 3.59Å; W224-P233 HydrophobicContact CD2-CB 4.4Å; W224-P233 HydrophobicContact CE3-CB 4.44Å; W224-P233 HydrophobicContact CH2-CB 4.14Å; W224-P233 HydrophobicContact CH2-CG 4.14Å; W224-P233 HydrophobicContact CZ2-CB 4.06Å; W224-P233 HydrophobicContact CZ2-CG 4.5Å; W224-P233 HydrophobicContact CZ3-CB 4.33Å; W224-P233 HydrophobicContact CZ3-CG 4.34Å; P233-F253 HydrophobicContact CG-CB 4.45Å; P233-F253 HydrophobicContact CG-CD1 4.04Å; P233-F253 HydrophobicContact CG-CG 4.2Å; P233-F253 VanDerWaalsContact O-CB 3.29Å; P233-F253 WeakPolarHBondContact O-CB 3.5Å; P233-L260 HydrophobicContact CB-CD1 4.04Å; P233-L260 HydrophobicContact CG-CB 4.2Å; P233-L260 HydrophobicContact CG-CD1 4.28Å; P233-L260 HydrophobicContact CG-CG 4.23Å |
| 234 | I | 96.6 | Very high | 88.7 | Confident | 0 Ų | 0 | 54.2 Ų | 54.2 | 0% | 0 | 27% | 0.27 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -125.7 | 147.7 | 156.8 | 64.9 | 176 | 0 | 0 | 0 | 108.7 | V222 K223 I225 N250 L254 L439 | V222-I234 WeakPolarHBondContact CA-O 3.21Å; K223-I234 HydrophobicContact CB-CG1 3.9Å; K223-I234 HydrophobicContact CD-CD1 4.43Å; K223-I234 PolarHBondContact N-O 3.38Å; K223-I234 PolarHBondContact O-N 3.03Å; I225-I234 HydrophobicContact CD1-CD1 4.43Å; I225-I234 HydrophobicContact CD1-CG2 3.87Å; I225-I234 HydrophobicContact CG1-CG2 4.2Å; I225-I234 HydrophobicContact CG2-CD1 3.89Å; I225-I234 HydrophobicContact CG2-CG1 4.21Å; I234-N250 WeakPolarHBondContact CA-OD1 3.49Å; I234-L254 HydrophobicContact CG2-CD2 3.97Å; I234-L254 HydrophobicContact CG2-CG 4.26Å; I234-L439 HydrophobicContact CB-CD2 4.29Å; I234-L439 HydrophobicContact CD1-CD1 3.99Å; I234-L439 HydrophobicContact CD1-CD2 4.26Å; I234-L439 HydrophobicContact CD1-CG 4.19Å; I234-L439 HydrophobicContact CG2-CD1 4.47Å; I234-L439 HydrophobicContact CG2-CD2 4.11Å |
| 235 | V | 95.5 | Very high | 88.6 | Confident | 0 Ų | 0 | 51.3 Ų | 51.3 | 0% | 0 | 26% | 0.26 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -95 | 129 | -179.6 | -174.3 | 0 | 0 | 0 | 0 | 108.8 | Y220 L246 N250 F253 V267 L272 | Y220-V235 HydrophobicContact CD2-CG1 4.47Å; Y220-V235 HydrophobicContact CG-CG1 4.03Å; V235-L246 HydrophobicContact CB-CG 4.25Å; V235-L246 HydrophobicContact CG1-CD1 4.44Å; V235-L246 HydrophobicContact CG1-CD2 3.9Å; V235-L246 HydrophobicContact CG1-CG 3.85Å; V235-N250 PolarHBondContact N-OD1 2.94Å; V235-N250 PolarHBondContact O-ND2 3.18Å; V235-F253 HydrophobicContact CG2-CD2 4.32Å; V235-F253 HydrophobicContact CG2-CE2 3.71Å; V235-V267 HydrophobicContact CG1-CG1 4.15Å; V235-V267 HydrophobicContact CG2-CG1 4.12Å; V235-L272 HydrophobicContact CG1-CD1 4.29Å; V235-L272 HydrophobicContact CG2-CD2 4.01Å |
| 236 | T | 94.3 | Very high | 88.6 | Confident | 1 Ų | 1 | 51.2 Ų | 51.2 | 1% | 0.006 | 26% | 0.259 | C | S | . | . | trans | -92.1 | 156.9 | 175.2 | 59.9 | 0 | 0 | 0 | 0 | 112 | L221 K223 T441 L446 | L221-T236 PolarHBondContact O-N 3.02Å; L221-T236 PolarHBondContact O-OG1 2.94Å; K223-T236 HydrophobicContact CB-CG2 4.09Å; T236-T441 CarbonylContact C-O 3.51Å; T236-T441 WeakPolarHBondContact CA-O 3.4Å; T236-T441 WeakPolarHBondContact CB-O 3.44Å; T236-L446 HydrophobicContact CG2-CD1 4.24Å | ||
| 237 | Q | 89.7 | Confident | 88.6 | Confident | 28 Ų | 28 | 48.4 Ų | 48.4 | 13% | 0.131 | 24% | 0.242 | C | C | . | . | B | Isolated β-bridge | trans | -119.7 | 150.4 | -179.2 | 72 | -171.9 | 15.5 | 0 | 0 | 111.7 | L246 H425 T441 Q443 | Q237-L246 HydrophobicContact CB-CD2 3.64Å; Q237-H425 PolarHBondContact NE2-NE2 2.93Å; Q237-H425 PolarHBondContact OE1-NE2 2.86Å; Q237-T441 PolarHBondContact N-O 3.48Å; Q237-Q443 VanDerWaalsContact O-CB 3.27Å; Q237-Q443 WeakPolarHBondContact O-CB 3.42Å; Q237-Q443 PolarHBondContact O-N 3Å |
| 238 | S | 83.3 | Confident | 88.6 | Confident | 62 Ų | 62 | 48.2 Ų | 48.2 | 43% | 0.434 | 24% | 0.241 | S | C | . | . | trans | -96.6 | 173.5 | 161.5 | 58.1 | 0 | 0 | 0 | 0 | 110.2 | N240 G241 | S238-N240 PolarHBondContact O-N 3.44Å; S238-G241 PolarHBondContact O-N 3.33Å | ||
| 239 | E | 65.8 | Low | 88.8 | Confident | 188 Ų | 188 | 42.9 Ų | 42.9 | 88% | 0.879 | 22% | 0.218 | S | C | * | . | T | Hydrogen-bonded Turn | trans | -51 | -22.8 | -174.1 | -64.5 | 179.8 | 125.8 | 0 | 0 | 115.9 | ||
| 240 | N | 64.9 | Low | 89 | Confident | 150 Ų | 150 | 33.8 Ų | 33.8 | 80% | 0.802 | 18% | 0.175 | S | C | * | . | T | Hydrogen-bonded Turn | trans | -123 | 26.1 | -178.5 | -65.4 | -95.7 | 0 | 0 | 0 | 112.1 | S238 | S238-N240 PolarHBondContact O-N 3.44Š|
| 241 | G | 66.4 | Low | 89.2 | Confident | 18 Ų | 18 | 28.3 Ų | 28.3 | 19% | 0.186 | 15% | 0.152 | C | C | . | . | S | Bend | trans | -75.2 | 152.3 | 176.6 | 0 | 0 | 0 | 0 | 0 | 113.2 | S238 C243 | S238-G241 PolarHBondContact O-N 3.33Å; G241-C243 VanDerWaalsContact C-N 3.32Å; G241-C243 PolarHBondContact O-N 3.14Å |
| 242 | P | 80.8 | Confident | 89.3 | Confident | 11 Ų | 11 | 23.5 Ų | 23.5 | 7% | 0.071 | 13% | 0.131 | C | C | . | . | trans | -76.6 | 82.5 | 177.3 | 29.7 | -31.3 | 0 | 0 | 0 | 111.3 | Y220 P244 L245 L246 L310 | Y220-P242 HydrophobicContact CE1-CG 4.33Å; Y220-P242 WeakPolarHBondContact OH-CD 3.21Å; Y220-P242 WeakPolarHBondContact OH-CG 3.44Å; P242-P244 VanDerWaalsContact C-N 3.28Å; P242-P244 WeakPolarHBondContact O-CD 3.24Å; P242-L245 HydrophobicContact CB-CB 4.31Å; P242-L245 HydrophobicContact CG-CB 4.45Å; P242-L245 HydrophobicContact CG-CD2 4.44Å; P242-L245 PolarHBondContact O-N 3.47Å; P242-L246 HydrophobicContact CG-CD1 4.04Å; P242-L246 WeakPolarHBondContact O-CD1 3.45Å; P242-L246 PolarHBondContact O-N 3.42Å; P242-L310 WeakPolarHBondContact CB-O 3.37Å | ||
| 243 | C | 88.1 | Confident | 89.3 | Confident | 15 Ų | 15 | 23.4 Ų | 23.4 | 10% | 0.101 | 13% | 0.13 | C | C | . | . | H | α-helix | trans | -52.6 | -30.8 | 176.7 | 62.6 | 0 | 0 | 0 | 0 | 115.3 | G241 L246 A247 H425 F426 | G241-C243 VanDerWaalsContact C-N 3.32Å; G241-C243 PolarHBondContact O-N 3.14Å; C243-L246 PolarHBondContact O-N 3.17Å; C243-A247 WeakPolarHBondContact O-CB 3.48Å; C243-A247 PolarHBondContact O-N 2.98Å; C243-H425 VanDerWaalsContact CB-NE2 3.29Å; C243-H425 WeakPolarHBondContact CB-NE2 3.27Å; C243-F426 HydrophobicContact CB-CB 4.42Å; C243-F426 PolarHBondContact SG-N 3.4Å; C243-F426 VanDerWaalsContact SG-N 3.43Å |
| 244 | P | 92.1 | Very high | 89.3 | Confident | 4 Ų | 4 | 23.1 Ų | 23.1 | 3% | 0.026 | 13% | 0.128 | C | C | . | . | H | α-helix | trans | -65.3 | -48.2 | 176.1 | -14.9 | 29 | 0 | 0 | 0 | 111.9 | P242 I248 L310 L314 F426 | P242-P244 VanDerWaalsContact C-N 3.28Å; P242-P244 WeakPolarHBondContact O-CD 3.24Å; P244-I248 WeakPolarHBondContact O-CG1 3.21Å; P244-I248 PolarHBondContact O-N 3.28Å; P244-I248 VanDerWaalsContact O-N 3.15Å; P244-L310 HydrophobicContact CB-CD2 3.98Å; P244-L314 HydrophobicContact CB-CB 3.82Å; P244-L314 HydrophobicContact CB-CD2 4.18Å; P244-L314 HydrophobicContact CG-CB 3.6Å; P244-F426 HydrophobicContact CB-CD2 4.18Å; P244-F426 HydrophobicContact CB-CG 4.38Å; P244-F426 HydrophobicContact CG-CD2 3.72Å; P244-F426 HydrophobicContact CG-CE2 3.98Å; P244-F426 HydrophobicContact CG-CG 4.38Å |
| 245 | L | 93 | Very high | 89.2 | Confident | 0 Ų | 0 | 26.2 Ų | 26.2 | 0% | 0 | 14% | 0.14 | C | C | . | . | H | α-helix | trans | -60.8 | -46.6 | 175.6 | 177.4 | 60.3 | 0 | 0 | 0 | 111 | P242 I248 M249 T269 L272 M273 L276 L310 | P242-L245 HydrophobicContact CB-CB 4.31Å; P242-L245 HydrophobicContact CG-CB 4.45Å; P242-L245 HydrophobicContact CG-CD2 4.44Å; P242-L245 PolarHBondContact O-N 3.47Å; L245-I248 PolarHBondContact O-N 2.97Å; L245-M249 HydrophobicContact CD1-CG 3.89Å; L245-M249 HydrophobicContact CG-CG 4.38Å; L245-M249 WeakPolarHBondContact O-CB 3.5Å; L245-M249 VanDerWaalsContact O-CG 3.27Å; L245-M249 WeakPolarHBondContact O-CG 3.26Å; L245-M249 PolarHBondContact O-N 3.1Å; L245-T269 HydrophobicContact CD2-CG2 4.23Å; L245-L272 HydrophobicContact CD2-CB 4.25Å; L245-L272 HydrophobicContact CD2-CD1 4.44Å; L245-M273 HydrophobicContact CD1-SD 4.24Å; L245-M273 HydrophobicContact CD2-CG 4.35Å; L245-M273 HydrophobicContact CD2-SD 4.43Å; L245-L276 HydrophobicContact CD1-CD2 3.66Å; L245-L310 HydrophobicContact CB-CB 4.12Å; L245-L310 WeakPolarHBondContact CB-O 3.33Å; L245-L310 PolarHBondContact N-O 3.45Å |
| 246 | L | 94.4 | Very high | 89.2 | Confident | 1 Ų | 1 | 30.4 Ų | 30.4 | 1% | 0.005 | 16% | 0.156 | C | C | . | . | H | α-helix | trans | -67.7 | -39.1 | -178 | -89.6 | 62.9 | 0 | 0 | 0 | 112.3 | Y220 V235 Q237 P242 C243 M249 N250 L272 | Y220-L246 HydrophobicContact CD1-CD2 4.35Å; Y220-L246 HydrophobicContact CD2-CD1 4.42Å; Y220-L246 HydrophobicContact CE1-CD1 4.49Å; Y220-L246 HydrophobicContact CE2-CD1 4.36Å; Y220-L246 HydrophobicContact CG-CD1 4.49Å; V235-L246 HydrophobicContact CB-CG 4.25Å; V235-L246 HydrophobicContact CG1-CD1 4.44Å; V235-L246 HydrophobicContact CG1-CD2 3.9Å; V235-L246 HydrophobicContact CG1-CG 3.85Å; Q237-L246 HydrophobicContact CB-CD2 3.64Å; P242-L246 HydrophobicContact CG-CD1 4.04Å; P242-L246 WeakPolarHBondContact O-CD1 3.45Å; P242-L246 PolarHBondContact O-N 3.42Å; C243-L246 PolarHBondContact O-N 3.17Å; L246-M249 PolarHBondContact O-N 3.1Å; L246-N250 VanDerWaalsContact O-CB 3.22Å; L246-N250 WeakPolarHBondContact O-CB 3.25Å; L246-N250 VanDerWaalsContact O-CG 3.28Å; L246-N250 PolarHBondContact O-N 2.98Å; L246-N250 PolarHBondContact O-ND2 2.91Å; L246-L272 HydrophobicContact CD1-CD1 4.08Å |
| 247 | A | 95.4 | Very high | 89.1 | Confident | 3 Ų | 3 | 35.3 Ų | 35.3 | 3% | 0.025 | 18% | 0.177 | C | C | . | . | H | α-helix | trans | -65.7 | -38.2 | 177.2 | 0 | 0 | 0 | 0 | 0 | 112.6 | C243 T251 V419 F426 T428 | C243-A247 WeakPolarHBondContact O-CB 3.48Å; C243-A247 PolarHBondContact O-N 2.98Å; A247-T251 WeakPolarHBondContact O-CB 3.41Å; A247-T251 PolarHBondContact O-N 2.98Å; A247-T251 VanDerWaalsContact O-N 3.16Å; A247-T251 PolarHBondContact O-OG1 3.03Å; A247-V419 HydrophobicContact CB-CG1 3.89Å; A247-V419 HydrophobicContact CB-CG2 3.93Å; A247-F426 HydrophobicContact CB-CB 4.04Å; A247-T428 WeakPolarHBondContact CA-OG1 3.38Å; A247-T428 PolarHBondContact O-OG1 2.74Å |
| 248 | I | 95.4 | Very high | 89.2 | Confident | 0 Ų | 0 | 34.2 Ų | 34.2 | 0% | 0 | 17% | 0.173 | C | C | . | . | H | α-helix | trans | -67 | -50.7 | 172.1 | -67.6 | 167.8 | 0 | 0 | 0 | 110.3 | P244 L245 N250 T251 L252 L276 L310 V334 F335 L338 I340 | P244-I248 WeakPolarHBondContact O-CG1 3.21Å; P244-I248 PolarHBondContact O-N 3.28Å; P244-I248 VanDerWaalsContact O-N 3.15Å; L245-I248 PolarHBondContact O-N 2.97Å; I248-N250 PolarHBondContact O-N 3.32Å; I248-T251 CarbonylContact O-C 3.6Å; I248-T251 WeakPolarHBondContact O-CA 3.48Å; I248-T251 VanDerWaalsContact O-CB 3.29Å; I248-T251 WeakPolarHBondContact O-CB 3.46Å; I248-T251 PolarHBondContact O-N 3.03Å; I248-T251 VanDerWaalsContact O-N 3.1Å; I248-L252 HydrophobicContact CG2-CD1 4.05Å; I248-L252 HydrophobicContact CG2-CG 4.41Å; I248-L252 WeakPolarHBondContact O-CG 3.19Å; I248-L252 PolarHBondContact O-N 2.97Å; I248-L276 HydrophobicContact CG2-CD1 3.68Å; I248-L310 HydrophobicContact CD1-CD1 4.12Å; I248-L310 HydrophobicContact CD1-CD2 3.84Å; I248-V334 HydrophobicContact CD1-CG1 4.16Å; I248-F335 HydrophobicContact CD1-CE1 4.01Å; I248-F335 HydrophobicContact CD1-CE2 4.16Å; I248-F335 HydrophobicContact CD1-CZ 3.75Å; I248-F335 HydrophobicContact CG1-CD1 4.42Å; I248-F335 HydrophobicContact CG1-CE1 3.78Å; I248-F335 HydrophobicContact CG1-CZ 4.01Å; I248-L338 HydrophobicContact CG2-CD1 3.67Å; I248-I340 HydrophobicContact CG2-CD1 4Å |
| 249 | M | 95.9 | Very high | 89.5 | Confident | 0 Ų | 0 | 38.4 Ų | 38.4 | 0% | 0 | 18% | 0.183 | C | C | . | . | H | α-helix | trans | -63.9 | -42.1 | -176.4 | -73.6 | -56 | -61.8 | 0 | 0 | 112.5 | L245 L246 T251 L252 F253 A258 L272 H275 L276 | L245-M249 HydrophobicContact CD1-CG 3.89Å; L245-M249 HydrophobicContact CG-CG 4.38Å; L245-M249 WeakPolarHBondContact O-CB 3.5Å; L245-M249 VanDerWaalsContact O-CG 3.27Å; L245-M249 WeakPolarHBondContact O-CG 3.26Å; L245-M249 PolarHBondContact O-N 3.1Å; L246-M249 PolarHBondContact O-N 3.1Å; M249-T251 VanDerWaalsContact C-N 3.31Å; M249-T251 PolarHBondContact O-N 3.4Å; M249-L252 CarbonylContact O-C 3.57Å; M249-L252 WeakPolarHBondContact O-CB 3.34Å; M249-L252 PolarHBondContact O-N 3.05Å; M249-L252 HydrophobicContact SD-CD1 3.93Å; M249-F253 HydrophobicContact CB-CD2 4.44Å; M249-F253 HydrophobicContact CB-CE2 4.01Å; M249-F253 HydrophobicContact CE-CE1 4.21Å; M249-F253 HydrophobicContact CE-CE2 3.89Å; M249-F253 HydrophobicContact CE-CZ 3.55Å; M249-F253 WeakPolarHBondContact O-CD2 3.41Å; M249-F253 WeakPolarHBondContact O-CG 3.41Å; M249-F253 PolarHBondContact O-N 3.34Å; M249-A258 HydrophobicContact CE-CB 4.19Å; M249-L272 HydrophobicContact CB-CD2 4.39Å; M249-L272 HydrophobicContact CE-CD2 3.98Å; M249-L272 HydrophobicContact CG-CB 4.28Å; M249-L272 HydrophobicContact CG-CD2 4.21Å; M249-H275 HydrophobicContact CE-CB 3.66Å; M249-L276 HydrophobicContact SD-CB 3.83Å; M249-L276 HydrophobicContact SD-CD1 4.3Å |
| 250 | N | 97.1 | Very high | 90.8 | Very high | 0 Ų | 0 | 30.4 Ų | 30.4 | 0% | 0 | 15% | 0.146 | C | C | . | . | H | α-helix | trans | -62 | -38.7 | 172.6 | -74.7 | -27.8 | 0 | 0 | 0 | 111.9 | I234 V235 L246 I248 L252 F253 L254 T428 L439 T441 | I234-N250 WeakPolarHBondContact CA-OD1 3.49Å; V235-N250 PolarHBondContact N-OD1 2.94Å; V235-N250 PolarHBondContact O-ND2 3.18Å; L246-N250 VanDerWaalsContact O-CB 3.22Å; L246-N250 WeakPolarHBondContact O-CB 3.25Å; L246-N250 VanDerWaalsContact O-CG 3.28Å; L246-N250 PolarHBondContact O-N 2.98Å; L246-N250 PolarHBondContact O-ND2 2.91Å; I248-N250 PolarHBondContact O-N 3.32Å; N250-L252 VanDerWaalsContact C-N 3.32Å; N250-L252 PolarHBondContact O-N 3.31Å; N250-F253 PolarHBondContact O-N 3.38Å; N250-L254 WeakPolarHBondContact O-CB 3.47Å; N250-L254 WeakPolarHBondContact O-CG 3.31Å; N250-L254 PolarHBondContact O-N 2.62Å; N250-T428 WeakPolarHBondContact CB-OG1 3.13Å; N250-L439 HydrophobicContact CB-CD2 3.64Å; N250-T441 WeakPolarHBondContact ND2-CG2 3.32Å |
| 251 | T | 97 | Very high | 92 | Very high | 0 Ų | 0 | 27.5 Ų | 27.5 | 0% | 0 | 14% | 0.135 | C | C | . | . | H | α-helix | trans | -60.4 | -40.8 | 170.9 | -59.3 | 0 | 0 | 0 | 0 | 111.8 | A247 I248 M249 R255 I340 I417 T428 | A247-T251 WeakPolarHBondContact O-CB 3.41Å; A247-T251 PolarHBondContact O-N 2.98Å; A247-T251 VanDerWaalsContact O-N 3.16Å; A247-T251 PolarHBondContact O-OG1 3.03Å; I248-T251 CarbonylContact O-C 3.6Å; I248-T251 WeakPolarHBondContact O-CA 3.48Å; I248-T251 VanDerWaalsContact O-CB 3.29Å; I248-T251 WeakPolarHBondContact O-CB 3.46Å; I248-T251 PolarHBondContact O-N 3.03Å; I248-T251 VanDerWaalsContact O-N 3.1Å; M249-T251 VanDerWaalsContact C-N 3.31Å; M249-T251 PolarHBondContact O-N 3.4Å; T251-R255 VanDerWaalsContact O-CB 3.26Å; T251-R255 WeakPolarHBondContact O-CB 3.46Å; T251-R255 VanDerWaalsContact O-CD 3.3Å; T251-R255 WeakPolarHBondContact O-CD 3.47Å; T251-R255 WeakPolarHBondContact O-CG 3.35Å; T251-R255 PolarHBondContact O-N 3.4Å; T251-R255 VanDerWaalsContact O-N 3.1Å; T251-I340 HydrophobicContact CG2-CD1 3.84Å; T251-I340 HydrophobicContact CG2-CG1 3.82Å; T251-I340 HydrophobicContact CG2-CG2 4.07Å; T251-I417 HydrophobicContact CG2-CB 4.3Å; T251-I417 HydrophobicContact CG2-CG2 3.86Å; T251-T428 WeakPolarHBondContact OG1-CG2 3.37Å |
| 252 | L | 96.1 | Very high | 93.1 | Very high | 0 Ų | 0 | 30.7 Ų | 30.7 | 0% | 0 | 16% | 0.16 | C | C | . | . | H | α-helix | trans | -70.7 | -37.5 | 178.2 | -65.7 | 174.1 | 0 | 0 | 0 | 113.2 | I248 M249 N250 W256 K257 A258 L276 C279 L338 I340 | I248-L252 HydrophobicContact CG2-CD1 4.05Å; I248-L252 HydrophobicContact CG2-CG 4.41Å; I248-L252 WeakPolarHBondContact O-CG 3.19Å; I248-L252 PolarHBondContact O-N 2.97Å; M249-L252 CarbonylContact O-C 3.57Å; M249-L252 WeakPolarHBondContact O-CB 3.34Å; M249-L252 PolarHBondContact O-N 3.05Å; M249-L252 HydrophobicContact SD-CD1 3.93Å; N250-L252 VanDerWaalsContact C-N 3.32Å; N250-L252 PolarHBondContact O-N 3.31Å; L252-W256 PolarHBondContact O-N 2.97Å; L252-K257 HydrophobicContact CB-CB 4.45Å; L252-K257 HydrophobicContact CD2-CB 4.05Å; L252-K257 HydrophobicContact CD2-CD 3.65Å; L252-K257 HydrophobicContact CD2-CG 4.45Å; L252-K257 PolarHBondContact O-N 2.81Å; L252-A258 HydrophobicContact CB-CB 3.91Å; L252-A258 PolarHBondContact O-N 3.41Å; L252-L276 HydrophobicContact CD1-CD1 3.81Å; L252-C279 HydrophobicContact CD1-CB 3.92Å; L252-L338 HydrophobicContact CD1-CD1 4.27Å; L252-L338 HydrophobicContact CD2-CD2 4.29Å; L252-I340 HydrophobicContact CD2-CD1 4.4Å |
| 253 | F | 96.6 | Very high | 93.3 | Very high | 1 Ų | 1 | 38.6 Ų | 38.6 | 0% | 0.004 | 20% | 0.196 | C | C | . | . | H | α-helix | trans | -69.4 | -45.2 | 175.3 | -65.6 | -53.2 | 0 | 0 | 0 | 112.1 | T232 P233 V235 M249 N250 R255 W256 A258 L260 L272 | T232-F253 WeakPolarHBondContact CG2-O 3.45Å; P233-F253 HydrophobicContact CG-CB 4.45Å; P233-F253 HydrophobicContact CG-CD1 4.04Å; P233-F253 HydrophobicContact CG-CG 4.2Å; P233-F253 VanDerWaalsContact O-CB 3.29Å; P233-F253 WeakPolarHBondContact O-CB 3.5Å; V235-F253 HydrophobicContact CG2-CD2 4.32Å; V235-F253 HydrophobicContact CG2-CE2 3.71Å; M249-F253 HydrophobicContact CB-CD2 4.44Å; M249-F253 HydrophobicContact CB-CE2 4.01Å; M249-F253 HydrophobicContact CE-CE1 4.21Å; M249-F253 HydrophobicContact CE-CE2 3.89Å; M249-F253 HydrophobicContact CE-CZ 3.55Å; M249-F253 WeakPolarHBondContact O-CD2 3.41Å; M249-F253 WeakPolarHBondContact O-CG 3.41Å; M249-F253 PolarHBondContact O-N 3.34Å; N250-F253 PolarHBondContact O-N 3.38Å; F253-R255 VanDerWaalsContact C-N 3.25Å; F253-R255 PolarHBondContact O-N 2.87Å; F253-W256 WeakPolarHBondContact O-CA 3.49Å; F253-W256 VanDerWaalsContact O-CD1 3.24Å; F253-W256 PolarHBondContact O-N 2.99Å; F253-A258 HydrophobicContact CD1-CB 3.63Å; F253-A258 HydrophobicContact CE1-CB 3.56Å; F253-A258 HydrophobicContact CG-CB 4.49Å; F253-A258 HydrophobicContact CZ-CB 4.39Å; F253-L260 HydrophobicContact CE1-CD1 4.44Å; F253-L260 HydrophobicContact CE1-CD2 4.07Å; F253-L260 HydrophobicContact CE1-CG 3.74Å; F253-L260 HydrophobicContact CZ-CD1 4.09Å; F253-L260 HydrophobicContact CZ-CD2 3.93Å; F253-L260 HydrophobicContact CZ-CG 3.78Å; F253-L272 HydrophobicContact CE2-CD2 4.15Å; F253-L272 HydrophobicContact CZ-CD2 4.14Å |
| 254 | L | 96.4 | Very high | 93.6 | Very high | 4 Ų | 4 | 39.2 Ų | 39.2 | 2% | 0.021 | 20% | 0.2 | C | C | . | . | H | α-helix | trans | -68.2 | -22.8 | 177.3 | -66.1 | 170.6 | 0 | 0 | 0 | 113.4 | I225 W227 I234 N250 W256 I417 T428 L439 W453 | I225-L254 HydrophobicContact CD1-CD2 3.82Å; W227-L254 HydrophobicContact CB-CD2 4.35Å; W227-L254 HydrophobicContact CD2-CD2 3.97Å; W227-L254 HydrophobicContact CG-CD2 3.8Å; W227-L254 PolarHBondContact NE1-O 2.95Å; I234-L254 HydrophobicContact CG2-CD2 3.97Å; I234-L254 HydrophobicContact CG2-CG 4.26Å; N250-L254 WeakPolarHBondContact O-CB 3.47Å; N250-L254 WeakPolarHBondContact O-CG 3.31Å; N250-L254 PolarHBondContact O-N 2.62Å; L254-W256 VanDerWaalsContact C-N 3.35Å; L254-I417 HydrophobicContact CB-CD1 3.48Å; L254-I417 VanDerWaalsContact CB-CD1 3.48Å; L254-I417 HydrophobicContact CD1-CD1 4.34Å; L254-T428 HydrophobicContact CD1-CG2 4.09Å; L254-L439 HydrophobicContact CD1-CD1 4.17Å; L254-L439 HydrophobicContact CD1-CD2 4.15Å; L254-W453 HydrophobicContact CD1-CH2 3.85Å; L254-W453 HydrophobicContact CD1-CZ2 4.14Å |
| 255 | R | 95.1 | Very high | 93.6 | Very high | 64 Ų | 64 | 46.3 Ų | 46.3 | 24% | 0.242 | 23% | 0.233 | C | C | . | . | T | Hydrogen-bonded Turn | trans | -87.2 | -1.7 | 168.6 | -69.2 | 170.5 | 173.6 | -156.9 | -4.8 | 113.2 | T251 F253 K257 L338 N339 I417 | T251-R255 VanDerWaalsContact O-CB 3.26Å; T251-R255 WeakPolarHBondContact O-CB 3.46Å; T251-R255 VanDerWaalsContact O-CD 3.3Å; T251-R255 WeakPolarHBondContact O-CD 3.47Å; T251-R255 WeakPolarHBondContact O-CG 3.35Å; T251-R255 PolarHBondContact O-N 3.4Å; T251-R255 VanDerWaalsContact O-N 3.1Å; F253-R255 VanDerWaalsContact C-N 3.25Å; F253-R255 PolarHBondContact O-N 2.87Å; R255-K257 HydrophobicContact CB-CG 4.49Å; R255-K257 PolarHBondContact O-N 2.74Å; R255-K257 VanDerWaalsContact O-N 3.15Å; R255-L338 PolarHBondContact NH1-O 2.93Å; R255-N339 VanDerWaalsContact CZ-O 3.29Å; R255-N339 PolarHBondContact NH1-O 3.45Å; R255-N339 PolarHBondContact NH2-O 2.95Å; R255-I417 HydrophobicContact CG-CD1 4.31Å; R255-I417 PolarHBondContact NH2-O 2.62Å |
| 256 | W | 94.4 | Very high | 93.6 | Very high | 88 Ų | 88 | 49.4 Ų | 49.4 | 33% | 0.333 | 25% | 0.251 | S | S | . | . | T | Hydrogen-bonded Turn | trans | 53.8 | 23.4 | -174.4 | -52.7 | -48.1 | 0 | 0 | 0 | 115.5 | K228 K230 T232 L252 F253 L254 | K228-W256 HydrophobicContact CB-CH2 3.88Å; K228-W256 HydrophobicContact CB-CZ2 4.06Å; K228-W256 HydrophobicContact CD-CH2 4.34Å; K230-W256 HydrophobicContact CB-CZ2 4.19Å; K230-W256 HydrophobicContact CD-CH2 3.99Å; K230-W256 HydrophobicContact CD-CZ2 3.75Å; K230-W256 HydrophobicContact CG-CZ2 4.37Å; T232-W256 PolarHBondContact OG1-NE1 2.72Å; L252-W256 PolarHBondContact O-N 2.97Å; F253-W256 WeakPolarHBondContact O-CA 3.49Å; F253-W256 VanDerWaalsContact O-CD1 3.24Å; F253-W256 PolarHBondContact O-N 2.99Å; L254-W256 VanDerWaalsContact C-N 3.35Å |
| 257 | K | 92 | Very high | 93.6 | Very high | 105 Ų | 105 | 49.4 Ų | 49.4 | 46% | 0.457 | 25% | 0.251 | S | S | . | . | S | Bend | trans | -70.6 | -51.4 | 170.2 | -78.6 | -171.8 | 169.6 | -169.4 | 0 | 110 | L252 R255 L338 | L252-K257 HydrophobicContact CB-CB 4.45Å; L252-K257 HydrophobicContact CD2-CB 4.05Å; L252-K257 HydrophobicContact CD2-CD 3.65Å; L252-K257 HydrophobicContact CD2-CG 4.45Å; L252-K257 PolarHBondContact O-N 2.81Å; R255-K257 HydrophobicContact CB-CG 4.49Å; R255-K257 PolarHBondContact O-N 2.74Å; R255-K257 VanDerWaalsContact O-N 3.15Å; K257-L338 PolarHBondContact NZ-O 3.16Å |
| 258 | A | 91.8 | Very high | 93.4 | Very high | 5 Ų | 5 | 50.2 Ų | 50.2 | 4% | 0.041 | 26% | 0.256 | C | S | . | . | S | Bend | trans | -92.9 | 154.7 | 170.6 | 0 | 0 | 0 | 0 | 0 | 110.6 | M249 L252 F253 | M249-A258 HydrophobicContact CE-CB 4.19Å; L252-A258 HydrophobicContact CB-CB 3.91Å; L252-A258 PolarHBondContact O-N 3.41Å; F253-A258 HydrophobicContact CD1-CB 3.63Å; F253-A258 HydrophobicContact CE1-CB 3.56Å; F253-A258 HydrophobicContact CG-CB 4.49Å; F253-A258 HydrophobicContact CZ-CB 4.39Å |
| 259 | K | 90.8 | Very high | 93.2 | Very high | 149 Ų | 149 | 51.3 Ų | 51.3 | 65% | 0.648 | 26% | 0.263 | S | S | * | . | trans | -149 | 135.2 | 177.9 | -62.7 | 174.6 | -172.4 | 160.4 | 0 | 110 | ||||
| 260 | L | 92.1 | Very high | 92.9 | Very high | 20 Ų | 20 | 58.4 Ų | 58.4 | 11% | 0.105 | 30% | 0.296 | C | S | . | . | P | Polyproline II helix | trans | -95.6 | 158.5 | 167.7 | -60.5 | 179.2 | 0 | 0 | 0 | 110.5 | V222 P233 F253 T264 V267 | V222-L260 HydrophobicContact CG1-CD1 4.04Å; V222-L260 HydrophobicContact CG2-CD1 3.97Å; P233-L260 HydrophobicContact CB-CD1 4.04Å; P233-L260 HydrophobicContact CG-CB 4.2Å; P233-L260 HydrophobicContact CG-CD1 4.28Å; P233-L260 HydrophobicContact CG-CG 4.23Å; F253-L260 HydrophobicContact CE1-CD1 4.44Å; F253-L260 HydrophobicContact CE1-CD2 4.07Å; F253-L260 HydrophobicContact CE1-CG 3.74Å; F253-L260 HydrophobicContact CZ-CD1 4.09Å; F253-L260 HydrophobicContact CZ-CD2 3.93Å; F253-L260 HydrophobicContact CZ-CG 3.78Å; L260-T264 HydrophobicContact CD1-CG2 4.25Å; L260-V267 HydrophobicContact CD2-CG2 4.24Å |
| 261 | P | 91.4 | Very high | 92.6 | Very high | 89 Ų | 89 | 62.8 Ų | 62.8 | 58% | 0.578 | 32% | 0.316 | S | S | * | . | P | Polyproline II helix | trans | -53.7 | 150.9 | 166.8 | -23.5 | 33.6 | 0 | 0 | 0 | 112.2 | W224 T264 | W224-P261 WeakPolarHBondContact CH2-O 3.31Å; W224-P261 WeakPolarHBondContact CZ2-O 3.45Å; P261-T264 WeakPolarHBondContact CD-OG1 3.32Å; P261-T264 PolarHBondContact O-N 3.04Å; P261-T264 PolarHBondContact O-OG1 2.94Å |
| 262 | A | 89.1 | Confident | 92.4 | Very high | 86 Ų | 86 | 62.8 Ų | 62.8 | 71% | 0.711 | 32% | 0.316 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -63.7 | 140.1 | 173.4 | 0 | 0 | 0 | 0 | 0 | 110.3 | T264 | A262-T264 VanDerWaalsContact C-N 3.27Å; A262-T264 PolarHBondContact O-N 2.89Å |
| 263 | Q | 85.9 | Confident | 92.2 | Very high | 177 Ų | 177 | 64.7 Ų | 64.7 | 83% | 0.827 | 33% | 0.325 | S | S | * | . | T | Hydrogen-bonded Turn | trans | 66.8 | 17.5 | -178.7 | -52.6 | 174.8 | -17.2 | 0 | 0 | 115.2 | E265 | Q263-E265 PolarHBondContact O-N 3.48Š|
| 264 | T | 92.8 | Very high | 91.9 | Very high | 28 Ų | 28 | 67.8 Ų | 67.8 | 17% | 0.172 | 35% | 0.352 | C | S | . | . | trans | -63.5 | 114.2 | 162.9 | -63.9 | 0 | 0 | 0 | 0 | 109.6 | V222 W224 L260 P261 A262 V266 | V222-T264 WeakPolarHBondContact CB-O 3.28Å; V222-T264 WeakPolarHBondContact CG1-O 3.49Å; V222-T264 HydrophobicContact CG2-CG2 4.27Å; W224-T264 PolarHBondContact NE1-O 3.36Å; L260-T264 HydrophobicContact CD1-CG2 4.25Å; P261-T264 WeakPolarHBondContact CD-OG1 3.32Å; P261-T264 PolarHBondContact O-N 3.04Å; P261-T264 PolarHBondContact O-OG1 2.94Å; A262-T264 VanDerWaalsContact C-N 3.27Å; A262-T264 PolarHBondContact O-N 2.89Å; T264-V266 WeakPolarHBondContact CG2-O 3.5Å | ||
| 265 | E | 93.1 | Very high | 91.7 | Very high | 153 Ų | 153 | 70.5 Ų | 70.5 | 72% | 0.715 | 36% | 0.364 | S | S | * | . | trans | -92.4 | -25.5 | 176.7 | -63.6 | -178.8 | 165 | 0 | 0 | 112.9 | V222 Q263 | V222-E265 PolarHBondContact N-O 3.14Å; Q263-E265 PolarHBondContact O-N 3.48Å | ||
| 266 | V | 93.6 | Very high | 91.6 | Very high | 64 Ų | 64 | 67.5 Ų | 67.5 | 39% | 0.388 | 35% | 0.353 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -136.1 | 140.4 | -174.7 | -170.5 | 0 | 0 | 0 | 0 | 109.1 | Y219 Y220 L221 T264 | Y219-V266 HydrophobicContact CD1-CG1 3.74Å; Y219-V266 HydrophobicContact CG-CG1 4.1Å; Y220-V266 WeakPolarHBondContact O-CA 3.02Å; L221-V266 HydrophobicContact CD2-CG1 4.46Å; L221-V266 HydrophobicContact CD2-CG2 3.85Å; T264-V266 WeakPolarHBondContact CG2-O 3.5Å |
| 267 | V | 93.6 | Very high | 91.4 | Very high | 1 Ų | 1 | 63.8 Ų | 63.8 | 1% | 0.006 | 34% | 0.342 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -134.5 | 142.1 | 174.4 | 67.4 | 0 | 0 | 0 | 0 | 110.4 | Y219 Y220 V222 V235 L260 E271 L272 | Y219-V267 WeakPolarHBondContact CA-O 3.37Å; Y220-V267 PolarHBondContact N-O 3.35Å; Y220-V267 PolarHBondContact O-N 3.44Å; V222-V267 HydrophobicContact CG2-CB 4Å; V222-V267 HydrophobicContact CG2-CG1 3.72Å; V235-V267 HydrophobicContact CG1-CG1 4.15Å; V235-V267 HydrophobicContact CG2-CG1 4.12Å; L260-V267 HydrophobicContact CD2-CG2 4.24Å; V267-E271 HydrophobicContact CG2-CB 3.74Å; V267-L272 HydrophobicContact CG1-CD1 4.27Å; V267-L272 HydrophobicContact CG1-CD2 3.97Å; V267-L272 HydrophobicContact CG1-CG 4.12Å; V267-L272 HydrophobicContact CG2-CD2 3.88Å; V267-L272 HydrophobicContact CG2-CG 4.01Å |
| 268 | T | 92.1 | Very high | 91.4 | Very high | 21 Ų | 21 | 64.8 Ų | 64.8 | 13% | 0.129 | 35% | 0.348 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -86.8 | 160.6 | 177.3 | 59.5 | 0 | 0 | 0 | 0 | 112.5 | Y219 E270 E271 L272 | Y219-T268 HydrophobicContact CD1-CG2 3.61Å; Y219-T268 HydrophobicContact CE1-CG2 3.51Å; T268-E270 PolarHBondContact O-N 2.7Å; T268-E271 WeakPolarHBondContact CB-OE2 3.39Å; T268-E271 WeakPolarHBondContact CG2-OE2 3.44Å; T268-E271 PolarHBondContact N-OE2 3.37Å; T268-E271 PolarHBondContact O-N 3.06Å; T268-E271 WeakPolarHBondContact OG1-CB 3.27Å; T268-E271 VanDerWaalsContact OG1-CD 3.29Å; T268-E271 VanDerWaalsContact OG1-CG 3.25Å; T268-E271 WeakPolarHBondContact OG1-CG 3.38Å; T268-E271 PolarHBondContact OG1-N 3.43Å; T268-E271 VanDerWaalsContact OG1-N 3.1Å; T268-E271 PolarHBondContact OG1-OE2 2.84Å; T268-L272 WeakPolarHBondContact O-CG 3.41Å; T268-L272 PolarHBondContact O-N 3.02Å; T268-L272 VanDerWaalsContact O-N 3.1Å |
| 269 | T | 89.6 | Confident | 91.3 | Very high | 23 Ų | 23 | 65 Ų | 65 | 14% | 0.141 | 35% | 0.35 | C | S | . | . | H | α-helix | trans | -54.1 | -41.2 | 166.9 | -54.6 | 0 | 0 | 0 | 0 | 112 | A218 Y220 L245 L272 M273 | A218-T269 WeakPolarHBondContact CB-OG1 3.47Å; A218-T269 PolarHBondContact O-N 3.17Å; A218-T269 PolarHBondContact O-OG1 2.92Å; Y220-T269 WeakPolarHBondContact CE2-OG1 3.43Å; Y220-T269 PolarHBondContact OH-OG1 3.44Å; Y220-T269 VanDerWaalsContact OH-OG1 3.11Å; L245-T269 HydrophobicContact CD2-CG2 4.23Å; T269-L272 PolarHBondContact O-N 3.19Å; T269-M273 HydrophobicContact CG2-CG 4.19Å; T269-M273 VanDerWaalsContact O-CB 3.27Å; T269-M273 WeakPolarHBondContact O-CB 3.44Å; T269-M273 WeakPolarHBondContact O-CG 3.35Å; T269-M273 PolarHBondContact O-N 3.26Å |
| 270 | E | 89.6 | Confident | 91.3 | Very high | 148 Ų | 148 | 58 Ų | 58 | 69% | 0.692 | 32% | 0.319 | S | S | * | . | H | α-helix | trans | -64.3 | -42.4 | -179.1 | -65.7 | 178.9 | -160.9 | 0 | 0 | 112.3 | T268 M273 A274 | T268-E270 PolarHBondContact O-N 2.7Å; E270-M273 PolarHBondContact O-N 3.08Å; E270-A274 WeakPolarHBondContact O-CB 3.4Å; E270-A274 PolarHBondContact O-N 2.85Å |
| 271 | E | 91.8 | Very high | 91.1 | Very high | 92 Ų | 92 | 61.9 Ų | 61.9 | 43% | 0.43 | 34% | 0.34 | S | S | . | . | H | α-helix | trans | -66.5 | -41.8 | 175.8 | -71.7 | 160.9 | 127.7 | 0 | 0 | 112.2 | V267 T268 M273 A274 H275 | V267-E271 HydrophobicContact CG2-CB 3.74Å; T268-E271 WeakPolarHBondContact CB-OE2 3.39Å; T268-E271 WeakPolarHBondContact CG2-OE2 3.44Å; T268-E271 PolarHBondContact N-OE2 3.37Å; T268-E271 PolarHBondContact O-N 3.06Å; T268-E271 WeakPolarHBondContact OG1-CB 3.27Å; T268-E271 VanDerWaalsContact OG1-CD 3.29Å; T268-E271 VanDerWaalsContact OG1-CG 3.25Å; T268-E271 WeakPolarHBondContact OG1-CG 3.38Å; T268-E271 PolarHBondContact OG1-N 3.43Å; T268-E271 VanDerWaalsContact OG1-N 3.1Å; T268-E271 PolarHBondContact OG1-OE2 2.84Å; E271-M273 VanDerWaalsContact C-N 3.35Å; E271-A274 PolarHBondContact O-N 2.97Å; E271-H275 WeakPolarHBondContact O-CB 3.09Å; E271-H275 PolarHBondContact O-CD2 2.88Å; E271-H275 PolarHBondContact O-N 2.83Å |
| 272 | L | 92.5 | Very high | 90.9 | Very high | 0 Ų | 0 | 61.2 Ų | 61.2 | 0% | 0 | 34% | 0.337 | C | S | . | . | H | α-helix | trans | -61.9 | -43.7 | 174.3 | -67.7 | -178.7 | 0 | 0 | 0 | 111.5 | Y220 V235 L245 L246 M249 F253 V267 T268 T269 H275 L276 | Y220-L272 HydrophobicContact CD2-CD1 3.64Å; Y220-L272 HydrophobicContact CE2-CD1 4.01Å; V235-L272 HydrophobicContact CG1-CD1 4.29Å; V235-L272 HydrophobicContact CG2-CD2 4.01Å; L245-L272 HydrophobicContact CD2-CB 4.25Å; L245-L272 HydrophobicContact CD2-CD1 4.44Å; L246-L272 HydrophobicContact CD1-CD1 4.08Å; M249-L272 HydrophobicContact CB-CD2 4.39Å; M249-L272 HydrophobicContact CE-CD2 3.98Å; M249-L272 HydrophobicContact CG-CB 4.28Å; M249-L272 HydrophobicContact CG-CD2 4.21Å; F253-L272 HydrophobicContact CE2-CD2 4.15Å; F253-L272 HydrophobicContact CZ-CD2 4.14Å; V267-L272 HydrophobicContact CG1-CD1 4.27Å; V267-L272 HydrophobicContact CG1-CD2 3.97Å; V267-L272 HydrophobicContact CG1-CG 4.12Å; V267-L272 HydrophobicContact CG2-CD2 3.88Å; V267-L272 HydrophobicContact CG2-CG 4.01Å; T268-L272 WeakPolarHBondContact O-CG 3.41Å; T268-L272 PolarHBondContact O-N 3.02Å; T268-L272 VanDerWaalsContact O-N 3.1Å; T269-L272 PolarHBondContact O-N 3.19Å; L272-H275 PolarHBondContact O-N 2.92Å; L272-L276 WeakPolarHBondContact O-CB 3.28Å; L272-L276 PolarHBondContact O-N 3.03Å |
| 273 | M | 91 | Very high | 90.8 | Very high | 40 Ų | 40 | 58.5 Ų | 58.5 | 20% | 0.197 | 31% | 0.312 | C | S | . | . | H | α-helix | trans | -64.5 | -40.2 | 177 | -75.6 | -72.9 | -67.6 | 0 | 0 | 112.5 | L245 T269 E270 E271 L276 G277 L307 P308 | L245-M273 HydrophobicContact CD1-SD 4.24Å; L245-M273 HydrophobicContact CD2-CG 4.35Å; L245-M273 HydrophobicContact CD2-SD 4.43Å; T269-M273 HydrophobicContact CG2-CG 4.19Å; T269-M273 VanDerWaalsContact O-CB 3.27Å; T269-M273 WeakPolarHBondContact O-CB 3.44Å; T269-M273 WeakPolarHBondContact O-CG 3.35Å; T269-M273 PolarHBondContact O-N 3.26Å; E270-M273 PolarHBondContact O-N 3.08Å; E271-M273 VanDerWaalsContact C-N 3.35Å; M273-L276 PolarHBondContact O-N 2.92Å; M273-G277 PolarHBondContact O-N 3.15Å; M273-L307 HydrophobicContact CE-CB 3.8Å; M273-L307 HydrophobicContact SD-CB 4.49Å; M273-P308 HydrophobicContact CE-CG 4.36Å |
| 274 | A | 91.8 | Very high | 90.4 | Very high | 67 Ų | 67 | 55.5 Ų | 55.5 | 55% | 0.554 | 31% | 0.305 | S | S | * | . | H | α-helix | trans | -64.9 | -44.7 | 174.8 | 0 | 0 | 0 | 0 | 0 | 111.8 | E270 E271 L276 G277 E278 | E270-A274 WeakPolarHBondContact O-CB 3.4Å; E270-A274 PolarHBondContact O-N 2.85Å; E271-A274 PolarHBondContact O-N 2.97Å; A274-L276 VanDerWaalsContact C-N 3.32Å; A274-L276 PolarHBondContact O-N 3.29Å; A274-G277 PolarHBondContact O-N 2.91Å; A274-E278 PolarHBondContact O-N 3.18Å |
| 275 | H | 91.9 | Very high | 89.6 | Confident | 61 Ų | 61 | 55.7 Ų | 55.7 | 28% | 0.282 | 31% | 0.307 | S | S | . | . | H | α-helix | trans | -63.8 | -36 | 174.3 | -75.5 | -54.8 | 0 | 0 | 0 | 112.8 | M249 E271 L272 C279 | M249-H275 HydrophobicContact CE-CB 3.66Å; E271-H275 WeakPolarHBondContact O-CB 3.09Å; E271-H275 PolarHBondContact O-CD2 2.88Å; E271-H275 PolarHBondContact O-N 2.83Å; L272-H275 PolarHBondContact O-N 2.92Å; H275-C279 WeakPolarHBondContact O-CB 3.4Å; H275-C279 PolarHBondContact O-N 2.96Å; H275-C279 PolarHBondContact O-SG 3.01Å |
| 276 | L | 92.2 | Very high | 88.5 | Confident | 0 Ų | 0 | 58.1 Ų | 58.1 | 0% | 0 | 31% | 0.31 | C | S | . | . | H | α-helix | trans | -66.7 | -46.2 | 175 | -176.3 | 55.8 | 0 | 0 | 0 | 111.6 | L245 I248 M249 L252 L272 M273 A274 E278 C279 V280 L307 L310 L338 | L245-L276 HydrophobicContact CD1-CD2 3.66Å; I248-L276 HydrophobicContact CG2-CD1 3.68Å; M249-L276 HydrophobicContact SD-CB 3.83Å; M249-L276 HydrophobicContact SD-CD1 4.3Å; L252-L276 HydrophobicContact CD1-CD1 3.81Å; L272-L276 WeakPolarHBondContact O-CB 3.28Å; L272-L276 PolarHBondContact O-N 3.03Å; M273-L276 PolarHBondContact O-N 2.92Å; A274-L276 VanDerWaalsContact C-N 3.32Å; A274-L276 PolarHBondContact O-N 3.29Å; L276-E278 PolarHBondContact O-N 3.05Å; L276-C279 CarbonylContact O-C 3.4Å; L276-C279 WeakPolarHBondContact O-CA 3.4Å; L276-C279 WeakPolarHBondContact O-CB 3.17Å; L276-C279 PolarHBondContact O-N 2.88Å; L276-C279 VanDerWaalsContact O-N 3.12Å; L276-V280 WeakPolarHBondContact O-CG2 3.42Å; L276-V280 PolarHBondContact O-N 2.7Å; L276-L307 HydrophobicContact CD2-CD2 3.89Å; L276-L307 HydrophobicContact CG-CD1 4.39Å; L276-L307 HydrophobicContact CG-CD2 4.09Å; L276-L310 HydrophobicContact CD2-CD1 3.64Å; L276-L338 HydrophobicContact CD1-CD1 3.69Å |
| 277 | G | 91.3 | Very high | 87.2 | Confident | 11 Ų | 11 | 60.7 Ų | 60.7 | 11% | 0.113 | 32% | 0.317 | C | S | . | . | H | α-helix | trans | -57.8 | -47.5 | 175.7 | 0 | 0 | 0 | 0 | 0 | 112.5 | M273 A274 C279 V280 L281 | M273-G277 PolarHBondContact O-N 3.15Å; A274-G277 PolarHBondContact O-N 2.91Å; G277-C279 VanDerWaalsContact C-N 3.31Å; G277-C279 PolarHBondContact O-N 3.08Å; G277-V280 PolarHBondContact O-N 2.74Å; G277-V280 VanDerWaalsContact O-N 3.11Å; G277-L281 WeakPolarHBondContact O-CG 3.12Å; G277-L281 PolarHBondContact O-N 3.2Å |
| 278 | E | 91.4 | Very high | 85.9 | Confident | 125 Ų | 125 | 69.4 Ų | 69.4 | 58% | 0.584 | 36% | 0.355 | S | S | * | . | H | α-helix | trans | -60.4 | -38.8 | 173.9 | -175.2 | 63.9 | -160.6 | 0 | 0 | 111.9 | A274 L276 V280 L281 S282 | A274-E278 PolarHBondContact O-N 3.18Å; L276-E278 PolarHBondContact O-N 3.05Å; E278-V280 VanDerWaalsContact C-N 3.31Å; E278-V280 PolarHBondContact O-N 2.88Å; E278-L281 PolarHBondContact O-N 3.39Å; E278-S282 WeakPolarHBondContact O-CB 3.26Å; E278-S282 PolarHBondContact O-N 2.83Å; E278-S282 PolarHBondContact O-OG 2.71Å |
| 279 | C | 90.6 | Very high | 85.1 | Confident | 11 Ų | 11 | 71.9 Ų | 71.9 | 7% | 0.074 | 37% | 0.371 | C | S | . | . | H | α-helix | trans | -67.8 | -25.5 | 175.2 | -73.1 | 0 | 0 | 0 | 0 | 113.8 | L252 H275 L276 G277 S282 V283 L338 | L252-C279 HydrophobicContact CD1-CB 3.92Å; H275-C279 WeakPolarHBondContact O-CB 3.4Å; H275-C279 PolarHBondContact O-N 2.96Å; H275-C279 PolarHBondContact O-SG 3.01Å; L276-C279 CarbonylContact O-C 3.4Å; L276-C279 WeakPolarHBondContact O-CA 3.4Å; L276-C279 WeakPolarHBondContact O-CB 3.17Å; L276-C279 PolarHBondContact O-N 2.88Å; L276-C279 VanDerWaalsContact O-N 3.12Å; G277-C279 VanDerWaalsContact C-N 3.31Å; G277-C279 PolarHBondContact O-N 3.08Å; C279-S282 PolarHBondContact O-OG 2.89Å; C279-V283 WeakPolarHBondContact O-CG2 3.3Å; C279-L338 HydrophobicContact CB-CD2 4.08Å; C279-L338 WeakPolarHBondContact O-CD2 3.2Å |
| 280 | V | 89.3 | Confident | 84 | Confident | 0 Ų | 0 | 77.5 Ų | 77.5 | 0% | 0 | 40% | 0.399 | C | S | . | . | H | α-helix | trans | -82.5 | -44.8 | 173.4 | 174.6 | 0 | 0 | 0 | 0 | 111 | L276 G277 E278 S282 V283 M300 A303 M304 L337 L338 | L276-V280 WeakPolarHBondContact O-CG2 3.42Å; L276-V280 PolarHBondContact O-N 2.7Å; G277-V280 PolarHBondContact O-N 2.74Å; G277-V280 VanDerWaalsContact O-N 3.11Å; E278-V280 VanDerWaalsContact C-N 3.31Å; E278-V280 PolarHBondContact O-N 2.88Å; V280-S282 VanDerWaalsContact C-N 3.26Å; V280-S282 PolarHBondContact O-N 3.07Å; V280-V283 WeakPolarHBondContact O-CB 3.44Å; V280-V283 WeakPolarHBondContact O-CG2 3.22Å; V280-V283 PolarHBondContact O-N 3.01Å; V280-V283 VanDerWaalsContact O-N 3.09Å; V280-M300 HydrophobicContact CG1-CG 4.35Å; V280-A303 HydrophobicContact CG1-CB 4.35Å; V280-M304 HydrophobicContact CB-CE 3.9Å; V280-M304 HydrophobicContact CG1-CE 3.84Å; V280-L337 HydrophobicContact CG1-CD1 4.23Å; V280-L338 HydrophobicContact CG2-CD2 3.94Å; V280-L338 HydrophobicContact CG2-CG 4.32Å |
| 281 | L | 88.3 | Confident | 83 | Confident | 103 Ų | 103 | 74 Ų | 74 | 54% | 0.539 | 40% | 0.396 | S | S | . | . | H | α-helix | trans | -63.7 | -29 | 177.6 | -69.5 | 174.6 | 0 | 0 | 0 | 113.2 | G277 E278 V283 M300 M304 | G277-L281 WeakPolarHBondContact O-CG 3.12Å; G277-L281 PolarHBondContact O-N 3.2Å; E278-L281 PolarHBondContact O-N 3.39Å; L281-V283 VanDerWaalsContact C-N 3.33Å; L281-M300 HydrophobicContact CD2-SD 3.99Å; L281-M304 HydrophobicContact CD1-CE 4.39Å; L281-M304 HydrophobicContact CD2-CE 3.79Å; L281-M304 HydrophobicContact CG-CE 3.65Å |
| 282 | S | 87.3 | Confident | 82 | Confident | 74 Ų | 74 | 73.9 Ų | 73.9 | 52% | 0.517 | 40% | 0.397 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -84.2 | -0.4 | 175.5 | 56.6 | 0 | 0 | 0 | 0 | 114.4 | E278 C279 V280 | E278-S282 WeakPolarHBondContact O-CB 3.26Å; E278-S282 PolarHBondContact O-N 2.83Å; E278-S282 PolarHBondContact O-OG 2.71Å; C279-S282 PolarHBondContact O-OG 2.89Å; V280-S282 VanDerWaalsContact C-N 3.26Å; V280-S282 PolarHBondContact O-N 3.07Å |
| 283 | V | 86.6 | Confident | 81.4 | Confident | 30 Ų | 30 | 76.6 Ų | 76.6 | 18% | 0.182 | 41% | 0.409 | C | S | . | . | trans | -68.1 | 132.2 | 167.4 | -176.3 | 0 | 0 | 0 | 0 | 108.8 | C279 V280 L281 F296 L337 L338 | C279-V283 WeakPolarHBondContact O-CG2 3.3Å; V280-V283 WeakPolarHBondContact O-CB 3.44Å; V280-V283 WeakPolarHBondContact O-CG2 3.22Å; V280-V283 PolarHBondContact O-N 3.01Å; V280-V283 VanDerWaalsContact O-N 3.09Å; L281-V283 VanDerWaalsContact C-N 3.33Å; V283-F296 HydrophobicContact CB-CE2 4.47Å; V283-F296 HydrophobicContact CB-CZ 4.06Å; V283-F296 HydrophobicContact CG1-CE2 3.76Å; V283-F296 HydrophobicContact CG1-CZ 3.76Å; V283-F296 WeakPolarHBondContact O-CZ 3.49Å; V283-L337 WeakPolarHBondContact CG1-O 3.15Å; V283-L337 WeakPolarHBondContact CG2-O 3.2Å; V283-L338 HydrophobicContact CG2-CD2 4.42Å | ||
| 284 | T | 78.9 | Confident | 80.9 | Confident | 113 Ų | 113 | 80.3 Ų | 80.3 | 69% | 0.693 | 43% | 0.429 | S | S | * | . | trans | -110.4 | 141.8 | 175.1 | 42 | 0 | 0 | 0 | 0 | 110.8 | ||||
| 285 | P | 76.4 | Confident | 80.6 | Confident | 32 Ų | 32 | 81.5 Ų | 81.5 | 21% | 0.208 | 43% | 0.426 | C | S | . | . | trans | -66.4 | 135.6 | 179.8 | 25.4 | -31.8 | 0 | 0 | 0 | 110.5 | E293 F296 | P285-E293 WeakPolarHBondContact CG-OE2 3.49Å; P285-F296 HydrophobicContact CB-CB 4.39Å; P285-F296 HydrophobicContact CB-CD1 3.92Å; P285-F296 HydrophobicContact CB-CD2 4.32Å; P285-F296 HydrophobicContact CB-CE1 4.31Å; P285-F296 HydrophobicContact CB-CG 3.94Å; P285-F296 HydrophobicContact CG-CD1 4.12Å; P285-F296 HydrophobicContact CG-CE1 4.3Å | ||
| 286 | R | 68.4 | Low | 80.3 | Confident | 205 Ų | 205 | 80 Ų | 80 | 77% | 0.774 | 42% | 0.419 | S | S | * | . | S | Bend | trans | -68.5 | -34.3 | -176.7 | -67.3 | -178.6 | 178.9 | 165.7 | 3.7 | 113 | N339 | R286-N339 PolarHBondContact NH2-OD1 3.42Š|
| 287 | E | 66.9 | Low | 80 | Confident | 118 Ų | 118 | 84.8 Ų | 84.8 | 55% | 0.551 | 44% | 0.441 | S | S | * | . | S | Bend | trans | -131.4 | 130.4 | -176.3 | -65.5 | -174 | -170.6 | 0 | 0 | 110.3 | T289 M292 | E287-T289 VanDerWaalsContact C-N 3.32Å; E287-T289 PolarHBondContact O-N 3.35Å; E287-M292 HydrophobicContact CB-SD 3.91Å |
| 288 | K | 65.7 | Low | 79.8 | Confident | 183 Ų | 183 | 89 Ų | 89 | 80% | 0.796 | 46% | 0.458 | S | S | * | . | trans | -95.1 | 51 | -170.1 | -63.1 | -175.3 | 178 | -177.1 | 0 | 112.4 | ||||
| 289 | T | 75.3 | Confident | 79.7 | Confident | 74 Ų | 74 | 84.6 Ų | 84.6 | 45% | 0.454 | 44% | 0.438 | S | S | . | . | trans | -98.5 | 127.7 | 178.4 | -48.8 | 0 | 0 | 0 | 0 | 109 | E287 A291 M292 E293 | E287-T289 VanDerWaalsContact C-N 3.32Å; E287-T289 PolarHBondContact O-N 3.35Å; T289-A291 PolarHBondContact O-N 3.08Å; T289-M292 HydrophobicContact CG2-SD 4.47Å; T289-M292 WeakPolarHBondContact O-CA 3.21Å; T289-M292 WeakPolarHBondContact O-CB 3.35Å; T289-M292 PolarHBondContact O-N 3.01Å; T289-E293 PolarHBondContact O-N 3.11Å | ||
| 290 | N | 67.2 | Low | 79.6 | Confident | 140 Ų | 140 | 85.9 Ų | 85.9 | 75% | 0.749 | 44% | 0.444 | S | S | * | . | H | α-helix | trans | -51 | -33.5 | -170.1 | -63.8 | -0.2 | 0 | 0 | 0 | 115.3 | L294 | N290-L294 PolarHBondContact O-N 3.33Å |
| 291 | A | 68.4 | Low | 79.6 | Confident | 74 Ų | 74 | 89.3 Ų | 89.3 | 61% | 0.612 | 47% | 0.468 | S | S | * | . | H | α-helix | trans | -76.5 | -33.9 | 176.4 | 0 | 0 | 0 | 0 | 0 | 113.5 | T289 N295 | T289-A291 PolarHBondContact O-N 3.08Å; A291-N295 PolarHBondContact O-N 3.45Å |
| 292 | M | 71.6 | Confident | 79.6 | Confident | 91 Ų | 91 | 87.1 Ų | 87.1 | 45% | 0.448 | 46% | 0.457 | S | S | . | . | H | α-helix | trans | -72.7 | -35.4 | 174.9 | -66.6 | 165.3 | 163.1 | 0 | 0 | 111.2 | E287 T289 N295 F296 | E287-M292 HydrophobicContact CB-SD 3.91Å; T289-M292 HydrophobicContact CG2-SD 4.47Å; T289-M292 WeakPolarHBondContact O-CA 3.21Å; T289-M292 WeakPolarHBondContact O-CB 3.35Å; T289-M292 PolarHBondContact O-N 3.01Å; M292-N295 PolarHBondContact O-N 2.81Å; M292-F296 WeakPolarHBondContact O-CB 3.38Å; M292-F296 PolarHBondContact O-N 2.94Å |
| 293 | E | 79.1 | Confident | 79.7 | Confident | 57 Ų | 57 | 83.6 Ų | 83.6 | 27% | 0.266 | 43% | 0.432 | S | S | . | . | H | α-helix | trans | -59.3 | -45.1 | 173.5 | -176.5 | 63.4 | -139.6 | 0 | 0 | 111.4 | P285 T289 F296 Q297 | P285-E293 WeakPolarHBondContact CG-OE2 3.49Å; T289-E293 PolarHBondContact O-N 3.11Å; E293-F296 PolarHBondContact O-N 3.17Å; E293-Q297 VanDerWaalsContact O-CG 3.31Å; E293-Q297 WeakPolarHBondContact O-CG 3.44Å; E293-Q297 PolarHBondContact O-N 3.15Å; E293-Q297 PolarHBondContact OE1-NE2 3.1Å |
| 294 | L | 81.4 | Confident | 79.8 | Confident | 118 Ų | 118 | 85.2 Ų | 85.2 | 62% | 0.618 | 44% | 0.439 | S | S | * | . | H | α-helix | trans | -64.6 | -39.7 | 175.5 | -71.5 | 172.7 | 0 | 0 | 0 | 112.7 | N290 Q297 Q298 | N290-L294 PolarHBondContact O-N 3.33Å; L294-Q297 PolarHBondContact O-N 2.91Å; L294-Q298 WeakPolarHBondContact O-CB 3.29Å; L294-Q298 PolarHBondContact O-N 2.82Å |
| 295 | N | 85.3 | Confident | 80.3 | Confident | 91 Ų | 91 | 83.3 Ų | 83.3 | 49% | 0.487 | 43% | 0.434 | S | S | . | . | H | α-helix | trans | -64.9 | -42.8 | 173 | 175.3 | -111.1 | 0 | 0 | 0 | 111.5 | A291 M292 Q297 Q298 N299 | A291-N295 PolarHBondContact O-N 3.45Å; M292-N295 PolarHBondContact O-N 2.81Å; N295-Q297 VanDerWaalsContact C-N 3.33Å; N295-Q297 PolarHBondContact O-N 2.85Å; N295-Q298 PolarHBondContact O-N 2.69Å; N295-N299 PolarHBondContact ND2-OD1 3.01Å; N295-N299 WeakPolarHBondContact O-CB 3.34Å; N295-N299 PolarHBondContact O-N 3.3Å; N295-N299 PolarHBondContact O-ND2 3.1Å; N295-N299 PolarHBondContact O-OD1 3.43Å; N295-N299 VanDerWaalsContact O-OD1 3.05Å; N295-N299 PolarHBondContact OD1-ND2 3.48Å |
| 296 | F | 84.9 | Confident | 80.8 | Confident | 30 Ų | 30 | 82.3 Ų | 82.3 | 13% | 0.132 | 43% | 0.427 | C | S | . | . | H | α-helix | trans | -61.1 | -40.8 | 177.3 | -178.5 | -102.6 | 0 | 0 | 0 | 112.4 | V283 P285 M292 E293 N299 M300 L337 | V283-F296 HydrophobicContact CB-CE2 4.47Å; V283-F296 HydrophobicContact CB-CZ 4.06Å; V283-F296 HydrophobicContact CG1-CE2 3.76Å; V283-F296 HydrophobicContact CG1-CZ 3.76Å; V283-F296 WeakPolarHBondContact O-CZ 3.49Å; P285-F296 HydrophobicContact CB-CB 4.39Å; P285-F296 HydrophobicContact CB-CD1 3.92Å; P285-F296 HydrophobicContact CB-CD2 4.32Å; P285-F296 HydrophobicContact CB-CE1 4.31Å; P285-F296 HydrophobicContact CB-CG 3.94Å; P285-F296 HydrophobicContact CG-CD1 4.12Å; P285-F296 HydrophobicContact CG-CE1 4.3Å; M292-F296 WeakPolarHBondContact O-CB 3.38Å; M292-F296 PolarHBondContact O-N 2.94Å; E293-F296 PolarHBondContact O-N 3.17Å; F296-N299 PolarHBondContact O-N 2.9Å; F296-M300 HydrophobicContact CE1-CE 3.68Å; F296-M300 HydrophobicContact CZ-CE 3.85Å; F296-M300 WeakPolarHBondContact O-CB 3.13Å; F296-M300 PolarHBondContact O-N 2.89Å; F296-L337 HydrophobicContact CD2-CD2 4.07Å; F296-L337 HydrophobicContact CE2-CD2 3.73Å |
| 297 | Q | 86.3 | Confident | 81.7 | Confident | 100 Ų | 100 | 72.9 Ų | 72.9 | 47% | 0.467 | 39% | 0.392 | S | S | . | . | H | α-helix | trans | -66.4 | -40.4 | 175.2 | -71 | 173.9 | 15.6 | 0 | 0 | 112.4 | E293 L294 N295 M300 S301 | E293-Q297 VanDerWaalsContact O-CG 3.31Å; E293-Q297 WeakPolarHBondContact O-CG 3.44Å; E293-Q297 PolarHBondContact O-N 3.15Å; E293-Q297 PolarHBondContact OE1-NE2 3.1Å; L294-Q297 PolarHBondContact O-N 2.91Å; N295-Q297 VanDerWaalsContact C-N 3.33Å; N295-Q297 PolarHBondContact O-N 2.85Å; Q297-M300 PolarHBondContact O-N 3.31Å; Q297-S301 PolarHBondContact O-N 3.34Å |
| 298 | Q | 87.6 | Confident | 82.6 | Confident | 99 Ų | 99 | 70.8 Ų | 70.8 | 46% | 0.463 | 39% | 0.389 | S | S | . | . | H | α-helix | trans | -61.4 | -49.6 | 172.2 | -175.8 | 60.5 | 50.1 | 0 | 0 | 110.9 | L294 N295 M300 S301 D302 | L294-Q298 WeakPolarHBondContact O-CB 3.29Å; L294-Q298 PolarHBondContact O-N 2.82Å; N295-Q298 PolarHBondContact O-N 2.69Å; Q298-M300 VanDerWaalsContact C-N 3.27Å; Q298-M300 PolarHBondContact O-N 2.92Å; Q298-S301 WeakPolarHBondContact O-CA 3.5Å; Q298-S301 WeakPolarHBondContact O-CB 3.38Å; Q298-S301 PolarHBondContact O-N 2.94Å; Q298-D302 WeakPolarHBondContact CG-OD2 3.43Å; Q298-D302 VanDerWaalsContact NE2-CG 3.25Å; Q298-D302 PolarHBondContact NE2-OD1 2.68Å; Q298-D302 PolarHBondContact NE2-OD2 2.83Å; Q298-D302 PolarHBondContact O-N 3.42Å |
| 299 | N | 87.9 | Confident | 83.6 | Confident | 33 Ų | 33 | 66.4 Ų | 66.4 | 18% | 0.176 | 37% | 0.37 | C | S | . | . | H | α-helix | trans | -58.4 | -39.7 | 179.2 | -60 | -9.7 | 0 | 0 | 0 | 111.6 | N295 F296 D302 A303 I333 L337 | N295-N299 PolarHBondContact ND2-OD1 3.01Å; N295-N299 WeakPolarHBondContact O-CB 3.34Å; N295-N299 PolarHBondContact O-N 3.3Å; N295-N299 PolarHBondContact O-ND2 3.1Å; N295-N299 PolarHBondContact O-OD1 3.43Å; N295-N299 VanDerWaalsContact O-OD1 3.05Å; N295-N299 PolarHBondContact OD1-ND2 3.48Å; F296-N299 PolarHBondContact O-N 2.9Å; N299-D302 PolarHBondContact O-N 2.85Å; N299-A303 VanDerWaalsContact O-CB 3.26Å; N299-A303 WeakPolarHBondContact O-CB 3.45Å; N299-A303 PolarHBondContact O-N 3.41Å; N299-I333 VanDerWaalsContact CA-CD1 3.5Å; N299-I333 HydrophobicContact CB-CD1 3.59Å; N299-I333 HydrophobicContact CB-CG1 4.15Å; N299-L337 HydrophobicContact CB-CD2 4.13Å |
| 300 | M | 88.1 | Confident | 84 | Confident | 38 Ų | 38 | 63 Ų | 63 | 19% | 0.187 | 35% | 0.348 | C | S | . | . | H | α-helix | trans | -65.8 | -39.2 | 175 | -177 | 179.4 | -73.2 | 0 | 0 | 112.5 | V280 L281 F296 Q297 Q298 M304 | V280-M300 HydrophobicContact CG1-CG 4.35Å; L281-M300 HydrophobicContact CD2-SD 3.99Å; F296-M300 HydrophobicContact CE1-CE 3.68Å; F296-M300 HydrophobicContact CZ-CE 3.85Å; F296-M300 WeakPolarHBondContact O-CB 3.13Å; F296-M300 PolarHBondContact O-N 2.89Å; Q297-M300 PolarHBondContact O-N 3.31Å; Q298-M300 VanDerWaalsContact C-N 3.27Å; Q298-M300 PolarHBondContact O-N 2.92Å; M300-M304 VanDerWaalsContact O-CG 3.28Å; M300-M304 WeakPolarHBondContact O-CG 3.3Å; M300-M304 PolarHBondContact O-N 3.2Å; M300-M304 VanDerWaalsContact O-N 3.11Å |
| 301 | S | 89.4 | Confident | 84.8 | Confident | 72 Ų | 72 | 58.1 Ų | 58.1 | 50% | 0.503 | 33% | 0.326 | S | S | . | . | H | α-helix | trans | -63.9 | -45.9 | 174.4 | -176.5 | 0 | 0 | 0 | 0 | 111.6 | Q297 Q298 M304 A305 | Q297-S301 PolarHBondContact O-N 3.34Å; Q298-S301 WeakPolarHBondContact O-CA 3.5Å; Q298-S301 WeakPolarHBondContact O-CB 3.38Å; Q298-S301 PolarHBondContact O-N 2.94Å; S301-M304 PolarHBondContact O-N 3.29Å; S301-A305 PolarHBondContact O-N 3.04Å; S301-A305 VanDerWaalsContact O-N 3.09Å |
| 302 | D | 89.1 | Confident | 85.5 | Confident | 57 Ų | 57 | 60.4 Ų | 60.4 | 31% | 0.305 | 33% | 0.332 | S | S | . | . | H | α-helix | trans | -67.1 | -40.5 | -179.6 | -63.4 | -26.9 | 0 | 0 | 0 | 111 | Q298 N299 M304 A305 V306 I333 | Q298-D302 WeakPolarHBondContact CG-OD2 3.43Å; Q298-D302 VanDerWaalsContact NE2-CG 3.25Å; Q298-D302 PolarHBondContact NE2-OD1 2.68Å; Q298-D302 PolarHBondContact NE2-OD2 2.83Å; Q298-D302 PolarHBondContact O-N 3.42Å; N299-D302 PolarHBondContact O-N 2.85Å; D302-M304 PolarHBondContact O-N 2.78Å; D302-A305 WeakPolarHBondContact O-CB 3.2Å; D302-A305 PolarHBondContact O-N 2.82Å; D302-A305 VanDerWaalsContact O-N 3.15Å; D302-V306 PolarHBondContact O-N 2.87Å; D302-V306 VanDerWaalsContact O-N 3.07Å; D302-I333 HydrophobicContact CB-CD1 4.15Å |
| 303 | A | 88.8 | Confident | 85.9 | Confident | 0 Ų | 0 | 57.8 Ų | 57.8 | 0% | 0 | 33% | 0.328 | C | S | . | . | H | α-helix | trans | -55.6 | -48.4 | 172 | 0 | 0 | 0 | 0 | 0 | 112.1 | V280 N299 A305 V306 L307 I333 V334 L337 | V280-A303 HydrophobicContact CG1-CB 4.35Å; N299-A303 VanDerWaalsContact O-CB 3.26Å; N299-A303 WeakPolarHBondContact O-CB 3.45Å; N299-A303 PolarHBondContact O-N 3.41Å; A303-A305 VanDerWaalsContact C-N 3.27Å; A303-A305 PolarHBondContact O-N 3.41Å; A303-V306 VanDerWaalsContact O-CG2 3.31Å; A303-V306 WeakPolarHBondContact O-CG2 3.35Å; A303-V306 PolarHBondContact O-N 3.17Å; A303-V306 VanDerWaalsContact O-N 3.15Å; A303-L307 VanDerWaalsContact O-CG 3.29Å; A303-L307 WeakPolarHBondContact O-CG 3.3Å; A303-L307 PolarHBondContact O-N 3.31Å; A303-I333 HydrophobicContact CB-CG2 3.82Å; A303-V334 HydrophobicContact CB-CG2 4.36Å; A303-L337 HydrophobicContact CB-CD1 3.49Å; A303-L337 VanDerWaalsContact CB-CD1 3.49Å |
| 304 | M | 88.5 | Confident | 86.1 | Confident | 65 Ų | 65 | 55.9 Ų | 55.9 | 32% | 0.32 | 32% | 0.32 | S | S | . | . | H | α-helix | trans | -63.1 | -32.1 | 178.3 | -72.1 | -67.7 | 170.9 | 0 | 0 | 112.8 | V280 L281 M300 S301 D302 L307 | V280-M304 HydrophobicContact CB-CE 3.9Å; V280-M304 HydrophobicContact CG1-CE 3.84Å; L281-M304 HydrophobicContact CD1-CE 4.39Å; L281-M304 HydrophobicContact CD2-CE 3.79Å; L281-M304 HydrophobicContact CG-CE 3.65Å; M300-M304 VanDerWaalsContact O-CG 3.28Å; M300-M304 WeakPolarHBondContact O-CG 3.3Å; M300-M304 PolarHBondContact O-N 3.2Å; M300-M304 VanDerWaalsContact O-N 3.11Å; S301-M304 PolarHBondContact O-N 3.29Å; D302-M304 PolarHBondContact O-N 2.78Å; M304-L307 HydrophobicContact SD-CD1 3.82Å |
| 305 | A | 89.4 | Confident | 86.3 | Confident | 73 Ų | 73 | 56 Ų | 56 | 60% | 0.603 | 32% | 0.321 | S | S | * | . | H | α-helix | trans | -71.6 | -31.2 | 174.7 | 0 | 0 | 0 | 0 | 0 | 113.1 | S301 D302 A303 | S301-A305 PolarHBondContact O-N 3.04Å; S301-A305 VanDerWaalsContact O-N 3.09Å; D302-A305 WeakPolarHBondContact O-CB 3.2Å; D302-A305 PolarHBondContact O-N 2.82Å; D302-A305 VanDerWaalsContact O-N 3.15Å; A303-A305 VanDerWaalsContact C-N 3.27Å; A303-A305 PolarHBondContact O-N 3.41Å |
| 306 | V | 88.6 | Confident | 86.6 | Confident | 10 Ų | 10 | 53 Ų | 53 | 6% | 0.061 | 31% | 0.306 | C | S | . | . | H | α-helix | trans | -92.2 | -17 | 178.8 | -58.6 | 0 | 0 | 0 | 0 | 114.8 | D302 A303 P308 K309 P330 I333 V334 | D302-V306 PolarHBondContact O-N 2.87Å; D302-V306 VanDerWaalsContact O-N 3.07Å; A303-V306 VanDerWaalsContact O-CG2 3.31Å; A303-V306 WeakPolarHBondContact O-CG2 3.35Å; A303-V306 PolarHBondContact O-N 3.17Å; A303-V306 VanDerWaalsContact O-N 3.15Å; V306-P308 VanDerWaalsContact C-N 3.29Å; V306-P308 VanDerWaalsContact O-N 3.14Å; V306-K309 WeakPolarHBondContact O-CB 3.43Å; V306-K309 PolarHBondContact O-N 3.48Å; V306-P330 HydrophobicContact CG1-CB 3.96Å; V306-I333 HydrophobicContact CG2-CG2 4.35Å; V306-V334 HydrophobicContact CG2-CG2 3.71Å |
| 307 | L | 86.5 | Confident | 87 | Confident | 8 Ų | 8 | 52.1 Ų | 52.1 | 4% | 0.042 | 30% | 0.303 | C | S | . | . | G | 310 helix | trans | -47.7 | -44.3 | 178.9 | -65.8 | -167.6 | 0 | 0 | 0 | 113.4 | M273 L276 A303 M304 K309 L310 V334 | M273-L307 HydrophobicContact CE-CB 3.8Å; M273-L307 HydrophobicContact SD-CB 4.49Å; L276-L307 HydrophobicContact CD2-CD2 3.89Å; L276-L307 HydrophobicContact CG-CD1 4.39Å; L276-L307 HydrophobicContact CG-CD2 4.09Å; A303-L307 VanDerWaalsContact O-CG 3.29Å; A303-L307 WeakPolarHBondContact O-CG 3.3Å; A303-L307 PolarHBondContact O-N 3.31Å; M304-L307 HydrophobicContact SD-CD1 3.82Å; L307-K309 PolarHBondContact O-N 2.85Å; L307-K309 VanDerWaalsContact O-N 3.16Å; L307-L310 HydrophobicContact CD2-CD1 3.86Å; L307-L310 WeakPolarHBondContact O-CB 3.07Å; L307-L310 PolarHBondContact O-N 3.23Å; L307-L310 VanDerWaalsContact O-N 3.08Å; L307-V334 HydrophobicContact CD2-CG1 4.04Å; L307-V334 HydrophobicContact CD2-CG2 3.9Å |
| 308 | P | 86.4 | Confident | 87.5 | Confident | 73 Ų | 73 | 47.6 Ų | 47.6 | 47% | 0.474 | 28% | 0.282 | S | S | . | . | G | 310 helix | trans | -64.9 | -17.9 | -178.9 | -22.8 | 35.7 | 0 | 0 | 0 | 114.6 | M273 V306 S311 | M273-P308 HydrophobicContact CE-CG 4.36Å; V306-P308 VanDerWaalsContact C-N 3.29Å; V306-P308 VanDerWaalsContact O-N 3.14Å; P308-S311 PolarHBondContact O-OG 3.08Å |
| 309 | K | 86.1 | Confident | 87.9 | Confident | 92 Ų | 92 | 45.5 Ų | 45.5 | 40% | 0.4 | 27% | 0.27 | S | S | . | . | G | 310 helix | trans | -73.6 | -31.1 | 174.4 | -61.8 | -177.2 | 176.2 | -171.8 | 0 | 111.9 | V306 L307 S311 T312 G313 E331 | V306-K309 WeakPolarHBondContact O-CB 3.43Å; V306-K309 PolarHBondContact O-N 3.48Å; L307-K309 PolarHBondContact O-N 2.85Å; L307-K309 VanDerWaalsContact O-N 3.16Å; K309-S311 PolarHBondContact O-N 3.18Å; K309-T312 PolarHBondContact O-N 3.42Å; K309-T312 PolarHBondContact O-OG1 3.32Å; K309-G313 CarbonylContact C-O 3.6Å; K309-G313 CarbonylContact O-C 3.59Å; K309-G313 PolarHBondContact O-N 3.37Å; K309-E331 HydrophobicContact CD-CG 4.26Å; K309-E331 WeakPolarHBondContact CD-OE1 3.49Å; K309-E331 WeakPolarHBondContact CE-OE1 3.35Å; K309-E331 IonicContact NZ-OE1 2.66Å; K309-E331 PolarHBondContact NZ-OE1 3.24Å |
| 310 | L | 84.3 | Confident | 88.4 | Confident | 1 Ų | 1 | 44 Ų | 44 | 1% | 0.005 | 26% | 0.262 | C | S | . | . | T | Hydrogen-bonded Turn | trans | -58.1 | -24.5 | -178.9 | -65.2 | 166.6 | 0 | 0 | 0 | 113.2 | P242 P244 L245 I248 L276 L307 L314 V334 | P242-L310 WeakPolarHBondContact CB-O 3.37Å; P244-L310 HydrophobicContact CB-CD2 3.98Å; L245-L310 HydrophobicContact CB-CB 4.12Å; L245-L310 WeakPolarHBondContact CB-O 3.33Å; L245-L310 PolarHBondContact N-O 3.45Å; I248-L310 HydrophobicContact CD1-CD1 4.12Å; I248-L310 HydrophobicContact CD1-CD2 3.84Å; L276-L310 HydrophobicContact CD2-CD1 3.64Å; L307-L310 HydrophobicContact CD2-CD1 3.86Å; L307-L310 WeakPolarHBondContact O-CB 3.07Å; L307-L310 PolarHBondContact O-N 3.23Å; L307-L310 VanDerWaalsContact O-N 3.08Å; L310-L314 HydrophobicContact CD2-CD1 3.66Å; L310-L314 HydrophobicContact CD2-CD2 4.19Å; L310-L314 HydrophobicContact CD2-CG 4.47Å; L310-V334 HydrophobicContact CD1-CG1 4.22Å; L310-V334 HydrophobicContact CD1-CG2 4.43Å |
| 311 | S | 83.3 | Confident | 88.8 | Confident | 39 Ų | 39 | 45 Ų | 45 | 27% | 0.273 | 27% | 0.27 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -88.6 | -6.1 | 175 | 61.3 | 0 | 0 | 0 | 0 | 114.9 | P308 K309 | P308-S311 PolarHBondContact O-OG 3.08Å; K309-S311 PolarHBondContact O-N 3.18Å |
| 312 | T | 82.3 | Confident | 89.2 | Confident | 122 Ų | 122 | 41.9 Ų | 41.9 | 75% | 0.748 | 25% | 0.249 | S | C | * | . | T | Hydrogen-bonded Turn | trans | -115.3 | -27.3 | 178.1 | 54.4 | 0 | 0 | 0 | 0 | 114.1 | K309 | K309-T312 PolarHBondContact O-N 3.42Å; K309-T312 PolarHBondContact O-OG1 3.32Å |
| 313 | G | 79.9 | Confident | 89.6 | Confident | 35 Ų | 35 | 39.1 Ų | 39.1 | 36% | 0.361 | 23% | 0.234 | S | C | . | . | trans | 151.9 | 154.3 | -176.8 | 0 | 0 | 0 | 0 | 0 | 111.4 | K309 | K309-G313 CarbonylContact C-O 3.6Å; K309-G313 CarbonylContact O-C 3.59Å; K309-G313 PolarHBondContact O-N 3.37Å | ||
| 314 | L | 85 | Confident | 89.9 | Confident | 17 Ų | 17 | 42.8 Ų | 42.8 | 9% | 0.089 | 26% | 0.257 | C | S | . | . | trans | -127.2 | 113.2 | -179.5 | -159.3 | 72.7 | 0 | 0 | 0 | 111.6 | P244 L310 V316 E331 F335 F426 | P244-L314 HydrophobicContact CB-CB 3.82Å; P244-L314 HydrophobicContact CB-CD2 4.18Å; P244-L314 HydrophobicContact CG-CB 3.6Å; L310-L314 HydrophobicContact CD2-CD1 3.66Å; L310-L314 HydrophobicContact CD2-CD2 4.19Å; L310-L314 HydrophobicContact CD2-CG 4.47Å; L314-V316 HydrophobicContact CD2-CG1 4.23Å; L314-V316 HydrophobicContact CG-CG1 4.44Å; L314-V316 PolarHBondContact O-N 3.42Å; L314-E331 HydrophobicContact CD1-CB 3.52Å; L314-E331 HydrophobicContact CD1-CG 3.62Å; L314-E331 HydrophobicContact CG-CB 4.12Å; L314-E331 HydrophobicContact CG-CG 4.46Å; L314-F335 HydrophobicContact CD2-CE2 3.66Å; L314-F335 HydrophobicContact CD2-CZ 3.97Å; L314-F426 HydrophobicContact CB-CE2 3.95Å; L314-F426 HydrophobicContact CB-CZ 3.92Å; L314-F426 HydrophobicContact CD2-CE1 4.02Å; L314-F426 HydrophobicContact CD2-CZ 3.88Å; L314-F426 HydrophobicContact CG-CZ 4.35Å | ||
| 315 | D | 84.3 | Confident | 90.3 | Very high | 122 Ų | 122 | 42.2 Ų | 42.2 | 65% | 0.652 | 26% | 0.255 | S | S | * | . | trans | -75.9 | 113.5 | 176.5 | -60.8 | -47.5 | 0 | 0 | 0 | 110.1 | T329 | D315-T329 PolarHBondContact O-OG1 3.03Š| ||
| 316 | V | 91 | Very high | 90.6 | Very high | 28 Ų | 28 | 40.4 Ų | 40.4 | 17% | 0.17 | 23% | 0.234 | C | C | . | . | trans | -126.5 | 138.2 | 174 | -67.2 | 0 | 0 | 0 | 0 | 109.9 | L314 F326 F421 F426 | L314-V316 HydrophobicContact CD2-CG1 4.23Å; L314-V316 HydrophobicContact CG-CG1 4.44Å; L314-V316 PolarHBondContact O-N 3.42Å; V316-F326 HydrophobicContact CB-CD1 4.11Å; V316-F326 HydrophobicContact CB-CE1 4.23Å; V316-F326 HydrophobicContact CG2-CE1 4.47Å; V316-F421 HydrophobicContact CG2-CD1 4.1Å; V316-F421 HydrophobicContact CG2-CD2 3.75Å; V316-F421 HydrophobicContact CG2-CE1 3.92Å; V316-F421 HydrophobicContact CG2-CE2 3.54Å; V316-F421 HydrophobicContact CG2-CG 4.01Å; V316-F421 HydrophobicContact CG2-CZ 3.64Å; V316-F426 HydrophobicContact CB-CZ 4.44Å; V316-F426 HydrophobicContact CG1-CE1 4.12Å; V316-F426 HydrophobicContact CG1-CZ 3.8Å; V316-F426 HydrophobicContact CG2-CE1 4.36Å; V316-F426 HydrophobicContact CG2-CZ 3.72Å | ||
| 317 | N | 94.5 | Very high | 90.8 | Very high | 11 Ų | 11 | 43.2 Ų | 43.2 | 6% | 0.059 | 25% | 0.246 | C | C | . | . | trans | -123 | 102.1 | -179.7 | -173.6 | 22.9 | 0 | 0 | 0 | 108.9 | E327 S363 Y364 N365 | N317-E327 HydrophobicContact CB-CB 4.17Å; N317-E327 PolarHBondContact ND2-OE2 3.35Å; N317-E327 PolarHBondContact O-N 3.39Å; N317-S363 VanDerWaalsContact ND2-CB 3.27Å; N317-S363 WeakPolarHBondContact ND2-CB 3.39Å; N317-S363 PolarHBondContact ND2-OG 3.09Å; N317-Y364 WeakPolarHBondContact OD1-CB 3.4Å; N317-Y364 PolarHBondContact OD1-N 3.07Å; N317-Y364 VanDerWaalsContact OD1-N 3.12Å; N317-N365 PolarHBondContact ND2-ND2 2.99Å; N317-N365 PolarHBondContact OD1-N 3.41Å | ||
| 318 | V | 96.4 | Very high | 90.8 | Very high | 4 Ų | 4 | 49.4 Ų | 49.4 | 2% | 0.024 | 27% | 0.27 | C | S | . | . | B | Isolated β-bridge | trans | -72.6 | 155.6 | -177.8 | -64.7 | 0 | 0 | 0 | 0 | 112 | F320 F326 H344 W346 S363 Y364 F421 | V318-F320 HydrophobicContact CG2-CE1 4.22Å; V318-F326 HydrophobicContact CG1-CD1 3.93Å; V318-F326 HydrophobicContact CG1-CE1 3.61Å; V318-F326 HydrophobicContact CG1-CZ 4.39Å; V318-H344 HydrophobicContact CG1-CB 4.05Å; V318-W346 HydrophobicContact CG2-CE3 3.82Å; V318-W346 HydrophobicContact CG2-CZ3 4.41Å; V318-S363 CarbonylContact O-C 3.55Å; V318-S363 WeakPolarHBondContact O-CA 3.43Å; V318-S363 WeakPolarHBondContact O-CB 3.49Å; V318-Y364 PolarHBondContact O-N 3.29Å; V318-F421 HydrophobicContact CG1-CD1 4.19Å; V318-F421 HydrophobicContact CG1-CE1 4.39Å |
| 319 | R | 97.3 | Very high | 90.8 | Very high | 56 Ų | 56 | 47.3 Ų | 47.3 | 21% | 0.211 | 26% | 0.255 | C | S | . | . | B | Isolated β-bridge | trans | -114.4 | 139.5 | 162.7 | -56.9 | -176.8 | 178.6 | -69.9 | -19.8 | 108.6 | T321 D325 E327 H344 K361 | R319-T321 PolarHBondContact O-N 3.24Å; R319-D325 WeakPolarHBondContact CA-O 3.48Å; R319-D325 HydrophobicContact CB-CB 3.99Å; R319-D325 VanDerWaalsContact CB-O 3.26Å; R319-D325 WeakPolarHBondContact CB-O 3.29Å; R319-D325 WeakPolarHBondContact CG-O 3.39Å; R319-D325 PolarHBondContact N-O 2.91Å; R319-E327 IonicContact NH2-OE2 2.62Å; R319-E327 PolarHBondContact NH2-OE2 2.88Å; R319-H344 PolarHBondContact O-CE1 2.76Å; R319-K361 PolarHBondContact NH1-O 2.88Å |
| 320 | F | 97.7 | Very high | 90.7 | Very high | 1 Ų | 1 | 46.3 Ų | 46.3 | 0% | 0.004 | 26% | 0.258 | C | S | . | . | T | Hydrogen-bonded Turn | trans | -79.8 | 16.5 | -171.2 | -47.1 | -81.3 | 0 | 0 | 0 | 114.1 | V318 W346 L347 V348 V359 Y364 L367 F392 L393 | V318-F320 HydrophobicContact CG2-CE1 4.22Å; F320-W346 HydrophobicContact CD1-CD2 4.33Å; F320-W346 HydrophobicContact CD1-CG 4.11Å; F320-W346 AromaticContact CE1-CD2 3.76Å; F320-W346 HydrophobicContact CE1-CD2 3.76Å; F320-W346 AromaticContact CE1-CE2 3.78Å; F320-W346 HydrophobicContact CE1-CE3 4.2Å; F320-W346 HydrophobicContact CE1-CG 4.03Å; F320-W346 HydrophobicContact CE1-CZ2 4.3Å; F320-W346 AromaticContact CE1-NE1 3.95Å; F320-L347 WeakPolarHBondContact O-CA 3.33Å; F320-V348 HydrophobicContact CB-CB 4.48Å; F320-V348 PolarHBondContact O-N 2.74Å; F320-V359 HydrophobicContact CB-CG1 3.8Å; F320-V359 HydrophobicContact CD2-CG1 3.37Å; F320-V359 HydrophobicContact CE2-CG1 4.24Å; F320-V359 HydrophobicContact CG-CG1 3.84Å; F320-Y364 HydrophobicContact CZ-CD2 4.21Å; F320-L367 HydrophobicContact CD2-CD2 4.19Å; F320-L367 HydrophobicContact CE2-CB 4.09Å; F320-L367 HydrophobicContact CE2-CD2 3.53Å; F320-L367 HydrophobicContact CE2-CG 4.43Å; F320-L367 HydrophobicContact CZ-CD2 3.92Å; F320-F392 HydrophobicContact CB-CE1 4.44Å; F320-F392 HydrophobicContact CB-CZ 4.27Å; F320-F392 AromaticContact CD1-CE1 3.55Å; F320-F392 HydrophobicContact CD1-CE1 3.55Å; F320-F392 AromaticContact CD1-CZ 3.67Å; F320-F392 HydrophobicContact CD1-CZ 3.67Å; F320-F392 HydrophobicContact CD2-CE1 4.35Å; F320-F392 AromaticContact CE1-CE1 3.78Å; F320-F392 HydrophobicContact CE1-CE1 3.78Å; F320-F392 HydrophobicContact CE1-CZ 4.25Å; F320-F392 AromaticContact CG-CE1 3.84Å; F320-F392 HydrophobicContact CG-CE1 3.84Å; F320-F392 HydrophobicContact CG-CZ 4.05Å; F320-F392 HydrophobicContact CZ-CE1 4.27Å; F320-L393 HydrophobicContact CE1-CD2 4.25Å; F320-L393 HydrophobicContact CZ-CD2 4.02Å |
| 321 | T | 96.4 | Very high | 90.6 | Very high | 59 Ų | 59 | 46.9 Ų | 46.9 | 36% | 0.362 | 26% | 0.261 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -98.2 | -19 | -166.4 | 44.3 | 0 | 0 | 0 | 0 | 115.7 | R319 D325 K361 | R319-T321 PolarHBondContact O-N 3.24Å; T321-D325 WeakPolarHBondContact CB-OD2 3.45Å; T321-D325 PolarHBondContact OG1-OD2 2.75Å; T321-K361 HydrophobicContact CG2-CB 4.4Å; T321-K361 HydrophobicContact CG2-CG 4.23Å |
| 322 | G | 96.9 | Very high | 90.8 | Very high | 6 Ų | 6 | 45.6 Ų | 45.6 | 6% | 0.062 | 25% | 0.252 | C | S | . | . | S | Bend | trans | -176.2 | 151.9 | -176.7 | 0 | 0 | 0 | 0 | 0 | 110.7 | T324 D325 H344 E407 | G322-T324 PolarHBondContact O-N 2.77Å; G322-D325 PolarHBondContact N-OD2 2.96Å; G322-D325 WeakPolarHBondContact O-CB 3.39Å; G322-D325 PolarHBondContact O-N 2.81Å; G322-H344 PolarHBondContact O-CE1 3.26Å; G322-H344 PolarHBondContact O-NE2 2.9Å; G322-H344 VanDerWaalsContact O-NE2 3.08Å; G322-E407 VanDerWaalsContact CA-OE1 3.32Å; G322-E407 WeakPolarHBondContact CA-OE1 3.49Å |
| 323 | V | 97.4 | Very high | 91.1 | Very high | 0 Ų | 0 | 40 Ų | 40 | 0% | 0 | 22% | 0.217 | C | C | . | . | T | Hydrogen-bonded Turn | trans | -66.7 | -7.2 | -170.7 | -65.3 | 0 | 0 | 0 | 0 | 115.9 | Y343 H344 L347 E407 L408 T411 | V323-Y343 HydrophobicContact CB-CD1 4.47Å; V323-Y343 HydrophobicContact CG2-CD1 4.14Å; V323-Y343 HydrophobicContact CG2-CE1 4.41Å; V323-Y343 CarbonylContact O-C 3.56Å; V323-Y343 VanDerWaalsContact O-CA 3.28Å; V323-Y343 WeakPolarHBondContact O-CA 3.32Å; V323-H344 WeakPolarHBondContact CA-O 3.37Å; V323-H344 VanDerWaalsContact CB-O 3.31Å; V323-H344 WeakPolarHBondContact CB-O 3.38Å; V323-H344 WeakPolarHBondContact CG1-O 3.47Å; V323-H344 PolarHBondContact O-CD2 2.64Å; V323-H344 PolarHBondContact O-N 3.45Å; V323-L347 HydrophobicContact CB-CD1 4.47Å; V323-L347 HydrophobicContact CG1-CD1 3.7Å; V323-L347 HydrophobicContact CG1-CD2 4.08Å; V323-E407 HydrophobicContact CG1-CB 3.92Å; V323-E407 HydrophobicContact CG1-CG 4.03Å; V323-E407 HydrophobicContact CG2-CG 4.37Å; V323-E407 PolarHBondContact N-OE1 2.88Å; V323-L408 HydrophobicContact CB-CD1 4.15Å; V323-L408 HydrophobicContact CG1-CB 3.99Å; V323-L408 HydrophobicContact CG1-CD1 4.43Å; V323-L408 HydrophobicContact CG2-CD1 4.38Å; V323-T411 HydrophobicContact CG2-CG2 3.8Å |
| 324 | T | 96.6 | Very high | 91.7 | Very high | 76 Ų | 76 | 38.3 Ų | 38.3 | 47% | 0.466 | 20% | 0.2 | S | C | . | . | T | Hydrogen-bonded Turn | trans | -108.6 | -0.1 | 177.4 | 46.1 | 0 | 0 | 0 | 0 | 113.5 | G322 F326 Y343 | G322-T324 PolarHBondContact O-N 2.77Å; T324-F326 WeakPolarHBondContact O-CD2 3.3Å; T324-F326 PolarHBondContact O-N 2.9Å; T324-Y343 HydrophobicContact CG2-CD1 3.75Å; T324-Y343 HydrophobicContact CG2-CE1 3.57Å |
| 325 | D | 96.3 | Very high | 92 | Very high | 54 Ų | 54 | 37.7 Ų | 37.7 | 29% | 0.289 | 20% | 0.197 | S | C | . | . | trans | -90.3 | 74.2 | -158.3 | -67 | 7.9 | 0 | 0 | 0 | 111.8 | R319 T321 G322 H344 | R319-D325 WeakPolarHBondContact CA-O 3.48Å; R319-D325 HydrophobicContact CB-CB 3.99Å; R319-D325 VanDerWaalsContact CB-O 3.26Å; R319-D325 WeakPolarHBondContact CB-O 3.29Å; R319-D325 WeakPolarHBondContact CG-O 3.39Å; R319-D325 PolarHBondContact N-O 2.91Å; T321-D325 WeakPolarHBondContact CB-OD2 3.45Å; T321-D325 PolarHBondContact OG1-OD2 2.75Å; G322-D325 PolarHBondContact N-OD2 2.96Å; G322-D325 WeakPolarHBondContact O-CB 3.39Å; G322-D325 PolarHBondContact O-N 2.81Å; D325-H344 PolarHBondContact N-NE2 3Å | ||
| 326 | F | 95.3 | Very high | 92.3 | Very high | 35 Ų | 35 | 37 Ų | 37 | 15% | 0.154 | 19% | 0.193 | C | C | . | . | B | Isolated β-bridge | trans | -86.8 | 151.2 | 170.6 | -62.7 | -91.5 | 0 | 0 | 0 | 111.6 | V316 V318 T324 L342 H344 F421 | V316-F326 HydrophobicContact CB-CD1 4.11Å; V316-F326 HydrophobicContact CB-CE1 4.23Å; V316-F326 HydrophobicContact CG2-CE1 4.47Å; V318-F326 HydrophobicContact CG1-CD1 3.93Å; V318-F326 HydrophobicContact CG1-CE1 3.61Å; V318-F326 HydrophobicContact CG1-CZ 4.39Å; T324-F326 WeakPolarHBondContact O-CD2 3.3Å; T324-F326 PolarHBondContact O-N 2.9Å; F326-L342 HydrophobicContact CD1-CD2 4.33Å; F326-L342 HydrophobicContact CD2-CD2 4.07Å; F326-L342 HydrophobicContact CD2-CG 4.27Å; F326-L342 HydrophobicContact CE1-CD2 4.07Å; F326-L342 HydrophobicContact CE1-CG 4.37Å; F326-L342 HydrophobicContact CE2-CB 4.23Å; F326-L342 HydrophobicContact CE2-CD2 3.82Å; F326-L342 HydrophobicContact CE2-CG 3.59Å; F326-L342 HydrophobicContact CG-CD2 4.33Å; F326-L342 HydrophobicContact CZ-CD1 4.43Å; F326-L342 HydrophobicContact CZ-CD2 3.81Å; F326-L342 HydrophobicContact CZ-CG 3.65Å; F326-H344 AromaticContact CE2-CD2 3.59Å; F326-H344 HydrophobicContact CZ-CB 4.02Å; F326-H344 AromaticContact CZ-CD2 3.5Å; F326-F421 HydrophobicContact CZ-CB 4.42Å |
| 327 | E | 93.3 | Very high | 92.3 | Very high | 68 Ų | 68 | 36.5 Ų | 36.5 | 32% | 0.318 | 19% | 0.189 | S | C | . | . | trans | -71.1 | 131.9 | 157.7 | -169.2 | 162.9 | 175.9 | 0 | 0 | 109.5 | N317 R319 T329 S363 | N317-E327 HydrophobicContact CB-CB 4.17Å; N317-E327 PolarHBondContact ND2-OE2 3.35Å; N317-E327 PolarHBondContact O-N 3.39Å; R319-E327 IonicContact NH2-OE2 2.62Å; R319-E327 PolarHBondContact NH2-OE2 2.88Å; E327-T329 PolarHBondContact O-N 3.15Å; E327-S363 WeakPolarHBondContact OE2-CB 3.47Å; E327-S363 PolarHBondContact OE2-OG 2.84Å | ||
| 328 | Y | 86.6 | Confident | 92.2 | Very high | 139 Ų | 139 | 36 Ų | 36 | 55% | 0.545 | 19% | 0.187 | S | C | . | . | trans | -72.5 | 100 | -173.7 | -175.9 | -91.8 | 0 | 0 | 0 | 111.2 | I333 | Y328-I333 VanDerWaalsContact OH-CD1 3.26Å; Y328-I333 WeakPolarHBondContact OH-CD1 3.5Å; Y328-I333 WeakPolarHBondContact OH-CG1 3.41Å | ||
| 329 | T | 85.4 | Confident | 92 | Very high | 28 Ų | 28 | 39.1 Ų | 39.1 | 17% | 0.172 | 20% | 0.203 | C | C | . | . | trans | -90.7 | 148.6 | 166.9 | 55.1 | 0 | 0 | 0 | 0 | 109.8 | D315 E327 E331 C332 | D315-T329 PolarHBondContact O-OG1 3.03Å; E327-T329 PolarHBondContact O-N 3.15Å; T329-E331 WeakPolarHBondContact CB-OE2 3.44Å; T329-E331 PolarHBondContact O-N 2.84Å; T329-E331 VanDerWaalsContact O-N 3.09Å; T329-C332 WeakPolarHBondContact O-CB 3.46Å; T329-C332 PolarHBondContact O-N 2.84Å; T329-C332 PolarHBondContact OG1-SG 3.28Å; T329-C332 VanDerWaalsContact OG1-SG 3.37Å | ||
| 330 | P | 84 | Confident | 92 | Very high | 71 Ų | 71 | 36.7 Ų | 36.7 | 46% | 0.461 | 19% | 0.194 | S | C | . | . | G | 310 helix | trans | -50.7 | -32.4 | 172.7 | -28.8 | 35.8 | 0 | 0 | 0 | 113.2 | V306 C332 I333 | V306-P330 HydrophobicContact CG1-CB 3.96Å; P330-C332 VanDerWaalsContact C-N 3.29Å; P330-C332 PolarHBondContact O-N 2.75Å; P330-I333 WeakPolarHBondContact O-CB 3.06Å; P330-I333 WeakPolarHBondContact O-CG2 3.41Å; P330-I333 PolarHBondContact O-N 2.88Å |
| 331 | E | 82.1 | Confident | 91.9 | Very high | 13 Ų | 13 | 38 Ų | 38 | 6% | 0.061 | 20% | 0.203 | C | C | . | . | G | 310 helix | trans | -54.7 | -36.3 | 174.2 | -74.8 | 64.3 | -142.7 | 0 | 0 | 113.8 | K309 L314 T329 I333 | K309-E331 HydrophobicContact CD-CG 4.26Å; K309-E331 WeakPolarHBondContact CD-OE1 3.49Å; K309-E331 WeakPolarHBondContact CE-OE1 3.35Å; K309-E331 IonicContact NZ-OE1 2.66Å; K309-E331 PolarHBondContact NZ-OE1 3.24Å; L314-E331 HydrophobicContact CD1-CB 3.52Å; L314-E331 HydrophobicContact CD1-CG 3.62Å; L314-E331 HydrophobicContact CG-CB 4.12Å; L314-E331 HydrophobicContact CG-CG 4.46Å; T329-E331 WeakPolarHBondContact CB-OE2 3.44Å; T329-E331 PolarHBondContact O-N 2.84Å; T329-E331 VanDerWaalsContact O-N 3.09Å; E331-I333 VanDerWaalsContact C-N 3.27Å; E331-I333 PolarHBondContact O-N 2.84Å |
| 332 | C | 87.8 | Confident | 91.9 | Very high | 12 Ų | 12 | 36.1 Ų | 36.1 | 8% | 0.081 | 19% | 0.19 | C | C | . | . | G | 310 helix | trans | -69.7 | -20.7 | -179.2 | -73.1 | 0 | 0 | 0 | 0 | 113.6 | T329 P330 V334 F335 | T329-C332 WeakPolarHBondContact O-CB 3.46Å; T329-C332 PolarHBondContact O-N 2.84Å; T329-C332 PolarHBondContact OG1-SG 3.28Å; T329-C332 VanDerWaalsContact OG1-SG 3.37Å; P330-C332 VanDerWaalsContact C-N 3.29Å; P330-C332 PolarHBondContact O-N 2.75Å; C332-V334 PolarHBondContact O-N 3.45Å; C332-F335 WeakPolarHBondContact O-CB 3.49Å; C332-F335 WeakPolarHBondContact O-CD2 3.22Å; C332-F335 PolarHBondContact O-N 2.91Å |
| 333 | I | 89.5 | Confident | 91.9 | Very high | 4 Ų | 4 | 36.3 Ų | 36.3 | 2% | 0.021 | 19% | 0.189 | C | C | . | . | H | α-helix | trans | -60.8 | -25.1 | -173.4 | -151.4 | 169.2 | 0 | 0 | 0 | 113.6 | N299 D302 A303 V306 Y328 P330 E331 F335 D336 L337 | N299-I333 VanDerWaalsContact CA-CD1 3.5Å; N299-I333 HydrophobicContact CB-CD1 3.59Å; N299-I333 HydrophobicContact CB-CG1 4.15Å; D302-I333 HydrophobicContact CB-CD1 4.15Å; A303-I333 HydrophobicContact CB-CG2 3.82Å; V306-I333 HydrophobicContact CG2-CG2 4.35Å; Y328-I333 VanDerWaalsContact OH-CD1 3.26Å; Y328-I333 WeakPolarHBondContact OH-CD1 3.5Å; Y328-I333 WeakPolarHBondContact OH-CG1 3.41Å; P330-I333 WeakPolarHBondContact O-CB 3.06Å; P330-I333 WeakPolarHBondContact O-CG2 3.41Å; P330-I333 PolarHBondContact O-N 2.88Å; E331-I333 VanDerWaalsContact C-N 3.27Å; E331-I333 PolarHBondContact O-N 2.84Å; I333-F335 VanDerWaalsContact C-N 3.31Å; I333-F335 PolarHBondContact O-N 3.36Å; I333-D336 PolarHBondContact O-N 3.43Å; I333-L337 WeakPolarHBondContact O-CG 3.06Å; I333-L337 PolarHBondContact O-N 3.06Å; I333-L337 VanDerWaalsContact O-N 3.07Å |
| 334 | V | 91.1 | Very high | 92 | Very high | 0 Ų | 0 | 36.3 Ų | 36.3 | 0% | 0 | 19% | 0.19 | C | C | . | . | H | α-helix | trans | -66.1 | -35.3 | 178.6 | -175.8 | 0 | 0 | 0 | 0 | 111.1 | I248 A303 V306 L307 L310 C332 L338 | I248-V334 HydrophobicContact CD1-CG1 4.16Å; A303-V334 HydrophobicContact CB-CG2 4.36Å; V306-V334 HydrophobicContact CG2-CG2 3.71Å; L307-V334 HydrophobicContact CD2-CG1 4.04Å; L307-V334 HydrophobicContact CD2-CG2 3.9Å; L310-V334 HydrophobicContact CD1-CG1 4.22Å; L310-V334 HydrophobicContact CD1-CG2 4.43Å; C332-V334 PolarHBondContact O-N 3.45Å; V334-L338 HydrophobicContact CG1-CD1 3.82Å; V334-L338 WeakPolarHBondContact O-CB 3.27Å; V334-L338 WeakPolarHBondContact O-CD1 3.25Å; V334-L338 VanDerWaalsContact O-CG 3.23Å; V334-L338 WeakPolarHBondContact O-CG 3.39Å; V334-L338 PolarHBondContact O-N 2.72Å |
| 335 | F | 92.8 | Very high | 92 | Very high | 4 Ų | 4 | 32.7 Ų | 32.7 | 2% | 0.018 | 17% | 0.167 | C | C | . | . | H | α-helix | trans | -69 | -45.4 | 177.8 | -64.5 | -92.6 | 0 | 0 | 0 | 110.8 | I248 L314 C332 I333 L338 N339 I340 L342 V419 | I248-F335 HydrophobicContact CD1-CE1 4.01Å; I248-F335 HydrophobicContact CD1-CE2 4.16Å; I248-F335 HydrophobicContact CD1-CZ 3.75Å; I248-F335 HydrophobicContact CG1-CD1 4.42Å; I248-F335 HydrophobicContact CG1-CE1 3.78Å; I248-F335 HydrophobicContact CG1-CZ 4.01Å; L314-F335 HydrophobicContact CD2-CE2 3.66Å; L314-F335 HydrophobicContact CD2-CZ 3.97Å; C332-F335 WeakPolarHBondContact O-CB 3.49Å; C332-F335 WeakPolarHBondContact O-CD2 3.22Å; C332-F335 PolarHBondContact O-N 2.91Å; I333-F335 VanDerWaalsContact C-N 3.31Å; I333-F335 PolarHBondContact O-N 3.36Å; F335-L338 PolarHBondContact O-N 3.1Å; F335-N339 PolarHBondContact O-N 3.16Å; F335-I340 WeakPolarHBondContact CB-O 3.49Å; F335-I340 HydrophobicContact CD1-CB 4.38Å; F335-I340 HydrophobicContact CD1-CG2 4.06Å; F335-I340 PolarHBondContact O-N 2.86Å; F335-L342 HydrophobicContact CD1-CB 4.14Å; F335-L342 HydrophobicContact CD1-CD1 4.28Å; F335-L342 HydrophobicContact CD2-CD2 4.49Å; F335-L342 HydrophobicContact CE1-CD1 3.92Å; F335-L342 HydrophobicContact CG-CB 4.32Å; F335-L342 HydrophobicContact CZ-CD1 4.25Å; F335-V419 HydrophobicContact CD1-CB 4.43Å; F335-V419 HydrophobicContact CE1-CB 3.9Å; F335-V419 HydrophobicContact CE1-CG1 4.02Å; F335-V419 HydrophobicContact CE1-CG2 4.04Å |
| 336 | D | 90.8 | Very high | 92.1 | Very high | 108 Ų | 108 | 30.8 Ų | 30.8 | 58% | 0.578 | 16% | 0.156 | S | C | * | . | H | α-helix | trans | -61.3 | -50.9 | 178.1 | -72.8 | -34.3 | 0 | 0 | 0 | 112.2 | I333 L338 N339 | I333-D336 PolarHBondContact O-N 3.43Å; D336-L338 PolarHBondContact O-N 2.91Å; D336-N339 WeakPolarHBondContact O-CA 3.32Å; D336-N339 PolarHBondContact O-N 3.43Å |
| 337 | L | 90.6 | Very high | 92.2 | Very high | 18 Ų | 18 | 29.2 Ų | 29.2 | 9% | 0.094 | 15% | 0.149 | C | C | . | . | H | α-helix | trans | -60.4 | -42.4 | 179.6 | -72.5 | 175.7 | 0 | 0 | 0 | 112.6 | V280 V283 F296 N299 A303 I333 N339 | V280-L337 HydrophobicContact CG1-CD1 4.23Å; V283-L337 WeakPolarHBondContact CG1-O 3.15Å; V283-L337 WeakPolarHBondContact CG2-O 3.2Å; F296-L337 HydrophobicContact CD2-CD2 4.07Å; F296-L337 HydrophobicContact CE2-CD2 3.73Å; N299-L337 HydrophobicContact CB-CD2 4.13Å; A303-L337 HydrophobicContact CB-CD1 3.49Å; A303-L337 VanDerWaalsContact CB-CD1 3.49Å; I333-L337 WeakPolarHBondContact O-CG 3.06Å; I333-L337 PolarHBondContact O-N 3.06Å; I333-L337 VanDerWaalsContact O-N 3.07Å; L337-N339 PolarHBondContact O-N 3.4Å |
| 338 | L | 91.7 | Very high | 92.4 | Very high | 0 Ų | 0 | 26.6 Ų | 26.6 | 0% | 0 | 14% | 0.138 | C | C | . | . | H | α-helix | trans | -76.3 | -7.8 | 178.5 | -64.2 | 173.9 | 0 | 0 | 0 | 113.1 | I248 L252 R255 K257 L276 C279 V280 V283 V334 F335 D336 I340 | I248-L338 HydrophobicContact CG2-CD1 3.67Å; L252-L338 HydrophobicContact CD1-CD1 4.27Å; L252-L338 HydrophobicContact CD2-CD2 4.29Å; R255-L338 PolarHBondContact NH1-O 2.93Å; K257-L338 PolarHBondContact NZ-O 3.16Å; L276-L338 HydrophobicContact CD1-CD1 3.69Å; C279-L338 HydrophobicContact CB-CD2 4.08Å; C279-L338 WeakPolarHBondContact O-CD2 3.2Å; V280-L338 HydrophobicContact CG2-CD2 3.94Å; V280-L338 HydrophobicContact CG2-CG 4.32Å; V283-L338 HydrophobicContact CG2-CD2 4.42Å; V334-L338 HydrophobicContact CG1-CD1 3.82Å; V334-L338 WeakPolarHBondContact O-CB 3.27Å; V334-L338 WeakPolarHBondContact O-CD1 3.25Å; V334-L338 VanDerWaalsContact O-CG 3.23Å; V334-L338 WeakPolarHBondContact O-CG 3.39Å; V334-L338 PolarHBondContact O-N 2.72Å; F335-L338 PolarHBondContact O-N 3.1Å; D336-L338 PolarHBondContact O-N 2.91Å; L338-I340 HydrophobicContact CB-CD1 3.75Å; L338-I340 HydrophobicContact CB-CG1 3.88Å; L338-I340 HydrophobicContact CD1-CD1 4Å |
| 339 | N | 93 | Very high | 92.8 | Very high | 70 Ų | 70 | 22.6 Ų | 22.6 | 37% | 0.374 | 13% | 0.126 | S | C | . | . | T | Hydrogen-bonded Turn | trans | 52.4 | 55 | -169.2 | -168.7 | 102.1 | 0 | 0 | 0 | 111.3 | R255 R286 F335 D336 L337 | R255-N339 VanDerWaalsContact CZ-O 3.29Å; R255-N339 PolarHBondContact NH1-O 3.45Å; R255-N339 PolarHBondContact NH2-O 2.95Å; R286-N339 PolarHBondContact NH2-OD1 3.42Å; F335-N339 PolarHBondContact O-N 3.16Å; D336-N339 WeakPolarHBondContact O-CA 3.32Å; D336-N339 PolarHBondContact O-N 3.43Å; L337-N339 PolarHBondContact O-N 3.4Å |
| 340 | I | 95.8 | Very high | 93.3 | Very high | 5 Ų | 5 | 25.2 Ų | 25.2 | 3% | 0.026 | 14% | 0.143 | C | C | . | . | trans | -109.2 | 111.9 | 174.2 | -63 | 173.7 | 0 | 0 | 0 | 106.4 | I248 T251 L252 F335 L338 L342 V419 | I248-I340 HydrophobicContact CG2-CD1 4Å; T251-I340 HydrophobicContact CG2-CD1 3.84Å; T251-I340 HydrophobicContact CG2-CG1 3.82Å; T251-I340 HydrophobicContact CG2-CG2 4.07Å; L252-I340 HydrophobicContact CD2-CD1 4.4Å; F335-I340 WeakPolarHBondContact CB-O 3.49Å; F335-I340 HydrophobicContact CD1-CB 4.38Å; F335-I340 HydrophobicContact CD1-CG2 4.06Å; F335-I340 PolarHBondContact O-N 2.86Å; L338-I340 HydrophobicContact CB-CD1 3.75Å; L338-I340 HydrophobicContact CB-CG1 3.88Å; L338-I340 HydrophobicContact CD1-CD1 4Å; I340-L342 PolarHBondContact O-N 3.15Å; I340-V419 HydrophobicContact CG2-CB 4.35Å; I340-V419 HydrophobicContact CG2-CG2 3.79Å | ||
| 341 | P | 96.5 | Very high | 93.8 | Very high | 27 Ų | 27 | 30 Ų | 30 | 18% | 0.175 | 16% | 0.16 | C | C | . | . | trans | -60 | 133.3 | 172.1 | -21 | 32.2 | 0 | 0 | 0 | 110 | Y343 E416 S418 V419 | P341-Y343 HydrophobicContact CB-CD2 4.16Å; P341-Y343 HydrophobicContact CB-CE2 3.53Å; P341-Y343 HydrophobicContact CG-CE2 4.45Å; P341-E416 HydrophobicContact CG-CG 4.28Å; P341-S418 WeakPolarHBondContact O-CA 3.32Å; P341-S418 WeakPolarHBondContact O-CB 3.4Å; P341-V419 PolarHBondContact O-N 3.24Å | ||
| 342 | L | 96.6 | Very high | 94.4 | Very high | 20 Ų | 20 | 31.5 Ų | 31.5 | 11% | 0.105 | 17% | 0.171 | C | C | . | . | E | Extended strand (participates in β ladder) | trans | -102.9 | 132.3 | 167.8 | -177 | 65.3 | 0 | 0 | 0 | 108.1 | F326 F335 I340 V419 F426 | F326-L342 HydrophobicContact CD1-CD2 4.33Å; F326-L342 HydrophobicContact CD2-CD2 4.07Å; F326-L342 HydrophobicContact CD2-CG 4.27Å; F326-L342 HydrophobicContact CE1-CD2 4.07Å; F326-L342 HydrophobicContact CE1-CG 4.37Å; F326-L342 HydrophobicContact CE2-CB 4.23Å; F326-L342 HydrophobicContact CE2-CD2 3.82Å; F326-L342 HydrophobicContact CE2-CG 3.59Å; F326-L342 HydrophobicContact CG-CD2 4.33Å; F326-L342 HydrophobicContact CZ-CD1 4.43Å; F326-L342 HydrophobicContact CZ-CD2 3.81Å; F326-L342 HydrophobicContact CZ-CG 3.65Å; F335-L342 HydrophobicContact CD1-CB 4.14Å; F335-L342 HydrophobicContact CD1-CD1 4.28Å; F335-L342 HydrophobicContact CD2-CD2 4.49Å; F335-L342 HydrophobicContact CE1-CD1 3.92Å; F335-L342 HydrophobicContact CG-CB 4.32Å; F335-L342 HydrophobicContact CZ-CD1 4.25Å; I340-L342 PolarHBondContact O-N 3.15Å; L342-V419 CarbonylContact C-O 3.57Å; L342-V419 WeakPolarHBondContact CA-O 3.42Å; L342-V419 HydrophobicContact CD1-CB 4.09Å; L342-V419 HydrophobicContact CD1-CG1 3.84Å; L342-F426 HydrophobicContact CD1-CD1 4.18Å; L342-F426 HydrophobicContact CD1-CE1 4.14Å |
| 343 | Y | 97.7 | Very high | 94.8 | Very high | 10 Ų | 10 | 35.3 Ų | 35.3 | 4% | 0.039 | 20% | 0.196 | C | C | . | . | E | Extended strand (participates in β ladder) | trans | -132.9 | 156 | -178.2 | -66.6 | -66.9 | 0 | 0 | 0 | 112.1 | V323 T324 P341 L408 T411 A412 V419 F420 F421 M429 | V323-Y343 HydrophobicContact CB-CD1 4.47Å; V323-Y343 HydrophobicContact CG2-CD1 4.14Å; V323-Y343 HydrophobicContact CG2-CE1 4.41Å; V323-Y343 CarbonylContact O-C 3.56Å; V323-Y343 VanDerWaalsContact O-CA 3.28Å; V323-Y343 WeakPolarHBondContact O-CA 3.32Å; T324-Y343 HydrophobicContact CG2-CD1 3.75Å; T324-Y343 HydrophobicContact CG2-CE1 3.57Å; P341-Y343 HydrophobicContact CB-CD2 4.16Å; P341-Y343 HydrophobicContact CB-CE2 3.53Å; P341-Y343 HydrophobicContact CG-CE2 4.45Å; Y343-L408 HydrophobicContact CD1-CD1 3.94Å; Y343-L408 HydrophobicContact CD2-CD1 4.23Å; Y343-L408 HydrophobicContact CG-CD1 3.68Å; Y343-T411 HydrophobicContact CE1-CG2 4.05Å; Y343-A412 HydrophobicContact CE2-CB 4.46Å; Y343-V419 PolarHBondContact N-O 3.34Å; Y343-F420 CarbonylContact O-C 3.51Å; Y343-F420 WeakPolarHBondContact O-CA 3.46Å; Y343-F421 PolarHBondContact O-N 3.03Å; Y343-M429 HydrophobicContact CD2-CE 3.69Å; Y343-M429 HydrophobicContact CE2-CE 4.28Å; Y343-M429 HydrophobicContact CG-CE 4.42Å |
| 344 | H | 97.6 | Very high | 95 | Very high | 1 Ų | 1 | 42.2 Ų | 42.2 | 1% | 0.005 | 23% | 0.228 | C | C | . | . | E | Extended strand (participates in β ladder) | trans | -135 | 166.3 | 163.1 | 63.4 | 103.3 | 0 | 0 | 0 | 109.9 | V318 R319 G322 V323 D325 F326 W346 | V318-H344 HydrophobicContact CG1-CB 4.05Å; R319-H344 PolarHBondContact O-CE1 2.76Å; G322-H344 PolarHBondContact O-CE1 3.26Å; G322-H344 PolarHBondContact O-NE2 2.9Å; G322-H344 VanDerWaalsContact O-NE2 3.08Å; V323-H344 WeakPolarHBondContact CA-O 3.37Å; V323-H344 VanDerWaalsContact CB-O 3.31Å; V323-H344 WeakPolarHBondContact CB-O 3.38Å; V323-H344 WeakPolarHBondContact CG1-O 3.47Å; V323-H344 PolarHBondContact O-CD2 2.64Å; V323-H344 PolarHBondContact O-N 3.45Å; D325-H344 PolarHBondContact N-NE2 3Å; F326-H344 AromaticContact CE2-CD2 3.59Å; F326-H344 HydrophobicContact CZ-CB 4.02Å; F326-H344 AromaticContact CZ-CD2 3.5Å; H344-W346 PolarHBondContact ND1-O 2.84Å |
| 345 | G | 97.3 | Very high | 95.3 | Very high | 0 Ų | 0 | 43.3 Ų | 43.3 | 0% | 0 | 24% | 0.235 | C | C | . | . | B | Isolated β-bridge | trans | -117.4 | 11 | 175.6 | 0 | 0 | 0 | 0 | 0 | 113.9 | L347 S401 | G345-L347 PolarHBondContact O-N 3.37Å; G345-S401 PolarHBondContact O-N 2.93Å; G345-S401 PolarHBondContact O-OG 2.92Å |
| 346 | W | 97.8 | Very high | 95.4 | Very high | 13 Ų | 13 | 45.7 Ų | 45.7 | 5% | 0.049 | 25% | 0.25 | C | C | . | . | trans | -84.9 | 86.6 | 178.5 | -158.8 | 2.5 | 0 | 0 | 0 | 110.4 | V318 F320 H344 Y364 L393 T396 Q399 | V318-W346 HydrophobicContact CG2-CE3 3.82Å; V318-W346 HydrophobicContact CG2-CZ3 4.41Å; F320-W346 HydrophobicContact CD1-CD2 4.33Å; F320-W346 HydrophobicContact CD1-CG 4.11Å; F320-W346 AromaticContact CE1-CD2 3.76Å; F320-W346 HydrophobicContact CE1-CD2 3.76Å; F320-W346 AromaticContact CE1-CE2 3.78Å; F320-W346 HydrophobicContact CE1-CE3 4.2Å; F320-W346 HydrophobicContact CE1-CG 4.03Å; F320-W346 HydrophobicContact CE1-CZ2 4.3Å; F320-W346 AromaticContact CE1-NE1 3.95Å; H344-W346 PolarHBondContact ND1-O 2.84Å; W346-Y364 AromaticContact CH2-CD2 3.61Å; W346-Y364 HydrophobicContact CH2-CD2 3.61Å; W346-Y364 AromaticContact CH2-CE2 3.69Å; W346-Y364 HydrophobicContact CH2-CE2 3.69Å; W346-Y364 HydrophobicContact CZ2-CD2 4.46Å; W346-Y364 AromaticContact CZ3-CD2 3.86Å; W346-Y364 HydrophobicContact CZ3-CD2 3.86Å; W346-Y364 HydrophobicContact CZ3-CE2 4.23Å; W346-L393 HydrophobicContact CH2-CD2 4.06Å; W346-L393 HydrophobicContact CZ2-CD2 3.51Å; W346-T396 PolarHBondContact NE1-OG1 3.32Å; W346-Q399 HydrophobicContact CB-CB 4.45Å; W346-Q399 WeakPolarHBondContact CB-O 3.11Å; W346-Q399 HydrophobicContact CD2-CB 3.96Å; W346-Q399 HydrophobicContact CD2-CG 4.1Å; W346-Q399 HydrophobicContact CE3-CB 3.77Å; W346-Q399 HydrophobicContact CE3-CG 3.62Å; W346-Q399 HydrophobicContact CG-CB 4.31Å; W346-Q399 HydrophobicContact CH2-CG 4.02Å; W346-Q399 HydrophobicContact CZ2-CG 4.44Å; W346-Q399 HydrophobicContact CZ3-CB 4.29Å; W346-Q399 HydrophobicContact CZ3-CG 3.61Å | ||
| 347 | L | 97.8 | Very high | 95.7 | Very high | 2 Ų | 2 | 43.8 Ų | 43.8 | 1% | 0.01 | 25% | 0.249 | C | C | . | . | trans | -120.6 | 157.2 | -179.8 | -81.7 | 70.5 | 0 | 0 | 0 | 110 | F320 V323 G345 S401 E407 | F320-L347 WeakPolarHBondContact O-CA 3.33Å; V323-L347 HydrophobicContact CB-CD1 4.47Å; V323-L347 HydrophobicContact CG1-CD1 3.7Å; V323-L347 HydrophobicContact CG1-CD2 4.08Å; G345-L347 PolarHBondContact O-N 3.37Å; L347-S401 PolarHBondContact N-OG 3.46Å; L347-S401 WeakPolarHBondContact O-CB 3.37Å; L347-S401 PolarHBondContact O-OG 3.01Å; L347-E407 HydrophobicContact CD2-CB 4.38Å; L347-E407 WeakPolarHBondContact CD2-OE2 3.26Å | ||
| 348 | V | 97.3 | Very high | 95.9 | Very high | 14 Ų | 14 | 43 Ų | 43 | 9% | 0.085 | 25% | 0.245 | C | C | . | . | trans | -76.4 | 147.5 | 163.7 | 69.3 | 0 | 0 | 0 | 0 | 109.7 | F320 T355 V356 F392 H403 | F320-V348 HydrophobicContact CB-CB 4.48Å; F320-V348 PolarHBondContact O-N 2.74Å; V348-T355 HydrophobicContact CG2-CG2 3.64Å; V348-V356 HydrophobicContact CG1-CG2 4.09Å; V348-V356 HydrophobicContact CG2-CG2 3.9Å; V348-F392 HydrophobicContact CB-CE2 4.32Å; V348-F392 HydrophobicContact CB-CZ 4.42Å; V348-F392 HydrophobicContact CG2-CE2 4.48Å; V348-H403 PolarHBondContact O-ND1 2.99Å | ||
| 349 | D | 96.2 | Very high | 96.1 | Very high | 54 Ų | 54 | 43.1 Ų | 43.1 | 29% | 0.289 | 25% | 0.246 | S | C | . | . | trans | -85 | 123.3 | 175.1 | -165.5 | -34.5 | 0 | 0 | 0 | 110.2 | Q351 S352 V356 H403 | D349-Q351 PolarHBondContact O-N 2.87Å; D349-Q351 VanDerWaalsContact O-N 3.07Å; D349-Q351 VanDerWaalsContact OD1-CB 3.3Å; D349-Q351 WeakPolarHBondContact OD1-CB 3.41Å; D349-Q351 WeakPolarHBondContact OD1-CG 3.39Å; D349-Q351 PolarHBondContact OD1-N 2.89Å; D349-S352 PolarHBondContact O-N 3.47Å; D349-S352 VanDerWaalsContact O-N 3.09Å; D349-S352 PolarHBondContact O-OG 2.8Å; D349-V356 WeakPolarHBondContact O-CG2 3.34Å; D349-H403 HydrophobicContact CB-CB 4.26Å | ||
| 350 | P | 95.3 | Very high | 96.2 | Very high | 83 Ų | 83 | 41.3 Ų | 41.3 | 54% | 0.539 | 24% | 0.243 | S | C | . | . | T | Hydrogen-bonded Turn | trans | -57.5 | -17.9 | 173.5 | -25.6 | 35.9 | 0 | 0 | 0 | 114.7 | S352 H403 | P350-S352 VanDerWaalsContact C-N 3.33Å; P350-H403 VanDerWaalsContact CD-CD2 3.43Å; P350-H403 WeakPolarHBondContact CD-CD2 3.44Å; P350-H403 WeakPolarHBondContact CD-NE2 3.35Å |
| 351 | Q | 94.9 | Very high | 96.2 | Very high | 173 Ų | 173 | 49.3 Ų | 49.3 | 81% | 0.808 | 28% | 0.278 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -74.7 | -17.2 | 176.1 | -61.3 | -172.4 | 23 | 0 | 0 | 113.8 | D349 P353 | D349-Q351 PolarHBondContact O-N 2.87Å; D349-Q351 VanDerWaalsContact O-N 3.07Å; D349-Q351 VanDerWaalsContact OD1-CB 3.3Å; D349-Q351 WeakPolarHBondContact OD1-CB 3.41Å; D349-Q351 WeakPolarHBondContact OD1-CG 3.39Å; D349-Q351 PolarHBondContact OD1-N 2.89Å; Q351-P353 WeakPolarHBondContact O-CD 3.41Å |
| 352 | S | 95.3 | Very high | 96.2 | Very high | 43 Ų | 43 | 50.2 Ų | 50.2 | 30% | 0.301 | 28% | 0.281 | S | S | . | . | trans | -107.5 | 80.2 | 176.3 | 63.5 | 0 | 0 | 0 | 0 | 111.5 | D349 P350 E354 T355 V356 | D349-S352 PolarHBondContact O-N 3.47Å; D349-S352 VanDerWaalsContact O-N 3.09Å; D349-S352 PolarHBondContact O-OG 2.8Å; P350-S352 VanDerWaalsContact C-N 3.33Å; S352-E354 PolarHBondContact O-N 3.13Å; S352-E354 VanDerWaalsContact O-N 3.11Å; S352-T355 WeakPolarHBondContact CB-OG1 3.4Å; S352-T355 WeakPolarHBondContact O-CA 3.46Å; S352-T355 WeakPolarHBondContact O-CB 3.31Å; S352-T355 PolarHBondContact O-N 2.91Å; S352-T355 WeakPolarHBondContact OG-CB 3.47Å; S352-T355 PolarHBondContact OG-OG1 2.69Å; S352-V356 PolarHBondContact O-N 3Å | ||
| 353 | P | 94.7 | Very high | 96.2 | Very high | 92 Ų | 92 | 49.3 Ų | 49.3 | 60% | 0.597 | 28% | 0.276 | S | S | * | . | H | α-helix | trans | -61.5 | -26.5 | -172.2 | 25.2 | -35.9 | 0 | 0 | 0 | 113.7 | Q351 V356 A357 | Q351-P353 WeakPolarHBondContact O-CD 3.41Å; P353-V356 PolarHBondContact O-N 2.92Å; P353-A357 WeakPolarHBondContact O-CB 3.28Å; P353-A357 PolarHBondContact O-N 2.82Å |
| 354 | E | 95.3 | Very high | 96.2 | Very high | 150 Ų | 150 | 53.1 Ų | 53.1 | 70% | 0.701 | 29% | 0.292 | S | S | * | . | H | α-helix | trans | -63.6 | -43.7 | 172.6 | -61.9 | 178.6 | -178 | 0 | 0 | 111.2 | S352 A357 A358 V388 | S352-E354 PolarHBondContact O-N 3.13Å; S352-E354 VanDerWaalsContact O-N 3.11Å; E354-A357 PolarHBondContact O-N 3.02Å; E354-A358 WeakPolarHBondContact O-CB 3.46Å; E354-A358 PolarHBondContact O-N 3.43Å; E354-V388 HydrophobicContact CB-CG1 4.49Å |
| 355 | T | 95.6 | Very high | 96.1 | Very high | 22 Ų | 22 | 57.1 Ų | 57.1 | 14% | 0.135 | 31% | 0.313 | C | S | . | . | H | α-helix | trans | -68.1 | -42.3 | 174.6 | -35.5 | 0 | 0 | 0 | 0 | 111.6 | V348 S352 A357 A358 V359 V388 F392 | V348-T355 HydrophobicContact CG2-CG2 3.64Å; S352-T355 WeakPolarHBondContact CB-OG1 3.4Å; S352-T355 WeakPolarHBondContact O-CA 3.46Å; S352-T355 WeakPolarHBondContact O-CB 3.31Å; S352-T355 PolarHBondContact O-N 2.91Å; S352-T355 WeakPolarHBondContact OG-CB 3.47Å; S352-T355 PolarHBondContact OG-OG1 2.69Å; T355-A357 VanDerWaalsContact C-N 3.28Å; T355-A357 PolarHBondContact O-N 2.7Å; T355-A358 PolarHBondContact O-N 2.87Å; T355-V359 HydrophobicContact CG2-CG2 4.09Å; T355-V359 WeakPolarHBondContact O-CB 3.46Å; T355-V359 WeakPolarHBondContact O-CG2 3.37Å; T355-V359 PolarHBondContact O-N 3.07Å; T355-V388 HydrophobicContact CG2-CG1 4.48Å; T355-F392 HydrophobicContact CG2-CB 3.63Å; T355-F392 HydrophobicContact CG2-CD2 3.77Å; T355-F392 HydrophobicContact CG2-CG 3.79Å |
| 356 | V | 96.8 | Very high | 96.1 | Very high | 55 Ų | 55 | 60.4 Ų | 60.4 | 33% | 0.333 | 33% | 0.328 | S | S | . | . | H | α-helix | trans | -60.3 | -39.3 | 176.4 | 178.1 | 0 | 0 | 0 | 0 | 111.1 | V348 D349 S352 P353 G360 | V348-V356 HydrophobicContact CG1-CG2 4.09Å; V348-V356 HydrophobicContact CG2-CG2 3.9Å; D349-V356 WeakPolarHBondContact O-CG2 3.34Å; S352-V356 PolarHBondContact O-N 3Å; P353-V356 PolarHBondContact O-N 2.92Å; V356-G360 WeakPolarHBondContact O-CA 3.32Å; V356-G360 PolarHBondContact O-N 3.32Å |
| 357 | A | 95.8 | Very high | 96.1 | Very high | 68 Ų | 68 | 59.8 Ų | 59.8 | 56% | 0.562 | 33% | 0.326 | S | S | * | . | H | α-helix | trans | -67.9 | -45.9 | 174.4 | 0 | 0 | 0 | 0 | 0 | 112.3 | P353 E354 T355 | P353-A357 WeakPolarHBondContact O-CB 3.28Å; P353-A357 PolarHBondContact O-N 2.82Å; E354-A357 PolarHBondContact O-N 3.02Å; T355-A357 VanDerWaalsContact C-N 3.28Å; T355-A357 PolarHBondContact O-N 2.7Å |
| 358 | A | 95.1 | Very high | 96 | Very high | 2 Ų | 2 | 62 Ų | 62 | 2% | 0.017 | 34% | 0.339 | C | S | . | . | H | α-helix | trans | -66.5 | -38.7 | -178.8 | 0 | 0 | 0 | 0 | 0 | 113.3 | E354 T355 K370 E385 V388 A389 | E354-A358 WeakPolarHBondContact O-CB 3.46Å; E354-A358 PolarHBondContact O-N 3.43Å; T355-A358 PolarHBondContact O-N 2.87Å; A358-K370 PolarHBondContact O-NZ 3.03Å; A358-E385 HydrophobicContact CB-CG 3.95Å; A358-V388 HydrophobicContact CB-CB 4.07Å; A358-V388 HydrophobicContact CB-CG1 3.84Å; A358-A389 HydrophobicContact CB-CB 4.32Å |
| 359 | V | 96.3 | Very high | 96 | Very high | 1 Ų | 1 | 67.4 Ų | 67.4 | 1% | 0.006 | 36% | 0.364 | C | S | . | . | H | α-helix | trans | -84.6 | -42.4 | -179.8 | 176 | 0 | 0 | 0 | 0 | 111.9 | F320 T355 K361 L362 L367 F392 | F320-V359 HydrophobicContact CB-CG1 3.8Å; F320-V359 HydrophobicContact CD2-CG1 3.37Å; F320-V359 HydrophobicContact CE2-CG1 4.24Å; F320-V359 HydrophobicContact CG-CG1 3.84Å; T355-V359 HydrophobicContact CG2-CG2 4.09Å; T355-V359 WeakPolarHBondContact O-CB 3.46Å; T355-V359 WeakPolarHBondContact O-CG2 3.37Å; T355-V359 PolarHBondContact O-N 3.07Å; V359-K361 PolarHBondContact O-N 3.09Å; V359-L362 WeakPolarHBondContact O-CG 3.23Å; V359-L362 PolarHBondContact O-N 3.32Å; V359-L367 HydrophobicContact CB-CD1 4.46Å; V359-L367 HydrophobicContact CG1-CD2 4.23Å; V359-L367 HydrophobicContact CG2-CD1 4.31Å; V359-L367 HydrophobicContact CG2-CD2 4.05Å; V359-F392 HydrophobicContact CG2-CD1 3.66Å; V359-F392 HydrophobicContact CG2-CE1 4.03Å; V359-F392 HydrophobicContact CG2-CG 4.13Å |
| 360 | G | 94.2 | Very high | 96 | Very high | 32 Ų | 32 | 66.8 Ų | 66.8 | 33% | 0.33 | 36% | 0.358 | S | S | . | . | T | Hydrogen-bonded Turn | trans | 60.5 | -120.9 | 178 | 0 | 0 | 0 | 0 | 0 | 113.4 | V356 | V356-G360 WeakPolarHBondContact O-CA 3.32Å; V356-G360 PolarHBondContact O-N 3.32Å |
| 361 | K | 95.8 | Very high | 96 | Very high | 173 Ų | 173 | 63.3 Ų | 63.3 | 75% | 0.752 | 34% | 0.335 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -119.7 | 17 | -179.9 | -58.7 | -170.3 | 177.1 | -172.1 | 0 | 113.2 | R319 T321 V359 | R319-K361 PolarHBondContact NH1-O 2.88Å; T321-K361 HydrophobicContact CG2-CB 4.4Å; T321-K361 HydrophobicContact CG2-CG 4.23Å; V359-K361 PolarHBondContact O-N 3.09Å |
| 362 | L | 96.8 | Very high | 96.1 | Very high | 47 Ų | 47 | 59.4 Ų | 59.4 | 25% | 0.246 | 32% | 0.319 | C | S | . | . | trans | -70.9 | 145.8 | -175.6 | -58.3 | 177 | 0 | 0 | 0 | 110.3 | V359 Q366 L367 K370 | V359-L362 WeakPolarHBondContact O-CG 3.23Å; V359-L362 PolarHBondContact O-N 3.32Å; L362-Q366 HydrophobicContact CB-CB 3.95Å; L362-Q366 HydrophobicContact CD2-CB 4.1Å; L362-L367 HydrophobicContact CB-CB 4.35Å; L362-L367 HydrophobicContact CD1-CD1 4.03Å; L362-K370 HydrophobicContact CD1-CB 4.21Å; L362-K370 HydrophobicContact CD1-CD 3.45Å; L362-K370 VanDerWaalsContact CD1-CD 3.45Å; L362-K370 HydrophobicContact CD1-CG 4.46Å | ||
| 363 | S | 97.1 | Very high | 96.1 | Very high | 0 Ų | 0 | 62.4 Ų | 62.4 | 0% | 0 | 33% | 0.332 | C | S | . | . | B | Isolated β-bridge | trans | -77.8 | 163.9 | 163.4 | 53.8 | 0 | 0 | 0 | 0 | 110.4 | N317 V318 E327 N365 Q366 L367 | N317-S363 VanDerWaalsContact ND2-CB 3.27Å; N317-S363 WeakPolarHBondContact ND2-CB 3.39Å; N317-S363 PolarHBondContact ND2-OG 3.09Å; V318-S363 CarbonylContact O-C 3.55Å; V318-S363 WeakPolarHBondContact O-CA 3.43Å; V318-S363 WeakPolarHBondContact O-CB 3.49Å; E327-S363 WeakPolarHBondContact OE2-CB 3.47Å; E327-S363 PolarHBondContact OE2-OG 2.84Å; S363-N365 VanDerWaalsContact C-N 3.31Å; S363-N365 PolarHBondContact O-N 3.01Å; S363-Q366 WeakPolarHBondContact O-CB 3.27Å; S363-Q366 PolarHBondContact O-N 2.91Å; S363-Q366 VanDerWaalsContact OG-CD 3.29Å; S363-Q366 WeakPolarHBondContact OG-CG 3.49Å; S363-Q366 PolarHBondContact OG-OE1 2.84Å; S363-L367 PolarHBondContact O-N 3.48Å |
| 364 | Y | 97.1 | Very high | 96.1 | Very high | 91 Ų | 91 | 58 Ų | 58 | 36% | 0.357 | 30% | 0.303 | S | S | . | . | H | α-helix | trans | -50.8 | -48.2 | -177.9 | 167.2 | -94.7 | 0 | 0 | 0 | 112.5 | N317 V318 F320 W346 Q366 L367 V368 L393 | N317-Y364 WeakPolarHBondContact OD1-CB 3.4Å; N317-Y364 PolarHBondContact OD1-N 3.07Å; N317-Y364 VanDerWaalsContact OD1-N 3.12Å; V318-Y364 PolarHBondContact O-N 3.29Å; F320-Y364 HydrophobicContact CZ-CD2 4.21Å; W346-Y364 AromaticContact CH2-CD2 3.61Å; W346-Y364 HydrophobicContact CH2-CD2 3.61Å; W346-Y364 AromaticContact CH2-CE2 3.69Å; W346-Y364 HydrophobicContact CH2-CE2 3.69Å; W346-Y364 HydrophobicContact CZ2-CD2 4.46Å; W346-Y364 AromaticContact CZ3-CD2 3.86Å; W346-Y364 HydrophobicContact CZ3-CD2 3.86Å; W346-Y364 HydrophobicContact CZ3-CE2 4.23Å; Y364-Q366 PolarHBondContact O-N 3.37Å; Y364-L367 PolarHBondContact O-N 3.21Å; Y364-L367 VanDerWaalsContact O-N 3.16Å; Y364-V368 HydrophobicContact CD2-CG2 4.34Å; Y364-V368 HydrophobicContact CE1-CG2 4.2Å; Y364-V368 HydrophobicContact CE2-CG2 3.88Å; Y364-V368 WeakPolarHBondContact O-CG2 3.46Å; Y364-V368 PolarHBondContact O-N 3.4Å; Y364-L393 HydrophobicContact CD2-CD2 4.07Å; Y364-L393 HydrophobicContact CE2-CD1 4.4Å; Y364-L393 HydrophobicContact CE2-CD2 4.22Å |
| 365 | N | 96.1 | Very high | 96 | Very high | 84 Ų | 84 | 55.7 Ų | 55.7 | 45% | 0.449 | 29% | 0.29 | S | S | . | . | H | α-helix | trans | -58.4 | -45.7 | 176.6 | -65.1 | -12.5 | 0 | 0 | 0 | 112.1 | N317 S363 L367 V368 E369 | N317-N365 PolarHBondContact ND2-ND2 2.99Å; N317-N365 PolarHBondContact OD1-N 3.41Å; S363-N365 VanDerWaalsContact C-N 3.31Å; S363-N365 PolarHBondContact O-N 3.01Å; N365-L367 VanDerWaalsContact C-N 3.29Å; N365-L367 PolarHBondContact O-N 3.5Å; N365-V368 PolarHBondContact O-N 3.12Å; N365-E369 WeakPolarHBondContact O-CG 3.33Å; N365-E369 PolarHBondContact O-N 3.42Å |
| 366 | Q | 96.9 | Very high | 95.8 | Very high | 70 Ų | 70 | 62.4 Ų | 62.4 | 33% | 0.327 | 32% | 0.32 | S | S | . | . | H | α-helix | trans | -65.7 | -30.7 | 179.2 | -63.6 | 176.4 | -33.3 | 0 | 0 | 112.4 | L362 S363 Y364 K370 | L362-Q366 HydrophobicContact CB-CB 3.95Å; L362-Q366 HydrophobicContact CD2-CB 4.1Å; S363-Q366 WeakPolarHBondContact O-CB 3.27Å; S363-Q366 PolarHBondContact O-N 2.91Å; S363-Q366 VanDerWaalsContact OG-CD 3.29Å; S363-Q366 WeakPolarHBondContact OG-CG 3.49Å; S363-Q366 PolarHBondContact OG-OE1 2.84Å; Y364-Q366 PolarHBondContact O-N 3.37Å; Q366-K370 WeakPolarHBondContact O-CB 3.34Å; Q366-K370 PolarHBondContact O-N 2.88Å; Q366-K370 VanDerWaalsContact O-N 3.09Å |
| 367 | L | 97.2 | Very high | 95.7 | Very high | 0 Ų | 0 | 61 Ų | 61 | 0% | 0 | 31% | 0.313 | C | S | . | . | H | α-helix | trans | -73.8 | -42 | 176.2 | -170.9 | 65.5 | 0 | 0 | 0 | 111.5 | F320 V359 L362 S363 Y364 N365 K370 I371 A389 F392 L393 | F320-L367 HydrophobicContact CD2-CD2 4.19Å; F320-L367 HydrophobicContact CE2-CB 4.09Å; F320-L367 HydrophobicContact CE2-CD2 3.53Å; F320-L367 HydrophobicContact CE2-CG 4.43Å; F320-L367 HydrophobicContact CZ-CD2 3.92Å; V359-L367 HydrophobicContact CB-CD1 4.46Å; V359-L367 HydrophobicContact CG1-CD2 4.23Å; V359-L367 HydrophobicContact CG2-CD1 4.31Å; V359-L367 HydrophobicContact CG2-CD2 4.05Å; L362-L367 HydrophobicContact CB-CB 4.35Å; L362-L367 HydrophobicContact CD1-CD1 4.03Å; S363-L367 PolarHBondContact O-N 3.48Å; Y364-L367 PolarHBondContact O-N 3.21Å; Y364-L367 VanDerWaalsContact O-N 3.16Å; N365-L367 VanDerWaalsContact C-N 3.29Å; N365-L367 PolarHBondContact O-N 3.5Å; L367-K370 PolarHBondContact O-N 2.67Å; L367-I371 HydrophobicContact CG-CD1 4.16Å; L367-I371 VanDerWaalsContact O-CG1 3.28Å; L367-I371 WeakPolarHBondContact O-CG1 3.45Å; L367-I371 PolarHBondContact O-N 3.42Å; L367-A389 HydrophobicContact CD1-CB 3.86Å; L367-A389 HydrophobicContact CG-CB 4.4Å; L367-F392 HydrophobicContact CD2-CD1 4.18Å; L367-F392 HydrophobicContact CD2-CE1 4.38Å; L367-L393 HydrophobicContact CD2-CD1 4.24Å; L367-L393 HydrophobicContact CD2-CD2 4.04Å; L367-L393 HydrophobicContact CD2-CG 4.11Å |
| 368 | V | 96.9 | Very high | 95.6 | Very high | 47 Ų | 47 | 62.8 Ų | 62.8 | 29% | 0.285 | 33% | 0.327 | S | S | . | . | H | α-helix | trans | -62.7 | -44.3 | 175.5 | 173.2 | 0 | 0 | 0 | 0 | 111 | Y364 N365 K370 I371 I372 L393 | Y364-V368 HydrophobicContact CD2-CG2 4.34Å; Y364-V368 HydrophobicContact CE1-CG2 4.2Å; Y364-V368 HydrophobicContact CE2-CG2 3.88Å; Y364-V368 WeakPolarHBondContact O-CG2 3.46Å; Y364-V368 PolarHBondContact O-N 3.4Å; N365-V368 PolarHBondContact O-N 3.12Å; V368-K370 PolarHBondContact O-N 3Å; V368-I371 PolarHBondContact O-N 3.31Å; V368-I372 HydrophobicContact CG1-CD1 4.23Å; V368-I372 WeakPolarHBondContact O-CG1 3.29Å; V368-I372 PolarHBondContact O-N 3.03Å; V368-I372 VanDerWaalsContact O-N 3.16Å; V368-L393 HydrophobicContact CG2-CD1 4.06Å |
| 369 | E | 96.1 | Very high | 95.6 | Very high | 129 Ų | 129 | 67.1 Ų | 67.1 | 60% | 0.603 | 35% | 0.35 | S | S | * | . | H | α-helix | trans | -57.1 | -48.3 | 172.1 | -73.2 | 174.1 | -177.6 | 0 | 0 | 111.5 | N365 I371 I372 D373 | N365-E369 WeakPolarHBondContact O-CG 3.33Å; N365-E369 PolarHBondContact O-N 3.42Å; E369-I371 VanDerWaalsContact C-N 3.34Å; E369-I371 PolarHBondContact O-N 3.36Å; E369-I372 PolarHBondContact O-N 2.82Å; E369-D373 PolarHBondContact O-N 3.23Å |
| 370 | K | 96.1 | Very high | 95.4 | Very high | 41 Ų | 41 | 71.9 Ų | 71.9 | 18% | 0.178 | 38% | 0.383 | C | S | . | . | H | α-helix | trans | -59.5 | -40.4 | 176.7 | 177.7 | 176.6 | 175.2 | -176.5 | 0 | 112.8 | A358 L362 Q366 L367 V368 D373 C374 E385 | A358-K370 PolarHBondContact O-NZ 3.03Å; L362-K370 HydrophobicContact CD1-CB 4.21Å; L362-K370 HydrophobicContact CD1-CD 3.45Å; L362-K370 VanDerWaalsContact CD1-CD 3.45Å; L362-K370 HydrophobicContact CD1-CG 4.46Å; Q366-K370 WeakPolarHBondContact O-CB 3.34Å; Q366-K370 PolarHBondContact O-N 2.88Å; Q366-K370 VanDerWaalsContact O-N 3.09Å; L367-K370 PolarHBondContact O-N 2.67Å; V368-K370 PolarHBondContact O-N 3Å; K370-D373 PolarHBondContact O-N 3.5Å; K370-C374 WeakPolarHBondContact O-CB 3.47Å; K370-C374 PolarHBondContact O-N 2.83Å; K370-C374 PolarHBondContact O-SG 2.88Å; K370-C374 VanDerWaalsContact O-SG 3.33Å; K370-E385 WeakPolarHBondContact CE-OE1 3.46Å; K370-E385 WeakPolarHBondContact CE-OE2 3.25Å; K370-E385 IonicContact NZ-OE1 3.21Å; K370-E385 PolarHBondContact NZ-OE1 3.35Å; K370-E385 IonicContact NZ-OE2 2.68Å |
| 371 | I | 96.6 | Very high | 95.3 | Very high | 9 Ų | 9 | 74.4 Ų | 74.4 | 5% | 0.046 | 40% | 0.396 | C | S | . | . | H | α-helix | trans | -61.6 | -45.3 | 178.3 | -72.4 | 160.7 | 0 | 0 | 0 | 110.3 | L367 V368 E369 C374 K375 A389 E390 L393 | L367-I371 HydrophobicContact CG-CD1 4.16Å; L367-I371 VanDerWaalsContact O-CG1 3.28Å; L367-I371 WeakPolarHBondContact O-CG1 3.45Å; L367-I371 PolarHBondContact O-N 3.42Å; V368-I371 PolarHBondContact O-N 3.31Å; E369-I371 VanDerWaalsContact C-N 3.34Å; E369-I371 PolarHBondContact O-N 3.36Å; I371-C374 PolarHBondContact O-N 3.13Å; I371-K375 HydrophobicContact CG2-CD 3.67Å; I371-K375 HydrophobicContact CG2-CG 4.41Å; I371-K375 WeakPolarHBondContact O-CB 3.39Å; I371-K375 VanDerWaalsContact O-CG 3.26Å; I371-K375 WeakPolarHBondContact O-CG 3.17Å; I371-K375 PolarHBondContact O-N 2.97Å; I371-A389 HydrophobicContact CD1-CB 3.92Å; I371-A389 HydrophobicContact CG1-CB 3.66Å; I371-E390 HydrophobicContact CD1-CB 4.36Å; I371-E390 HydrophobicContact CG2-CB 4.09Å; I371-E390 HydrophobicContact CG2-CG 4.44Å; I371-L393 HydrophobicContact CD1-CD1 3.56Å; I371-L393 HydrophobicContact CD1-CG 4.42Å |
| 372 | I | 95.7 | Very high | 95.2 | Very high | 91 Ų | 91 | 70.3 Ų | 70.3 | 47% | 0.467 | 38% | 0.376 | S | S | . | . | H | α-helix | trans | -61.7 | -49.7 | 177.3 | -64.4 | 164.1 | 0 | 0 | 0 | 110.6 | V368 E369 C374 K375 H376 | V368-I372 HydrophobicContact CG1-CD1 4.23Å; V368-I372 WeakPolarHBondContact O-CG1 3.29Å; V368-I372 PolarHBondContact O-N 3.03Å; V368-I372 VanDerWaalsContact O-N 3.16Å; E369-I372 PolarHBondContact O-N 2.82Å; I372-C374 VanDerWaalsContact C-N 3.3Å; I372-C374 PolarHBondContact O-N 3.46Å; I372-K375 PolarHBondContact O-N 2.86Å; I372-H376 PolarHBondContact O-CD2 2.93Å; I372-H376 VanDerWaalsContact O-CD2 3.29Å; I372-H376 PolarHBondContact O-N 3.01Å; I372-H376 VanDerWaalsContact O-N 3.15Å |
| 373 | D | 95.4 | Very high | 95.1 | Very high | 107 Ų | 107 | 70.3 Ų | 70.3 | 57% | 0.572 | 38% | 0.378 | S | S | * | . | H | α-helix | trans | -57.4 | -40.5 | 177.2 | -109.1 | 25.9 | 0 | 0 | 0 | 112.8 | E369 K370 S377 R382 | E369-D373 PolarHBondContact O-N 3.23Å; K370-D373 PolarHBondContact O-N 3.5Å; D373-S377 PolarHBondContact O-N 2.81Å; D373-R382 IonicContact OD2-NH2 3.75Å |
| 374 | C | 94.9 | Very high | 95 | Very high | 0 Ų | 0 | 73.3 Ų | 73.3 | 0% | 0 | 40% | 0.399 | C | S | . | . | H | α-helix | trans | -73.7 | -38.6 | 179.4 | -78.5 | 0 | 0 | 0 | 0 | 112.5 | K370 I371 I372 H376 S377 R382 V383 | K370-C374 WeakPolarHBondContact O-CB 3.47Å; K370-C374 PolarHBondContact O-N 2.83Å; K370-C374 PolarHBondContact O-SG 2.88Å; K370-C374 VanDerWaalsContact O-SG 3.33Å; I371-C374 PolarHBondContact O-N 3.13Å; I372-C374 VanDerWaalsContact C-N 3.3Å; I372-C374 PolarHBondContact O-N 3.46Å; C374-H376 VanDerWaalsContact C-N 3.25Å; C374-H376 PolarHBondContact O-N 3.29Å; C374-S377 VanDerWaalsContact O-CB 3.29Å; C374-S377 WeakPolarHBondContact O-CB 3.27Å; C374-S377 PolarHBondContact O-N 3.36Å; C374-S377 VanDerWaalsContact O-N 3.11Å; C374-R382 VanDerWaalsContact CB-O 3.24Å; C374-R382 WeakPolarHBondContact CB-O 3.49Å; C374-R382 PolarHBondContact SG-O 2.85Å; C374-V383 WeakPolarHBondContact O-CG2 3.44Å |
| 375 | K | 92.8 | Very high | 94.9 | Very high | 100 Ų | 100 | 72 Ų | 72 | 44% | 0.435 | 40% | 0.396 | S | S | . | . | H | α-helix | trans | -67.7 | -23.1 | 176.5 | -73 | 172.7 | 69.2 | 145.3 | 0 | 113.2 | I371 I372 E390 | I371-K375 HydrophobicContact CG2-CD 3.67Å; I371-K375 HydrophobicContact CG2-CG 4.41Å; I371-K375 WeakPolarHBondContact O-CB 3.39Å; I371-K375 VanDerWaalsContact O-CG 3.26Å; I371-K375 WeakPolarHBondContact O-CG 3.17Å; I371-K375 PolarHBondContact O-N 2.97Å; I372-K375 PolarHBondContact O-N 2.86Å; K375-E390 IonicContact NZ-OE1 3.95Å; K375-E390 PolarHBondContact NZ-OE1 2.94Å; K375-E390 IonicContact NZ-OE2 2.62Å; K375-E390 PolarHBondContact NZ-OE2 2.89Å |
| 376 | H | 93.1 | Very high | 94.8 | Very high | 163 Ų | 163 | 68 Ų | 68 | 76% | 0.755 | 37% | 0.374 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -96 | 4.5 | 172 | -68.8 | -57.8 | 0 | 0 | 0 | 114.3 | I372 C374 | I372-H376 PolarHBondContact O-CD2 2.93Å; I372-H376 VanDerWaalsContact O-CD2 3.29Å; I372-H376 PolarHBondContact O-N 3.01Å; I372-H376 VanDerWaalsContact O-N 3.15Å; C374-H376 VanDerWaalsContact C-N 3.25Å; C374-H376 PolarHBondContact O-N 3.29Å |
| 377 | S | 94.1 | Very high | 94.8 | Very high | 26 Ų | 26 | 68.9 Ų | 68.9 | 18% | 0.182 | 38% | 0.381 | C | S | . | . | trans | -78.2 | 147.6 | 178.9 | -165.2 | 0 | 0 | 0 | 0 | 112.7 | D373 C374 D379 V383 | D373-S377 PolarHBondContact O-N 2.81Å; C374-S377 VanDerWaalsContact O-CB 3.29Å; C374-S377 WeakPolarHBondContact O-CB 3.27Å; C374-S377 PolarHBondContact O-N 3.36Å; C374-S377 VanDerWaalsContact O-N 3.11Å; S377-D379 VanDerWaalsContact C-N 3.34Å; S377-D379 PolarHBondContact OG-N 3.22Å; S377-V383 WeakPolarHBondContact O-CG2 3.36Å | ||
| 378 | A | 92.6 | Very high | 94.8 | Very high | 105 Ų | 105 | 70.5 Ų | 70.5 | 87% | 0.868 | 39% | 0.391 | S | S | * | . | S | Bend | trans | -82 | -13.7 | 167.1 | 0 | 0 | 0 | 0 | 0 | 112.8 | S380 | A378-S380 PolarHBondContact O-N 3.34Š|
| 379 | D | 94.9 | Very high | 94.8 | Very high | 94 Ų | 94 | 68.3 Ų | 68.3 | 50% | 0.503 | 38% | 0.377 | S | S | . | . | trans | -82.9 | 108.4 | -179.2 | -65.9 | -47.6 | 0 | 0 | 0 | 110.2 | S377 S381 R382 V383 | S377-D379 VanDerWaalsContact C-N 3.34Å; S377-D379 PolarHBondContact OG-N 3.22Å; D379-S381 PolarHBondContact O-N 2.99Å; D379-R382 HydrophobicContact CB-CB 4.16Å; D379-R382 HydrophobicContact CB-CG 4Å; D379-R382 WeakPolarHBondContact O-CA 3.34Å; D379-R382 WeakPolarHBondContact O-CB 3.5Å; D379-R382 PolarHBondContact O-N 3.43Å; D379-V383 PolarHBondContact O-N 3.23Å | ||
| 380 | S | 93.1 | Very high | 94.8 | Very high | 100 Ų | 100 | 64.4 Ų | 64.4 | 70% | 0.699 | 36% | 0.359 | S | S | * | . | H | α-helix | trans | -54.2 | -30.5 | -177.8 | -173 | 0 | 0 | 0 | 0 | 113.9 | A378 V383 S384 | A378-S380 PolarHBondContact O-N 3.34Å; S380-V383 PolarHBondContact O-N 2.94Å; S380-S384 PolarHBondContact O-N 3.47Å; S380-S384 PolarHBondContact O-OG 3.12Å |
| 381 | S | 91.9 | Very high | 94.9 | Very high | 85 Ų | 85 | 68.5 Ų | 68.5 | 59% | 0.594 | 38% | 0.379 | S | S | * | . | H | α-helix | trans | -68.6 | -38.4 | 175.5 | 49 | 0 | 0 | 0 | 0 | 112.8 | D379 S384 E385 | D379-S381 PolarHBondContact O-N 2.99Å; S381-S384 WeakPolarHBondContact CA-OG 3.49Å; S381-S384 PolarHBondContact O-N 2.87Å; S381-S384 PolarHBondContact O-OG 3.4Å; S381-E385 WeakPolarHBondContact O-CB 3.29Å; S381-E385 PolarHBondContact O-N 2.87Å |
| 382 | R | 93.1 | Very high | 94.9 | Very high | 88 Ų | 88 | 68.7 Ų | 68.7 | 33% | 0.332 | 38% | 0.379 | S | S | . | . | H | α-helix | trans | -68.9 | -40.9 | 173.4 | -68 | -166.6 | 64.2 | -171 | -5.7 | 110.9 | D373 C374 D379 S384 E385 G386 | D373-R382 IonicContact OD2-NH2 3.75Å; C374-R382 VanDerWaalsContact CB-O 3.24Å; C374-R382 WeakPolarHBondContact CB-O 3.49Å; C374-R382 PolarHBondContact SG-O 2.85Å; D379-R382 HydrophobicContact CB-CB 4.16Å; D379-R382 HydrophobicContact CB-CG 4Å; D379-R382 WeakPolarHBondContact O-CA 3.34Å; D379-R382 WeakPolarHBondContact O-CB 3.5Å; D379-R382 PolarHBondContact O-N 3.43Å; R382-S384 VanDerWaalsContact C-N 3.35Å; R382-S384 PolarHBondContact O-N 3.44Å; R382-E385 WeakPolarHBondContact O-CB 3.35Å; R382-E385 PolarHBondContact O-N 2.97Å; R382-G386 PolarHBondContact O-N 2.89Å |
| 383 | V | 95.3 | Very high | 94.9 | Very high | 46 Ų | 46 | 65.6 Ų | 65.6 | 28% | 0.279 | 36% | 0.364 | S | S | . | . | H | α-helix | trans | -57.8 | -46.9 | 174.1 | 179.3 | 0 | 0 | 0 | 0 | 110.7 | C374 S377 D379 S380 E385 G386 L387 | C374-V383 WeakPolarHBondContact O-CG2 3.44Å; S377-V383 WeakPolarHBondContact O-CG2 3.36Å; D379-V383 PolarHBondContact O-N 3.23Å; S380-V383 PolarHBondContact O-N 2.94Å; V383-E385 PolarHBondContact O-N 3.39Å; V383-G386 PolarHBondContact O-N 2.96Å; V383-L387 HydrophobicContact CG1-CD1 4.16Å; V383-L387 WeakPolarHBondContact O-CG 3.5Å; V383-L387 PolarHBondContact O-N 3.1Å |
| 384 | S | 94.3 | Very high | 95 | Very high | 63 Ų | 63 | 67.1 Ų | 67.1 | 44% | 0.441 | 37% | 0.367 | S | S | . | . | H | α-helix | trans | -63.7 | -38.1 | 175.5 | 49.7 | 0 | 0 | 0 | 0 | 113.4 | S380 S381 R382 L387 V388 | S380-S384 PolarHBondContact O-N 3.47Å; S380-S384 PolarHBondContact O-OG 3.12Å; S381-S384 WeakPolarHBondContact CA-OG 3.49Å; S381-S384 PolarHBondContact O-N 2.87Å; S381-S384 PolarHBondContact O-OG 3.4Å; R382-S384 VanDerWaalsContact C-N 3.35Å; R382-S384 PolarHBondContact O-N 3.44Å; S384-L387 PolarHBondContact O-N 3.15Å; S384-V388 WeakPolarHBondContact O-CG2 3.31Å; S384-V388 PolarHBondContact O-N 3.05Å |
| 385 | E | 94.9 | Very high | 95 | Very high | 63 Ų | 63 | 71.4 Ų | 71.4 | 29% | 0.294 | 40% | 0.397 | S | S | . | . | H | α-helix | trans | -63.3 | -41.6 | 175.4 | -171.4 | -173.4 | -157.3 | 0 | 0 | 111.7 | A358 K370 S381 R382 V383 V388 A389 | A358-E385 HydrophobicContact CB-CG 3.95Å; K370-E385 WeakPolarHBondContact CE-OE1 3.46Å; K370-E385 WeakPolarHBondContact CE-OE2 3.25Å; K370-E385 IonicContact NZ-OE1 3.21Å; K370-E385 PolarHBondContact NZ-OE1 3.35Å; K370-E385 IonicContact NZ-OE2 2.68Å; S381-E385 WeakPolarHBondContact O-CB 3.29Å; S381-E385 PolarHBondContact O-N 2.87Å; R382-E385 WeakPolarHBondContact O-CB 3.35Å; R382-E385 PolarHBondContact O-N 2.97Å; V383-E385 PolarHBondContact O-N 3.39Å; E385-V388 PolarHBondContact O-N 3.08Å; E385-A389 PolarHBondContact O-N 3.1Å; E385-A389 VanDerWaalsContact O-N 3.1Å |
| 386 | G | 95.6 | Very high | 95.1 | Very high | 0 Ų | 0 | 67.5 Ų | 67.5 | 0% | 0 | 38% | 0.382 | C | S | . | . | H | α-helix | trans | -63.4 | -41.7 | 174.4 | 0 | 0 | 0 | 0 | 0 | 112.9 | R382 V383 A389 E390 | R382-G386 PolarHBondContact O-N 2.89Å; V383-G386 PolarHBondContact O-N 2.96Å; G386-A389 PolarHBondContact O-N 3.35Å; G386-E390 WeakPolarHBondContact O-CB 2.99Å; G386-E390 PolarHBondContact O-N 3.36Å |
| 387 | L | 96 | Very high | 95.1 | Very high | 90 Ų | 90 | 62.6 Ų | 62.6 | 47% | 0.471 | 37% | 0.369 | S | S | . | . | H | α-helix | trans | -65.5 | -39.5 | 177.2 | -71.1 | 169.2 | 0 | 0 | 0 | 112.5 | V383 S384 E390 Q391 | V383-L387 HydrophobicContact CG1-CD1 4.16Å; V383-L387 WeakPolarHBondContact O-CG 3.5Å; V383-L387 PolarHBondContact O-N 3.1Å; S384-L387 PolarHBondContact O-N 3.15Å; L387-E390 PolarHBondContact O-N 3.39Å; L387-Q391 VanDerWaalsContact O-CB 3.32Å; L387-Q391 WeakPolarHBondContact O-CB 3.14Å; L387-Q391 PolarHBondContact O-N 2.64Å |
| 388 | V | 97 | Very high | 95.1 | Very high | 34 Ų | 34 | 64.5 Ų | 64.5 | 21% | 0.206 | 38% | 0.38 | C | S | . | . | H | α-helix | trans | -66.8 | -37.8 | 175.3 | 172.7 | 0 | 0 | 0 | 0 | 111.5 | E354 T355 A358 S384 E385 F392 | E354-V388 HydrophobicContact CB-CG1 4.49Å; T355-V388 HydrophobicContact CG2-CG1 4.48Å; A358-V388 HydrophobicContact CB-CB 4.07Å; A358-V388 HydrophobicContact CB-CG1 3.84Å; S384-V388 WeakPolarHBondContact O-CG2 3.31Å; S384-V388 PolarHBondContact O-N 3.05Å; E385-V388 PolarHBondContact O-N 3.08Å; V388-F392 WeakPolarHBondContact O-CB 3.38Å; V388-F392 PolarHBondContact O-N 2.79Å; V388-F392 VanDerWaalsContact O-N 3.08Å |
| 389 | A | 96.8 | Very high | 95.2 | Very high | 0 Ų | 0 | 60.4 Ų | 60.4 | 0% | 0 | 34% | 0.343 | C | S | . | . | H | α-helix | trans | -68.2 | -38.2 | 174.5 | 0 | 0 | 0 | 0 | 0 | 112.8 | A358 L367 I371 E385 G386 F392 L393 | A358-A389 HydrophobicContact CB-CB 4.32Å; L367-A389 HydrophobicContact CD1-CB 3.86Å; L367-A389 HydrophobicContact CG-CB 4.4Å; I371-A389 HydrophobicContact CD1-CB 3.92Å; I371-A389 HydrophobicContact CG1-CB 3.66Å; E385-A389 PolarHBondContact O-N 3.1Å; E385-A389 VanDerWaalsContact O-N 3.1Å; G386-A389 PolarHBondContact O-N 3.35Å; A389-F392 PolarHBondContact O-N 3.03Å; A389-L393 PolarHBondContact O-N 2.93Å |
| 390 | E | 96.9 | Very high | 95.3 | Very high | 47 Ų | 47 | 56.1 Ų | 56.1 | 22% | 0.22 | 32% | 0.32 | C | S | . | . | H | α-helix | trans | -66.7 | -49.2 | 175.5 | -173.7 | 161.3 | -118.4 | 0 | 0 | 111.3 | I371 K375 G386 L387 F392 L393 E394 | I371-E390 HydrophobicContact CD1-CB 4.36Å; I371-E390 HydrophobicContact CG2-CB 4.09Å; I371-E390 HydrophobicContact CG2-CG 4.44Å; K375-E390 IonicContact NZ-OE1 3.95Å; K375-E390 PolarHBondContact NZ-OE1 2.94Å; K375-E390 IonicContact NZ-OE2 2.62Å; K375-E390 PolarHBondContact NZ-OE2 2.89Å; G386-E390 WeakPolarHBondContact O-CB 2.99Å; G386-E390 PolarHBondContact O-N 3.36Å; L387-E390 PolarHBondContact O-N 3.39Å; E390-F392 PolarHBondContact O-N 3.02Å; E390-L393 PolarHBondContact O-N 3.25Å; E390-E394 WeakPolarHBondContact O-CG 3.29Å; E390-E394 PolarHBondContact O-N 2.88Å |
| 391 | Q | 97 | Very high | 95.5 | Very high | 127 Ų | 127 | 52 Ų | 52 | 59% | 0.593 | 29% | 0.291 | S | S | * | . | H | α-helix | trans | -58.3 | -34.2 | 175.2 | -172.3 | -179.6 | 11.6 | 0 | 0 | 112.6 | L387 S395 | L387-Q391 VanDerWaalsContact O-CB 3.32Å; L387-Q391 WeakPolarHBondContact O-CB 3.14Å; L387-Q391 PolarHBondContact O-N 2.64Å; Q391-S395 VanDerWaalsContact O-CB 3.27Å; Q391-S395 WeakPolarHBondContact O-CB 3.4Å; Q391-S395 PolarHBondContact O-N 2.82Å; Q391-S395 PolarHBondContact O-OG 3.18Å |
| 392 | F | 97 | Very high | 95.6 | Very high | 13 Ų | 13 | 54.2 Ų | 54.2 | 6% | 0.057 | 29% | 0.288 | C | S | . | . | H | α-helix | trans | -63 | -49 | 172.1 | 166.8 | -107.4 | 0 | 0 | 0 | 112.1 | F320 V348 T355 V359 L367 V388 A389 E390 E394 S395 T396 | F320-F392 HydrophobicContact CB-CE1 4.44Å; F320-F392 HydrophobicContact CB-CZ 4.27Å; F320-F392 AromaticContact CD1-CE1 3.55Å; F320-F392 HydrophobicContact CD1-CE1 3.55Å; F320-F392 AromaticContact CD1-CZ 3.67Å; F320-F392 HydrophobicContact CD1-CZ 3.67Å; F320-F392 HydrophobicContact CD2-CE1 4.35Å; F320-F392 AromaticContact CE1-CE1 3.78Å; F320-F392 HydrophobicContact CE1-CE1 3.78Å; F320-F392 HydrophobicContact CE1-CZ 4.25Å; F320-F392 AromaticContact CG-CE1 3.84Å; F320-F392 HydrophobicContact CG-CE1 3.84Å; F320-F392 HydrophobicContact CG-CZ 4.05Å; F320-F392 HydrophobicContact CZ-CE1 4.27Å; V348-F392 HydrophobicContact CB-CE2 4.32Å; V348-F392 HydrophobicContact CB-CZ 4.42Å; V348-F392 HydrophobicContact CG2-CE2 4.48Å; T355-F392 HydrophobicContact CG2-CB 3.63Å; T355-F392 HydrophobicContact CG2-CD2 3.77Å; T355-F392 HydrophobicContact CG2-CG 3.79Å; V359-F392 HydrophobicContact CG2-CD1 3.66Å; V359-F392 HydrophobicContact CG2-CE1 4.03Å; V359-F392 HydrophobicContact CG2-CG 4.13Å; L367-F392 HydrophobicContact CD2-CD1 4.18Å; L367-F392 HydrophobicContact CD2-CE1 4.38Å; V388-F392 WeakPolarHBondContact O-CB 3.38Å; V388-F392 PolarHBondContact O-N 2.79Å; V388-F392 VanDerWaalsContact O-N 3.08Å; A389-F392 PolarHBondContact O-N 3.03Å; E390-F392 PolarHBondContact O-N 3.02Å; F392-E394 VanDerWaalsContact C-N 3.34Å; F392-E394 PolarHBondContact O-N 3.21Å; F392-S395 PolarHBondContact O-N 2.98Å; F392-S395 PolarHBondContact O-OG 3.43Å; F392-T396 HydrophobicContact CD2-CG2 4.09Å; F392-T396 HydrophobicContact CE2-CG2 3.92Å; F392-T396 WeakPolarHBondContact O-CB 3.46Å; F392-T396 PolarHBondContact O-N 2.95Å; F392-T396 PolarHBondContact O-OG1 3.33Å |
| 393 | L | 96.8 | Very high | 95.8 | Very high | 27 Ų | 27 | 52.6 Ų | 52.6 | 14% | 0.141 | 28% | 0.284 | C | S | . | . | H | α-helix | trans | -63.9 | -38.8 | 178.4 | -68.5 | 179.6 | 0 | 0 | 0 | 112.1 | F320 W346 Y364 L367 V368 I371 A389 E390 A397 | F320-L393 HydrophobicContact CE1-CD2 4.25Å; F320-L393 HydrophobicContact CZ-CD2 4.02Å; W346-L393 HydrophobicContact CH2-CD2 4.06Å; W346-L393 HydrophobicContact CZ2-CD2 3.51Å; Y364-L393 HydrophobicContact CD2-CD2 4.07Å; Y364-L393 HydrophobicContact CE2-CD1 4.4Å; Y364-L393 HydrophobicContact CE2-CD2 4.22Å; L367-L393 HydrophobicContact CD2-CD1 4.24Å; L367-L393 HydrophobicContact CD2-CD2 4.04Å; L367-L393 HydrophobicContact CD2-CG 4.11Å; V368-L393 HydrophobicContact CG2-CD1 4.06Å; I371-L393 HydrophobicContact CD1-CD1 3.56Å; I371-L393 HydrophobicContact CD1-CG 4.42Å; A389-L393 PolarHBondContact O-N 2.93Å; E390-L393 PolarHBondContact O-N 3.25Å; L393-A397 WeakPolarHBondContact O-CA 3.42Å; L393-A397 PolarHBondContact O-N 3.4Å; L393-A397 VanDerWaalsContact O-N 3.1Å |
| 394 | E | 96.1 | Very high | 95.9 | Very high | 138 Ų | 138 | 50.4 Ų | 50.4 | 65% | 0.645 | 27% | 0.27 | S | S | * | . | H | α-helix | trans | -65 | -51.1 | 175.3 | -69.5 | -179.4 | 163.4 | 0 | 0 | 112 | E390 F392 T396 A397 | E390-E394 WeakPolarHBondContact O-CG 3.29Å; E390-E394 PolarHBondContact O-N 2.88Å; F392-E394 VanDerWaalsContact C-N 3.34Å; F392-E394 PolarHBondContact O-N 3.21Å; E394-T396 PolarHBondContact O-N 3.19Å; E394-A397 WeakPolarHBondContact O-CB 3.43Å; E394-A397 PolarHBondContact O-N 2.91Å |
| 395 | S | 94.7 | Very high | 95.9 | Very high | 90 Ų | 90 | 48.1 Ų | 48.1 | 63% | 0.629 | 25% | 0.253 | S | S | * | . | H | α-helix | trans | -69.4 | -19 | -178.2 | 58.1 | 0 | 0 | 0 | 0 | 114.1 | Q391 F392 | Q391-S395 VanDerWaalsContact O-CB 3.27Å; Q391-S395 WeakPolarHBondContact O-CB 3.4Å; Q391-S395 PolarHBondContact O-N 2.82Å; Q391-S395 PolarHBondContact O-OG 3.18Å; F392-S395 PolarHBondContact O-N 2.98Å; F392-S395 PolarHBondContact O-OG 3.43Å |
| 396 | T | 95.2 | Very high | 96 | Very high | 19 Ų | 19 | 49.2 Ų | 49.2 | 12% | 0.117 | 27% | 0.267 | C | S | . | . | T | Hydrogen-bonded Turn | trans | -114.8 | 21.5 | 177.6 | 62.6 | 0 | 0 | 0 | 0 | 113.5 | W346 F392 E394 T398 Q399 | W346-T396 PolarHBondContact NE1-OG1 3.32Å; F392-T396 HydrophobicContact CD2-CG2 4.09Å; F392-T396 HydrophobicContact CE2-CG2 3.92Å; F392-T396 WeakPolarHBondContact O-CB 3.46Å; F392-T396 PolarHBondContact O-N 2.95Å; F392-T396 PolarHBondContact O-OG1 3.33Å; E394-T396 PolarHBondContact O-N 3.19Å; T396-T398 PolarHBondContact O-N 3.27Å; T396-Q399 WeakPolarHBondContact O-CA 3.47Å; T396-Q399 PolarHBondContact O-N 2.85Å |
| 397 | A | 94.3 | Very high | 96.1 | Very high | 59 Ų | 59 | 51.6 Ų | 51.6 | 49% | 0.488 | 28% | 0.278 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -56.5 | -19.8 | -175.2 | 0 | 0 | 0 | 0 | 0 | 115.4 | L393 E394 Q399 | L393-A397 WeakPolarHBondContact O-CA 3.42Å; L393-A397 PolarHBondContact O-N 3.4Å; L393-A397 VanDerWaalsContact O-N 3.1Å; E394-A397 WeakPolarHBondContact O-CB 3.43Å; E394-A397 PolarHBondContact O-N 2.91Å; A397-Q399 PolarHBondContact O-N 2.64Å |
| 398 | T | 93.3 | Very high | 96.1 | Very high | 67 Ų | 67 | 47.3 Ų | 47.3 | 41% | 0.411 | 26% | 0.256 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -74.7 | 3.2 | 172.2 | 67.8 | 0 | 0 | 0 | 0 | 113.9 | T396 L400 R422 | T396-T398 PolarHBondContact O-N 3.27Å; T398-L400 PolarHBondContact O-N 3.4Å; T398-R422 VanDerWaalsContact O-CG 3.29Å; T398-R422 WeakPolarHBondContact O-CG 3.43Å; T398-R422 PolarHBondContact O-NE 3.46Å; T398-R422 VanDerWaalsContact O-NE 3.15Å |
| 399 | Q | 96.1 | Very high | 96.1 | Very high | 18 Ų | 18 | 48.2 Ų | 48.2 | 8% | 0.084 | 26% | 0.259 | C | S | . | . | S | Bend | trans | 56.3 | 28.8 | 179.7 | -49.3 | -177.3 | -10.6 | 0 | 0 | 113.8 | W346 T396 A397 R422 N423 N424 | W346-Q399 HydrophobicContact CB-CB 4.45Å; W346-Q399 WeakPolarHBondContact CB-O 3.11Å; W346-Q399 HydrophobicContact CD2-CB 3.96Å; W346-Q399 HydrophobicContact CD2-CG 4.1Å; W346-Q399 HydrophobicContact CE3-CB 3.77Å; W346-Q399 HydrophobicContact CE3-CG 3.62Å; W346-Q399 HydrophobicContact CG-CB 4.31Å; W346-Q399 HydrophobicContact CH2-CG 4.02Å; W346-Q399 HydrophobicContact CZ2-CG 4.44Å; W346-Q399 HydrophobicContact CZ3-CB 4.29Å; W346-Q399 HydrophobicContact CZ3-CG 3.61Å; T396-Q399 WeakPolarHBondContact O-CA 3.47Å; T396-Q399 PolarHBondContact O-N 2.85Å; A397-Q399 PolarHBondContact O-N 2.64Å; Q399-R422 HydrophobicContact CB-CG 4.47Å; Q399-N423 VanDerWaalsContact OE1-CA 3.28Å; Q399-N424 PolarHBondContact NE2-OD1 3.07Å |
| 400 | L | 96.6 | Very high | 96 | Very high | 4 Ų | 4 | 53.7 Ų | 53.7 | 2% | 0.021 | 29% | 0.293 | C | S | . | . | B | Isolated β-bridge | trans | -144.8 | 125.9 | 175.8 | -179.7 | 58.6 | 0 | 0 | 0 | 110.1 | T398 L405 F420 R422 L456 V459 | T398-L400 PolarHBondContact O-N 3.4Å; L400-L405 HydrophobicContact CD1-CB 4.11Å; L400-F420 HydrophobicContact CD1-CZ 4.26Å; L400-R422 HydrophobicContact CB-CG 4.3Å; L400-L456 HydrophobicContact CD2-CD1 3.88Å; L400-V459 HydrophobicContact CD2-CG1 4.44Å; L400-V459 HydrophobicContact CG-CB 4.41Å; L400-V459 HydrophobicContact CG-CG1 4.07Å |
| 401 | S | 96.1 | Very high | 96 | Very high | 13 Ų | 13 | 54.3 Ų | 54.3 | 9% | 0.091 | 30% | 0.3 | C | S | . | . | trans | -107.2 | 154.1 | 177.4 | 62.8 | 0 | 0 | 0 | 0 | 110.6 | G345 L347 G404 L405 | G345-S401 PolarHBondContact O-N 2.93Å; G345-S401 PolarHBondContact O-OG 2.92Å; L347-S401 PolarHBondContact N-OG 3.46Å; L347-S401 WeakPolarHBondContact O-CB 3.37Å; L347-S401 PolarHBondContact O-OG 3.01Å; S401-G404 PolarHBondContact O-N 3.43Å; S401-G404 WeakPolarHBondContact OG-CA 3.47Å; S401-G404 PolarHBondContact OG-N 3Å; S401-L405 WeakPolarHBondContact O-CB 3.43Å; S401-L405 PolarHBondContact O-N 3.11Å | ||
| 402 | Y | 95.2 | Very high | 96 | Very high | 133 Ų | 133 | 48.4 Ų | 48.4 | 52% | 0.522 | 27% | 0.273 | S | S | . | . | H | α-helix | trans | -61.7 | -43.1 | 172.8 | -74.4 | -76.2 | 0 | 0 | 0 | 111.6 | L405 C406 V459 E460 | Y402-L405 PolarHBondContact O-N 3.01Å; Y402-C406 PolarHBondContact O-N 3.43Å; Y402-C406 PolarHBondContact O-SG 3.02Å; Y402-V459 HydrophobicContact CD1-CG1 3.9Å; Y402-V459 HydrophobicContact CD2-CG1 4.12Å; Y402-V459 HydrophobicContact CD2-CG2 4.3Å; Y402-V459 HydrophobicContact CE1-CG1 3.99Å; Y402-V459 HydrophobicContact CE1-CG2 4.21Å; Y402-V459 HydrophobicContact CE2-CG1 4.19Å; Y402-V459 HydrophobicContact CE2-CG2 3.63Å; Y402-V459 HydrophobicContact CG-CG1 3.97Å; Y402-E460 PolarHBondContact OH-OE1 3.36Å |
| 403 | H | 96.6 | Very high | 96 | Very high | 53 Ų | 53 | 53.2 Ų | 53.2 | 25% | 0.245 | 29% | 0.294 | C | S | . | . | H | α-helix | trans | -56.7 | -52.4 | 173.9 | 179.5 | -101.9 | 0 | 0 | 0 | 111.7 | V348 D349 P350 L405 C406 E407 | V348-H403 PolarHBondContact O-ND1 2.99Å; D349-H403 HydrophobicContact CB-CB 4.26Å; P350-H403 VanDerWaalsContact CD-CD2 3.43Å; P350-H403 WeakPolarHBondContact CD-CD2 3.44Å; P350-H403 WeakPolarHBondContact CD-NE2 3.35Å; H403-L405 VanDerWaalsContact C-N 3.31Å; H403-L405 PolarHBondContact O-N 3.16Å; H403-C406 PolarHBondContact O-N 3.08Å; H403-C406 VanDerWaalsContact O-N 3.15Å; H403-E407 IonicContact CE1-OE2 3.76Å; H403-E407 PolarHBondContact O-N 3.07Å |
| 404 | G | 97 | Very high | 96 | Very high | 0 Ų | 0 | 56.9 Ų | 56.9 | 0% | 0 | 31% | 0.31 | C | S | . | . | H | α-helix | trans | -63.1 | -31.5 | 178.2 | 0 | 0 | 0 | 0 | 0 | 114 | S401 L408 | S401-G404 PolarHBondContact O-N 3.43Å; S401-G404 WeakPolarHBondContact OG-CA 3.47Å; S401-G404 PolarHBondContact OG-N 3Å; G404-L408 WeakPolarHBondContact O-CB 3.37Å; G404-L408 PolarHBondContact O-N 3.11Å |
| 405 | L | 95.9 | Very high | 96 | Very high | 16 Ų | 16 | 52.1 Ų | 52.1 | 8% | 0.084 | 30% | 0.298 | C | S | . | . | H | α-helix | trans | -68.3 | -41.1 | 172.8 | -178.2 | 60.3 | 0 | 0 | 0 | 112 | L400 S401 Y402 H403 L408 N409 L436 L456 | L400-L405 HydrophobicContact CD1-CB 4.11Å; S401-L405 WeakPolarHBondContact O-CB 3.43Å; S401-L405 PolarHBondContact O-N 3.11Å; Y402-L405 PolarHBondContact O-N 3.01Å; H403-L405 VanDerWaalsContact C-N 3.31Å; H403-L405 PolarHBondContact O-N 3.16Å; L405-L408 PolarHBondContact O-N 2.74Å; L405-N409 PolarHBondContact O-N 2.96Å; L405-L436 HydrophobicContact CD1-CD1 4.04Å; L405-L456 HydrophobicContact CD1-CD2 4.26Å; L405-L456 HydrophobicContact CD1-CG 3.94Å |
| 406 | C | 96.1 | Very high | 96 | Very high | 86 Ų | 86 | 49.8 Ų | 49.8 | 58% | 0.581 | 28% | 0.277 | S | S | * | . | H | α-helix | trans | -66.6 | -42.6 | 174.8 | -70.1 | 0 | 0 | 0 | 0 | 112.2 | Y402 H403 T410 | Y402-C406 PolarHBondContact O-N 3.43Å; Y402-C406 PolarHBondContact O-SG 3.02Å; H403-C406 PolarHBondContact O-N 3.08Å; H403-C406 VanDerWaalsContact O-N 3.15Å; C406-T410 PolarHBondContact O-N 3.49Å; C406-T410 VanDerWaalsContact O-N 3.11Å; C406-T410 PolarHBondContact O-OG1 2.88Å |
| 407 | E | 96.9 | Very high | 96.1 | Very high | 50 Ų | 50 | 49.2 Ų | 49.2 | 23% | 0.234 | 27% | 0.274 | C | S | . | . | H | α-helix | trans | -65.1 | -42.7 | 174.1 | -168.1 | -175.1 | 117.2 | 0 | 0 | 111.1 | G322 V323 L347 H403 N409 T410 T411 | G322-E407 VanDerWaalsContact CA-OE1 3.32Å; G322-E407 WeakPolarHBondContact CA-OE1 3.49Å; V323-E407 HydrophobicContact CG1-CB 3.92Å; V323-E407 HydrophobicContact CG1-CG 4.03Å; V323-E407 HydrophobicContact CG2-CG 4.37Å; V323-E407 PolarHBondContact N-OE1 2.88Å; L347-E407 HydrophobicContact CD2-CB 4.38Å; L347-E407 WeakPolarHBondContact CD2-OE2 3.26Å; H403-E407 IonicContact CE1-OE2 3.76Å; H403-E407 PolarHBondContact O-N 3.07Å; E407-N409 PolarHBondContact O-N 3.06Å; E407-T410 CarbonylContact O-C 3.41Å; E407-T410 WeakPolarHBondContact O-CA 3.46Å; E407-T410 WeakPolarHBondContact O-CB 3.48Å; E407-T410 PolarHBondContact O-N 3.02Å; E407-T411 WeakPolarHBondContact O-CB 3.4Å; E407-T411 PolarHBondContact O-N 3.47Å; E407-T411 PolarHBondContact O-OG1 3.32Å |
| 408 | L | 97.1 | Very high | 96.2 | Very high | 0 Ų | 0 | 46.6 Ų | 46.6 | 0% | 0 | 25% | 0.251 | C | S | . | . | H | α-helix | trans | -61 | -44.3 | 178.9 | -175.9 | 64.3 | 0 | 0 | 0 | 111.4 | V323 Y343 G404 L405 T410 T411 A412 F420 M429 L436 L456 | V323-L408 HydrophobicContact CB-CD1 4.15Å; V323-L408 HydrophobicContact CG1-CB 3.99Å; V323-L408 HydrophobicContact CG1-CD1 4.43Å; V323-L408 HydrophobicContact CG2-CD1 4.38Å; Y343-L408 HydrophobicContact CD1-CD1 3.94Å; Y343-L408 HydrophobicContact CD2-CD1 4.23Å; Y343-L408 HydrophobicContact CG-CD1 3.68Å; G404-L408 WeakPolarHBondContact O-CB 3.37Å; G404-L408 PolarHBondContact O-N 3.11Å; L405-L408 PolarHBondContact O-N 2.74Å; L408-T410 PolarHBondContact O-N 3.38Å; L408-T411 PolarHBondContact O-N 3.24Å; L408-A412 WeakPolarHBondContact O-CB 3.42Å; L408-A412 PolarHBondContact O-N 2.68Å; L408-F420 HydrophobicContact CD2-CD2 3.74Å; L408-F420 HydrophobicContact CD2-CE2 3.44Å; L408-F420 VanDerWaalsContact CD2-CE2 3.44Å; L408-F420 HydrophobicContact CD2-CZ 4.23Å; L408-M429 HydrophobicContact CD1-CE 3.99Å; L408-M429 HydrophobicContact CD2-CE 4.35Å; L408-M429 HydrophobicContact CD2-SD 4Å; L408-M429 HydrophobicContact CG-CE 4.26Å; L408-M429 HydrophobicContact CG-SD 4.43Å; L408-L436 HydrophobicContact CB-CD1 4.19Å; L408-L436 HydrophobicContact CD2-CD1 3.76Å; L408-L436 HydrophobicContact CG-CD1 3.73Å; L408-L456 HydrophobicContact CD2-CD2 4.35Å |
| 409 | N | 95.8 | Very high | 96.4 | Very high | 53 Ų | 53 | 43.4 Ų | 43.4 | 28% | 0.283 | 23% | 0.232 | S | C | . | . | H | α-helix | trans | -70.3 | -16.9 | 174.9 | -165.2 | 27.1 | 0 | 0 | 0 | 112.9 | L405 E407 K431 G434 L436 | L405-N409 PolarHBondContact O-N 2.96Å; E407-N409 PolarHBondContact O-N 3.06Å; N409-K431 WeakPolarHBondContact O-CE 3.47Å; N409-K431 PolarHBondContact O-NZ 3.36Å; N409-K431 WeakPolarHBondContact OD1-CE 3.4Å; N409-G434 PolarHBondContact ND2-O 3.35Å; N409-G434 PolarHBondContact OD1-O 3.05Å; N409-L436 HydrophobicContact CB-CD1 4.01Å; N409-L436 HydrophobicContact CB-CG 4.1Å |
| 410 | T | 95.9 | Very high | 96.5 | Very high | 114 Ų | 114 | 42.6 Ų | 42.6 | 70% | 0.699 | 23% | 0.228 | S | C | * | . | H | α-helix | trans | -81.8 | -49 | 172.4 | -56.7 | 0 | 0 | 0 | 0 | 110.9 | C406 E407 L408 | C406-T410 PolarHBondContact O-N 3.49Å; C406-T410 VanDerWaalsContact O-N 3.11Å; C406-T410 PolarHBondContact O-OG1 2.88Å; E407-T410 CarbonylContact O-C 3.41Å; E407-T410 WeakPolarHBondContact O-CA 3.46Å; E407-T410 WeakPolarHBondContact O-CB 3.48Å; E407-T410 PolarHBondContact O-N 3.02Å; L408-T410 PolarHBondContact O-N 3.38Å |
| 411 | T | 96.6 | Very high | 96.5 | Very high | 60 Ų | 60 | 43.1 Ų | 43.1 | 37% | 0.368 | 23% | 0.23 | S | C | . | . | H | α-helix | trans | -78 | -33.4 | -172.8 | -61.9 | 0 | 0 | 0 | 0 | 113.8 | V323 Y343 E407 L408 | V323-T411 HydrophobicContact CG2-CG2 3.8Å; Y343-T411 HydrophobicContact CE1-CG2 4.05Å; E407-T411 WeakPolarHBondContact O-CB 3.4Å; E407-T411 PolarHBondContact O-N 3.47Å; E407-T411 PolarHBondContact O-OG1 3.32Å; L408-T411 PolarHBondContact O-N 3.24Å |
| 412 | A | 96.3 | Very high | 96.4 | Very high | 4 Ų | 4 | 44.8 Ų | 44.8 | 3% | 0.033 | 24% | 0.235 | C | C | . | . | S | Bend | trans | -66 | 135.5 | 176.3 | 0 | 0 | 0 | 0 | 0 | 111.1 | Y343 L408 M429 K431 L436 | Y343-A412 HydrophobicContact CE2-CB 4.46Å; L408-A412 WeakPolarHBondContact O-CB 3.42Å; L408-A412 PolarHBondContact O-N 2.68Å; A412-M429 HydrophobicContact CB-CE 4.4Å; A412-K431 HydrophobicContact CB-CB 4.45Å; A412-K431 HydrophobicContact CB-CD 4.12Å; A412-K431 WeakPolarHBondContact O-CD 3.48Å; A412-K431 PolarHBondContact O-NZ 3.46Å; A412-L436 HydrophobicContact CB-CD2 4.04Å |
| 413 | K | 96.9 | Very high | 96.3 | Very high | 114 Ų | 114 | 43.4 Ų | 43.4 | 50% | 0.496 | 24% | 0.236 | S | C | . | . | P | Polyproline II helix | trans | -84.8 | 140.6 | -178.6 | -52 | -177.3 | -151.8 | 76 | 0 | 111.2 | G415 E416 | K413-G415 PolarHBondContact O-N 3.47Å; K413-E416 HydrophobicContact CB-CB 3.87Å; K413-E416 WeakPolarHBondContact CB-OE2 3.47Å; K413-E416 WeakPolarHBondContact CD-OE2 3.49Å; K413-E416 VanDerWaalsContact CG-OE2 3.28Å; K413-E416 WeakPolarHBondContact CG-OE2 3.48Å; K413-E416 IonicContact NZ-OE1 3.54Å; K413-E416 PolarHBondContact NZ-OE1 3.04Å; K413-E416 IonicContact NZ-OE2 3.57Å; K413-E416 PolarHBondContact NZ-OE2 3.46Å; K413-E416 WeakPolarHBondContact O-CB 3.41Å; K413-E416 PolarHBondContact O-N 2.94Å; K413-E416 VanDerWaalsContact O-N 3.1Å |
| 414 | E | 97.4 | Very high | 96 | Very high | 103 Ų | 103 | 46.5 Ų | 46.5 | 48% | 0.481 | 25% | 0.254 | S | S | . | . | B | Isolated β-bridge | trans | -57.7 | 124.1 | 176.9 | -179.6 | 60.8 | -148.5 | 0 | 0 | 111.1 | E416 H432 K433 G434 | E414-E416 VanDerWaalsContact C-N 3.27Å; E414-E416 PolarHBondContact O-N 3.22Å; E414-H432 VanDerWaalsContact OE1-CA 3.31Å; E414-H432 WeakPolarHBondContact OE1-CA 3.39Å; E414-K433 VanDerWaalsContact CD-N 3.28Å; E414-K433 PolarHBondContact OE1-N 2.88Å; E414-K433 PolarHBondContact OE2-N 3.47Å; E414-K433 VanDerWaalsContact OE2-N 3.1Å; E414-G434 PolarHBondContact OE2-N 3.38Å; E414-G434 VanDerWaalsContact OE2-N 3.08Å |
| 415 | G | 95.4 | Very high | 95.8 | Very high | 38 Ų | 38 | 48.9 Ų | 48.9 | 39% | 0.392 | 27% | 0.266 | S | S | . | . | T | Hydrogen-bonded Turn | trans | 76 | 0.2 | -177.8 | 0 | 0 | 0 | 0 | 0 | 116.3 | K413 K431 | K413-G415 PolarHBondContact O-N 3.47Å; G415-K431 WeakPolarHBondContact CA-O 3.42Å; G415-K431 PolarHBondContact N-O 3.21Å |
| 416 | E | 95.4 | Very high | 95.7 | Very high | 41 Ų | 41 | 48.5 Ų | 48.5 | 19% | 0.192 | 26% | 0.263 | C | S | . | . | trans | -82.4 | 127.1 | 177.7 | -173 | 171.7 | -125.9 | 0 | 0 | 111.1 | P341 K413 E414 | P341-E416 HydrophobicContact CG-CG 4.28Å; K413-E416 HydrophobicContact CB-CB 3.87Å; K413-E416 WeakPolarHBondContact CB-OE2 3.47Å; K413-E416 WeakPolarHBondContact CD-OE2 3.49Å; K413-E416 VanDerWaalsContact CG-OE2 3.28Å; K413-E416 WeakPolarHBondContact CG-OE2 3.48Å; K413-E416 IonicContact NZ-OE1 3.54Å; K413-E416 PolarHBondContact NZ-OE1 3.04Å; K413-E416 IonicContact NZ-OE2 3.57Å; K413-E416 PolarHBondContact NZ-OE2 3.46Å; K413-E416 WeakPolarHBondContact O-CB 3.41Å; K413-E416 PolarHBondContact O-N 2.94Å; K413-E416 VanDerWaalsContact O-N 3.1Å; E414-E416 VanDerWaalsContact C-N 3.27Å; E414-E416 PolarHBondContact O-N 3.22Å | ||
| 417 | I | 97.1 | Very high | 95.7 | Very high | 8 Ų | 8 | 45.2 Ų | 45.2 | 4% | 0.041 | 24% | 0.241 | C | C | . | . | E | Extended strand (participates in β ladder) | trans | -90.1 | 128.6 | 174.7 | -47.4 | -177 | 0 | 0 | 0 | 108.6 | W227 T251 L254 R255 T428 M429 I430 | W227-I417 HydrophobicContact CZ2-CD1 4.02Å; T251-I417 HydrophobicContact CG2-CB 4.3Å; T251-I417 HydrophobicContact CG2-CG2 3.86Å; L254-I417 HydrophobicContact CB-CD1 3.48Å; L254-I417 VanDerWaalsContact CB-CD1 3.48Å; L254-I417 HydrophobicContact CD1-CD1 4.34Å; R255-I417 HydrophobicContact CG-CD1 4.31Å; R255-I417 PolarHBondContact NH2-O 2.62Å; I417-T428 HydrophobicContact CG2-CG2 3.5Å; I417-M429 WeakPolarHBondContact CA-O 3.33Å; I417-I430 HydrophobicContact CG1-CD1 3.91Å; I417-I430 HydrophobicContact CG1-CG1 4.11Å |
| 418 | S | 97.6 | Very high | 95.7 | Very high | 3 Ų | 3 | 42.9 Ų | 42.9 | 2% | 0.021 | 23% | 0.231 | C | C | . | . | E | Extended strand (participates in β ladder) | trans | -137 | 175.9 | -172.5 | 53.4 | 0 | 0 | 0 | 0 | 110.3 | P341 M429 | P341-S418 WeakPolarHBondContact O-CA 3.32Å; P341-S418 WeakPolarHBondContact O-CB 3.4Å; S418-M429 PolarHBondContact N-O 3.24Å; S418-M429 PolarHBondContact O-N 3.38Å; S418-M429 WeakPolarHBondContact OG-CE 3.48Å; S418-M429 PolarHBondContact OG-O 3.48Å |
| 419 | V | 97.6 | Very high | 95.8 | Very high | 0 Ų | 0 | 42.9 Ų | 42.9 | 0% | 0 | 23% | 0.231 | C | C | . | . | E | Extended strand (participates in β ladder) | trans | -112.7 | 137.4 | 168.4 | 174.9 | 0 | 0 | 0 | 0 | 108.9 | A247 F335 I340 P341 L342 Y343 F426 S427 | A247-V419 HydrophobicContact CB-CG1 3.89Å; A247-V419 HydrophobicContact CB-CG2 3.93Å; F335-V419 HydrophobicContact CD1-CB 4.43Å; F335-V419 HydrophobicContact CE1-CB 3.9Å; F335-V419 HydrophobicContact CE1-CG1 4.02Å; F335-V419 HydrophobicContact CE1-CG2 4.04Å; I340-V419 HydrophobicContact CG2-CB 4.35Å; I340-V419 HydrophobicContact CG2-CG2 3.79Å; P341-V419 PolarHBondContact O-N 3.24Å; L342-V419 CarbonylContact C-O 3.57Å; L342-V419 WeakPolarHBondContact CA-O 3.42Å; L342-V419 HydrophobicContact CD1-CB 4.09Å; L342-V419 HydrophobicContact CD1-CG1 3.84Å; Y343-V419 PolarHBondContact N-O 3.34Å; V419-F426 HydrophobicContact CG1-CB 4.05Å; V419-F426 HydrophobicContact CG1-CD1 3.89Å; V419-F426 HydrophobicContact CG1-CG 4.48Å; V419-S427 WeakPolarHBondContact CA-O 3.42Å |
| 420 | F | 97.5 | Very high | 95.9 | Very high | 1 Ų | 1 | 40.6 Ų | 40.6 | 0% | 0.004 | 22% | 0.218 | C | C | . | . | E | Extended strand (participates in β ladder) | trans | -119.1 | 126.2 | -178.3 | 173.4 | -114.5 | 0 | 0 | 0 | 109.6 | Y343 L400 L408 R422 S427 M429 L438 L456 | Y343-F420 CarbonylContact O-C 3.51Å; Y343-F420 WeakPolarHBondContact O-CA 3.46Å; L400-F420 HydrophobicContact CD1-CZ 4.26Å; L408-F420 HydrophobicContact CD2-CD2 3.74Å; L408-F420 HydrophobicContact CD2-CE2 3.44Å; L408-F420 VanDerWaalsContact CD2-CE2 3.44Å; L408-F420 HydrophobicContact CD2-CZ 4.23Å; F420-R422 HydrophobicContact CD1-CB 4.22Å; F420-R422 HydrophobicContact CE1-CB 3.53Å; F420-R422 HydrophobicContact CE1-CG 4.26Å; F420-R422 HydrophobicContact CZ-CB 3.83Å; F420-R422 HydrophobicContact CZ-CG 4.4Å; F420-S427 PolarHBondContact N-O 2.91Å; F420-S427 PolarHBondContact O-N 2.9Å; F420-M429 HydrophobicContact CB-CB 3.86Å; F420-M429 HydrophobicContact CB-CE 4.49Å; F420-M429 HydrophobicContact CB-SD 4.06Å; F420-M429 HydrophobicContact CD2-SD 4.38Å; F420-M429 HydrophobicContact CG-SD 4.21Å; F420-L438 HydrophobicContact CB-CD2 4.21Å; F420-L438 HydrophobicContact CD1-CD1 4.18Å; F420-L438 HydrophobicContact CD1-CD2 3.7Å; F420-L438 HydrophobicContact CE1-CD1 4.36Å; F420-L438 HydrophobicContact CE1-CD2 4.49Å; F420-L438 HydrophobicContact CG-CD2 4.29Å; F420-L456 HydrophobicContact CD1-CD2 4.21Å; F420-L456 HydrophobicContact CE1-CD2 3.74Å; F420-L456 HydrophobicContact CZ-CD2 3.91Å |
| 421 | F | 96.1 | Very high | 95.9 | Very high | 16 Ų | 16 | 36.5 Ų | 36.5 | 7% | 0.07 | 19% | 0.191 | C | C | . | . | E | Extended strand (participates in β ladder) | trans | -98 | 125 | 176.4 | 178.1 | -101.1 | 0 | 0 | 0 | 110.6 | V316 V318 F326 Y343 H425 F426 | V316-F421 HydrophobicContact CG2-CD1 4.1Å; V316-F421 HydrophobicContact CG2-CD2 3.75Å; V316-F421 HydrophobicContact CG2-CE1 3.92Å; V316-F421 HydrophobicContact CG2-CE2 3.54Å; V316-F421 HydrophobicContact CG2-CG 4.01Å; V316-F421 HydrophobicContact CG2-CZ 3.64Å; V318-F421 HydrophobicContact CG1-CD1 4.19Å; V318-F421 HydrophobicContact CG1-CE1 4.39Å; F326-F421 HydrophobicContact CZ-CB 4.42Å; Y343-F421 PolarHBondContact O-N 3.03Å; F421-H425 WeakPolarHBondContact CA-O 3.13Å; F421-F426 HydrophobicContact CB-CD1 4.34Å; F421-F426 HydrophobicContact CB-CE1 4.22Å; F421-F426 HydrophobicContact CD2-CD1 4.08Å; F421-F426 HydrophobicContact CD2-CD2 4.04Å; F421-F426 AromaticContact CD2-CE1 3.7Å; F421-F426 HydrophobicContact CD2-CE1 3.7Å; F421-F426 AromaticContact CD2-CE2 3.65Å; F421-F426 HydrophobicContact CD2-CE2 3.65Å; F421-F426 HydrophobicContact CD2-CG 4.25Å; F421-F426 AromaticContact CD2-CZ 3.47Å; F421-F426 HydrophobicContact CD2-CZ 3.47Å; F421-F426 VanDerWaalsContact CD2-CZ 3.47Å; F421-F426 HydrophobicContact CE2-CD2 4.45Å; F421-F426 AromaticContact CE2-CE2 3.82Å; F421-F426 HydrophobicContact CE2-CE2 3.82Å; F421-F426 AromaticContact CE2-CZ 3.88Å; F421-F426 HydrophobicContact CE2-CZ 3.88Å; F421-F426 HydrophobicContact CG-CE1 4.32Å; F421-F426 HydrophobicContact CG-CZ 4.42Å |
| 422 | R | 94.9 | Very high | 95.9 | Very high | 48 Ų | 48 | 35.4 Ų | 35.4 | 18% | 0.181 | 18% | 0.181 | C | C | . | . | E | Extended strand (participates in β ladder) | trans | -157.9 | 139.8 | 176.1 | -178.6 | -173 | 176.3 | -165.2 | 0.4 | 110.3 | T398 Q399 L400 F420 N424 H425 V459 | T398-R422 VanDerWaalsContact O-CG 3.29Å; T398-R422 WeakPolarHBondContact O-CG 3.43Å; T398-R422 PolarHBondContact O-NE 3.46Å; T398-R422 VanDerWaalsContact O-NE 3.15Å; Q399-R422 HydrophobicContact CB-CG 4.47Å; L400-R422 HydrophobicContact CB-CG 4.3Å; F420-R422 HydrophobicContact CD1-CB 4.22Å; F420-R422 HydrophobicContact CE1-CB 3.53Å; F420-R422 HydrophobicContact CE1-CG 4.26Å; F420-R422 HydrophobicContact CZ-CB 3.83Å; F420-R422 HydrophobicContact CZ-CG 4.4Å; R422-N424 VanDerWaalsContact C-N 3.3Å; R422-N424 PolarHBondContact O-N 3.1Å; R422-H425 PolarHBondContact N-O 2.81Å; R422-H425 WeakPolarHBondContact O-CA 3.4Å; R422-H425 WeakPolarHBondContact O-CB 3.34Å; R422-H425 PolarHBondContact O-N 2.88Å; R422-V459 PolarHBondContact NH2-O 2.75Å |
| 423 | N | 92.2 | Very high | 95.9 | Very high | 104 Ų | 104 | 42.8 Ų | 42.8 | 56% | 0.556 | 21% | 0.213 | S | C | * | . | T | Hydrogen-bonded Turn | trans | 50.5 | 47.7 | 177.2 | -166.8 | 33.5 | 0 | 0 | 0 | 112.6 | Q399 H425 | Q399-N423 VanDerWaalsContact OE1-CA 3.28Å; N423-H425 PolarHBondContact O-N 3.21Å; N423-H425 VanDerWaalsContact O-N 3.08Å |
| 424 | N | 90.4 | Very high | 95.7 | Very high | 117 Ų | 117 | 38.7 Ų | 38.7 | 63% | 0.626 | 20% | 0.203 | S | C | * | . | T | Hydrogen-bonded Turn | trans | 58.7 | 15.6 | -175.5 | -53 | -28.8 | 0 | 0 | 0 | 115.1 | Q399 R422 | Q399-N424 PolarHBondContact NE2-OD1 3.07Å; R422-N424 VanDerWaalsContact C-N 3.3Å; R422-N424 PolarHBondContact O-N 3.1Å |
| 425 | H | 92.1 | Very high | 95.6 | Very high | 51 Ų | 51 | 39 Ų | 39 | 24% | 0.236 | 20% | 0.204 | C | C | . | . | E | Extended strand (participates in β ladder) | trans | -117.5 | 146.8 | -177.6 | -174.8 | -89 | 0 | 0 | 0 | 111.8 | Q237 C243 F421 R422 N423 S427 | Q237-H425 PolarHBondContact NE2-NE2 2.93Å; Q237-H425 PolarHBondContact OE1-NE2 2.86Å; C243-H425 VanDerWaalsContact CB-NE2 3.29Å; C243-H425 WeakPolarHBondContact CB-NE2 3.27Å; F421-H425 WeakPolarHBondContact CA-O 3.13Å; R422-H425 PolarHBondContact N-O 2.81Å; R422-H425 WeakPolarHBondContact O-CA 3.4Å; R422-H425 WeakPolarHBondContact O-CB 3.34Å; R422-H425 PolarHBondContact O-N 2.88Å; N423-H425 PolarHBondContact O-N 3.21Å; N423-H425 VanDerWaalsContact O-N 3.08Å; H425-S427 PolarHBondContact CE1-OG 3.11Å; H425-S427 PolarHBondContact ND1-OG 3.36Å |
| 426 | F | 94.5 | Very high | 95.6 | Very high | 7 Ų | 7 | 37.4 Ų | 37.4 | 3% | 0.031 | 19% | 0.187 | C | C | . | . | E | Extended strand (participates in β ladder) | trans | -109.6 | 117.2 | 175.9 | -66.3 | -97.3 | 0 | 0 | 0 | 110.5 | C243 P244 A247 L314 V316 L342 V419 F421 | C243-F426 HydrophobicContact CB-CB 4.42Å; C243-F426 PolarHBondContact SG-N 3.4Å; C243-F426 VanDerWaalsContact SG-N 3.43Å; P244-F426 HydrophobicContact CB-CD2 4.18Å; P244-F426 HydrophobicContact CB-CG 4.38Å; P244-F426 HydrophobicContact CG-CD2 3.72Å; P244-F426 HydrophobicContact CG-CE2 3.98Å; P244-F426 HydrophobicContact CG-CG 4.38Å; A247-F426 HydrophobicContact CB-CB 4.04Å; L314-F426 HydrophobicContact CB-CE2 3.95Å; L314-F426 HydrophobicContact CB-CZ 3.92Å; L314-F426 HydrophobicContact CD2-CE1 4.02Å; L314-F426 HydrophobicContact CD2-CZ 3.88Å; L314-F426 HydrophobicContact CG-CZ 4.35Å; V316-F426 HydrophobicContact CB-CZ 4.44Å; V316-F426 HydrophobicContact CG1-CE1 4.12Å; V316-F426 HydrophobicContact CG1-CZ 3.8Å; V316-F426 HydrophobicContact CG2-CE1 4.36Å; V316-F426 HydrophobicContact CG2-CZ 3.72Å; L342-F426 HydrophobicContact CD1-CD1 4.18Å; L342-F426 HydrophobicContact CD1-CE1 4.14Å; V419-F426 HydrophobicContact CG1-CB 4.05Å; V419-F426 HydrophobicContact CG1-CD1 3.89Å; V419-F426 HydrophobicContact CG1-CG 4.48Å; F421-F426 HydrophobicContact CB-CD1 4.34Å; F421-F426 HydrophobicContact CB-CE1 4.22Å; F421-F426 HydrophobicContact CD2-CD1 4.08Å; F421-F426 HydrophobicContact CD2-CD2 4.04Å; F421-F426 AromaticContact CD2-CE1 3.7Å; F421-F426 HydrophobicContact CD2-CE1 3.7Å; F421-F426 AromaticContact CD2-CE2 3.65Å; F421-F426 HydrophobicContact CD2-CE2 3.65Å; F421-F426 HydrophobicContact CD2-CG 4.25Å; F421-F426 AromaticContact CD2-CZ 3.47Å; F421-F426 HydrophobicContact CD2-CZ 3.47Å; F421-F426 VanDerWaalsContact CD2-CZ 3.47Å; F421-F426 HydrophobicContact CE2-CD2 4.45Å; F421-F426 AromaticContact CE2-CE2 3.82Å; F421-F426 HydrophobicContact CE2-CE2 3.82Å; F421-F426 AromaticContact CE2-CZ 3.88Å; F421-F426 HydrophobicContact CE2-CZ 3.88Å; F421-F426 HydrophobicContact CG-CE1 4.32Å; F421-F426 HydrophobicContact CG-CZ 4.42Å |
| 427 | S | 95.4 | Very high | 95.7 | Very high | 18 Ų | 18 | 36.6 Ų | 36.6 | 13% | 0.126 | 18% | 0.182 | C | C | . | . | E | Extended strand (participates in β ladder) | trans | -114.2 | 138.8 | 179.9 | -62 | 0 | 0 | 0 | 0 | 111 | V419 F420 H425 M429 | V419-S427 WeakPolarHBondContact CA-O 3.42Å; F420-S427 PolarHBondContact N-O 2.91Å; F420-S427 PolarHBondContact O-N 2.9Å; H425-S427 PolarHBondContact CE1-OG 3.11Å; H425-S427 PolarHBondContact ND1-OG 3.36Å; S427-M429 PolarHBondContact O-N 2.93Å |
| 428 | T | 97.8 | Very high | 95.8 | Very high | 1 Ų | 1 | 37 Ų | 37 | 1% | 0.006 | 18% | 0.184 | C | C | . | . | E | Extended strand (participates in β ladder) | trans | -67.7 | 124.1 | 167 | -56.1 | 0 | 0 | 0 | 0 | 109.2 | A247 N250 T251 L254 I417 L438 L439 | A247-T428 WeakPolarHBondContact CA-OG1 3.38Å; A247-T428 PolarHBondContact O-OG1 2.74Å; N250-T428 WeakPolarHBondContact CB-OG1 3.13Å; T251-T428 WeakPolarHBondContact OG1-CG2 3.37Å; L254-T428 HydrophobicContact CD1-CG2 4.09Å; I417-T428 HydrophobicContact CG2-CG2 3.5Å; T428-L438 WeakPolarHBondContact O-CA 3.5Å; T428-L439 HydrophobicContact CG2-CB 4.45Å; T428-L439 HydrophobicContact CG2-CD2 4.49Å; T428-L439 PolarHBondContact O-N 3.26Å |
| 429 | M | 98.1 | Very high | 95.7 | Very high | 0 Ų | 0 | 37.1 Ų | 37.1 | 0% | 0 | 19% | 0.185 | C | C | . | . | E | Extended strand (participates in β ladder) | trans | -116.7 | 145.3 | -178.8 | -175.2 | -179.2 | 69.3 | 0 | 0 | 111.5 | Y343 L408 A412 I417 S418 F420 S427 L436 Y437 L438 L456 | Y343-M429 HydrophobicContact CD2-CE 3.69Å; Y343-M429 HydrophobicContact CE2-CE 4.28Å; Y343-M429 HydrophobicContact CG-CE 4.42Å; L408-M429 HydrophobicContact CD1-CE 3.99Å; L408-M429 HydrophobicContact CD2-CE 4.35Å; L408-M429 HydrophobicContact CD2-SD 4Å; L408-M429 HydrophobicContact CG-CE 4.26Å; L408-M429 HydrophobicContact CG-SD 4.43Å; A412-M429 HydrophobicContact CB-CE 4.4Å; I417-M429 WeakPolarHBondContact CA-O 3.33Å; S418-M429 PolarHBondContact N-O 3.24Å; S418-M429 PolarHBondContact O-N 3.38Å; S418-M429 WeakPolarHBondContact OG-CE 3.48Å; S418-M429 PolarHBondContact OG-O 3.48Å; F420-M429 HydrophobicContact CB-CB 3.86Å; F420-M429 HydrophobicContact CB-CE 4.49Å; F420-M429 HydrophobicContact CB-SD 4.06Å; F420-M429 HydrophobicContact CD2-SD 4.38Å; F420-M429 HydrophobicContact CG-SD 4.21Å; S427-M429 PolarHBondContact O-N 2.93Å; M429-L436 HydrophobicContact CE-CD2 4.46Å; M429-L436 HydrophobicContact SD-CB 4.47Å; M429-L436 HydrophobicContact SD-CD1 4.3Å; M429-L436 HydrophobicContact SD-CD2 4.13Å; M429-Y437 CarbonylContact C-O 3.51Å; M429-Y437 VanDerWaalsContact CA-O 3.3Å; M429-Y437 WeakPolarHBondContact CA-O 3.45Å; M429-Y437 WeakPolarHBondContact CG-O 3.43Å; M429-L438 HydrophobicContact CB-CD2 3.74Å; M429-L438 HydrophobicContact CG-CD2 3.83Å; M429-L438 HydrophobicContact SD-CD2 4.38Å; M429-L456 HydrophobicContact SD-CD2 4.37Å |
| 430 | I | 97.9 | Very high | 95.7 | Very high | 4 Ų | 4 | 37.5 Ų | 37.5 | 2% | 0.021 | 19% | 0.187 | C | C | . | . | E | Extended strand (participates in β ladder) | trans | -136.3 | 146.4 | 167.2 | -164.5 | -179.6 | 0 | 0 | 0 | 110.4 | W227 I417 Y437 W453 F470 | W227-I430 HydrophobicContact CH2-CD1 3.71Å; W227-I430 HydrophobicContact CZ2-CD1 4.09Å; I417-I430 HydrophobicContact CG1-CD1 3.91Å; I417-I430 HydrophobicContact CG1-CG1 4.11Å; I430-Y437 PolarHBondContact N-O 2.79Å; I430-Y437 PolarHBondContact O-N 2.93Å; I430-W453 HydrophobicContact CB-CH2 4.06Å; I430-W453 HydrophobicContact CB-CZ3 4.17Å; I430-W453 HydrophobicContact CG2-CD2 4.19Å; I430-W453 HydrophobicContact CG2-CE3 3.8Å; I430-W453 HydrophobicContact CG2-CH2 3.53Å; I430-W453 HydrophobicContact CG2-CZ2 3.91Å; I430-W453 HydrophobicContact CG2-CZ3 3.47Å; I430-W453 VanDerWaalsContact CG2-CZ3 3.47Å; I430-F470 HydrophobicContact CD1-CZ 4.18Å; I430-F470 HydrophobicContact CG2-CE1 3.59Å; I430-F470 HydrophobicContact CG2-CZ 3.65Å |
| 431 | K | 97.4 | Very high | 95.5 | Very high | 28 Ų | 28 | 38.1 Ų | 38.1 | 12% | 0.122 | 19% | 0.191 | C | C | . | . | E | Extended strand (participates in β ladder) | trans | -96.8 | 131.4 | 167.2 | -175.9 | 175.7 | 169.6 | 179.1 | 0 | 110.3 | N409 A412 G415 H435 L436 | N409-K431 WeakPolarHBondContact O-CE 3.47Å; N409-K431 PolarHBondContact O-NZ 3.36Å; N409-K431 WeakPolarHBondContact OD1-CE 3.4Å; A412-K431 HydrophobicContact CB-CB 4.45Å; A412-K431 HydrophobicContact CB-CD 4.12Å; A412-K431 WeakPolarHBondContact O-CD 3.48Å; A412-K431 PolarHBondContact O-NZ 3.46Å; G415-K431 WeakPolarHBondContact CA-O 3.42Å; G415-K431 PolarHBondContact N-O 3.21Å; K431-H435 CarbonylContact C-O 3.53Å; K431-H435 WeakPolarHBondContact CA-O 3.21Å; K431-L436 HydrophobicContact CB-CD2 3.91Å; K431-L436 HydrophobicContact CD-CD2 4.32Å; K431-L436 HydrophobicContact CG-CD2 4.1Å |
| 432 | H | 96.7 | Very high | 95.4 | Very high | 38 Ų | 38 | 40.7 Ų | 40.7 | 18% | 0.176 | 21% | 0.205 | C | C | . | . | E | Extended strand (participates in β ladder) | trans | -141.1 | 127.8 | 175.7 | 171.7 | -112.9 | 0 | 0 | 0 | 111.1 | E414 G434 H435 Y437 F470 | E414-H432 VanDerWaalsContact OE1-CA 3.31Å; E414-H432 WeakPolarHBondContact OE1-CA 3.39Å; H432-G434 PolarHBondContact O-N 3.3Å; H432-H435 PolarHBondContact N-O 3.1Å; H432-H435 PolarHBondContact O-N 3.48Å; H432-Y437 HydrophobicContact CB-CD2 4.14Å; H432-Y437 HydrophobicContact CB-CE2 3.97Å; H432-F470 HydrophobicContact CB-CD1 4.19Å; H432-F470 HydrophobicContact CB-CD2 4.08Å; H432-F470 HydrophobicContact CB-CE1 4.19Å; H432-F470 HydrophobicContact CB-CE2 4.09Å; H432-F470 HydrophobicContact CB-CG 4.13Å; H432-F470 HydrophobicContact CB-CZ 4.16Å; H432-F470 AromaticContact CE1-CD2 3.5Å; H432-F470 VanDerWaalsContact CE1-CD2 3.5Å; H432-F470 WeakPolarHBondContact CE1-CD2 3.37Å; H432-F470 AromaticContact CE1-CG 3.76Å; H432-F470 AromaticContact CG-CD2 3.56Å; H432-F470 AromaticContact CG-CE2 3.93Å; H432-F470 AromaticContact CG-CG 3.8Å; H432-F470 WeakPolarHBondContact ND1-CB 3.4Å; H432-F470 AromaticContact ND1-CD2 3.26Å; H432-F470 VanDerWaalsContact ND1-CD2 3.26Å; H432-F470 WeakPolarHBondContact ND1-CD2 3.46Å; H432-F470 AromaticContact ND1-CG 3.21Å; H432-F470 WeakPolarHBondContact ND1-CG 3.27Å; H432-F470 AromaticContact NE2-CD2 3.99Å |
| 433 | K | 94.8 | Very high | 95.2 | Very high | 158 Ų | 158 | 42.1 Ų | 42.1 | 69% | 0.687 | 21% | 0.214 | S | C | * | . | T | Hydrogen-bonded Turn | trans | 51.6 | 37.2 | -176.5 | -65.7 | 172.9 | -176.8 | 167.3 | 0 | 113.3 | E414 H435 | E414-K433 VanDerWaalsContact CD-N 3.28Å; E414-K433 PolarHBondContact OE1-N 2.88Å; E414-K433 PolarHBondContact OE2-N 3.47Å; E414-K433 VanDerWaalsContact OE2-N 3.1Å; K433-H435 VanDerWaalsContact C-N 3.3Å; K433-H435 PolarHBondContact O-CD2 2.94Å; K433-H435 PolarHBondContact O-N 3.19Å |
| 434 | G | 93.1 | Very high | 95.1 | Very high | 29 Ų | 29 | 40.3 Ų | 40.3 | 30% | 0.299 | 22% | 0.22 | S | C | . | . | T | Hydrogen-bonded Turn | trans | 74.4 | 13.3 | -178 | 0 | 0 | 0 | 0 | 0 | 115.5 | N409 E414 H432 | N409-G434 PolarHBondContact ND2-O 3.35Å; N409-G434 PolarHBondContact OD1-O 3.05Å; E414-G434 PolarHBondContact OE2-N 3.38Å; E414-G434 VanDerWaalsContact OE2-N 3.08Å; H432-G434 PolarHBondContact O-N 3.3Å |
| 435 | H | 94.9 | Very high | 95.1 | Very high | 109 Ų | 109 | 37.5 Ų | 37.5 | 51% | 0.505 | 20% | 0.202 | S | C | . | . | E | Extended strand (participates in β ladder) | trans | -115.1 | 146.9 | 170.5 | -59.4 | -79.9 | 0 | 0 | 0 | 110.4 | K431 H432 K433 Y437 | K431-H435 CarbonylContact C-O 3.53Å; K431-H435 WeakPolarHBondContact CA-O 3.21Å; H432-H435 PolarHBondContact N-O 3.1Å; H432-H435 PolarHBondContact O-N 3.48Å; K433-H435 VanDerWaalsContact C-N 3.3Å; K433-H435 PolarHBondContact O-CD2 2.94Å; K433-H435 PolarHBondContact O-N 3.19Å; H435-Y437 HydrophobicContact CB-CE2 3.77Å |
| 436 | L | 97.1 | Very high | 95.1 | Very high | 4 Ų | 4 | 36.8 Ų | 36.8 | 2% | 0.021 | 20% | 0.2 | C | C | . | . | E | Extended strand (participates in β ladder) | trans | -91.7 | 143.6 | 175.7 | -61.1 | 176.6 | 0 | 0 | 0 | 110.7 | L405 L408 N409 A412 M429 K431 L456 | L405-L436 HydrophobicContact CD1-CD1 4.04Å; L408-L436 HydrophobicContact CB-CD1 4.19Å; L408-L436 HydrophobicContact CD2-CD1 3.76Å; L408-L436 HydrophobicContact CG-CD1 3.73Å; N409-L436 HydrophobicContact CB-CD1 4.01Å; N409-L436 HydrophobicContact CB-CG 4.1Å; A412-L436 HydrophobicContact CB-CD2 4.04Å; M429-L436 HydrophobicContact CE-CD2 4.46Å; M429-L436 HydrophobicContact SD-CB 4.47Å; M429-L436 HydrophobicContact SD-CD1 4.3Å; M429-L436 HydrophobicContact SD-CD2 4.13Å; K431-L436 HydrophobicContact CB-CD2 3.91Å; K431-L436 HydrophobicContact CD-CD2 4.32Å; K431-L436 HydrophobicContact CG-CD2 4.1Å; L436-L456 HydrophobicContact CB-CB 4.02Å; L436-L456 HydrophobicContact CB-CD2 4.44Å; L436-L456 HydrophobicContact CD1-CD2 4.3Å; L436-L456 PolarHBondContact O-N 3.49Å |
| 437 | Y | 97.6 | Very high | 94.9 | Very high | 24 Ų | 24 | 44.4 Ų | 44.4 | 9% | 0.094 | 24% | 0.236 | C | C | . | . | E | Extended strand (participates in β ladder) | trans | -137.1 | 137.4 | 178.9 | -64.2 | -87.5 | 0 | 0 | 0 | 111.5 | M429 I430 H432 H435 W453 E454 F470 | M429-Y437 CarbonylContact C-O 3.51Å; M429-Y437 VanDerWaalsContact CA-O 3.3Å; M429-Y437 WeakPolarHBondContact CA-O 3.45Å; M429-Y437 WeakPolarHBondContact CG-O 3.43Å; I430-Y437 PolarHBondContact N-O 2.79Å; I430-Y437 PolarHBondContact O-N 2.93Å; H432-Y437 HydrophobicContact CB-CD2 4.14Å; H432-Y437 HydrophobicContact CB-CE2 3.97Å; H435-Y437 HydrophobicContact CB-CE2 3.77Å; Y437-W453 HydrophobicContact CD1-CB 4.15Å; Y437-W453 HydrophobicContact CG-CB 4.47Å; Y437-E454 CarbonylContact C-O 3.59Å; Y437-E454 WeakPolarHBondContact CA-O 3.45Å; Y437-F470 AromaticContact CD1-CD1 3.93Å; Y437-F470 HydrophobicContact CD1-CD1 3.93Å; Y437-F470 AromaticContact CD2-CD1 3.55Å; Y437-F470 HydrophobicContact CD2-CD1 3.55Å; Y437-F470 AromaticContact CD2-CE1 3.81Å; Y437-F470 HydrophobicContact CD2-CE1 3.81Å; Y437-F470 HydrophobicContact CE1-CD1 4.07Å; Y437-F470 HydrophobicContact CE2-CB 4.43Å; Y437-F470 AromaticContact CE2-CD1 3.71Å; Y437-F470 HydrophobicContact CE2-CD1 3.71Å; Y437-F470 HydrophobicContact CE2-CE1 4.38Å; Y437-F470 HydrophobicContact CE2-CG 4.33Å; Y437-F470 AromaticContact CG-CD1 3.66Å; Y437-F470 HydrophobicContact CG-CD1 3.66Å; Y437-F470 AromaticContact CG-CE1 3.87Å; Y437-F470 HydrophobicContact CG-CE1 3.87Å; Y437-F470 AromaticContact CZ-CD1 3.96Å |
| 438 | L | 97.3 | Very high | 94.7 | Very high | 17 Ų | 17 | 47 Ų | 47 | 9% | 0.089 | 25% | 0.246 | C | C | . | . | E | Extended strand (participates in β ladder) | trans | -101.9 | 143.4 | 172 | -58.2 | -178.1 | 0 | 0 | 0 | 110.3 | F420 T428 M429 W453 E454 L456 | F420-L438 HydrophobicContact CB-CD2 4.21Å; F420-L438 HydrophobicContact CD1-CD1 4.18Å; F420-L438 HydrophobicContact CD1-CD2 3.7Å; F420-L438 HydrophobicContact CE1-CD1 4.36Å; F420-L438 HydrophobicContact CE1-CD2 4.49Å; F420-L438 HydrophobicContact CG-CD2 4.29Å; T428-L438 WeakPolarHBondContact O-CA 3.5Å; M429-L438 HydrophobicContact CB-CD2 3.74Å; M429-L438 HydrophobicContact CG-CD2 3.83Å; M429-L438 HydrophobicContact SD-CD2 4.38Å; L438-W453 CarbonylContact O-C 3.59Å; L438-W453 VanDerWaalsContact O-CA 3.32Å; L438-W453 WeakPolarHBondContact O-CA 3.43Å; L438-E454 PolarHBondContact N-O 2.94Å; L438-E454 PolarHBondContact O-N 3.29Å; L438-L456 HydrophobicContact CD1-CD1 4.36Å; L438-L456 HydrophobicContact CD1-CD2 4.45Å; L438-L456 HydrophobicContact CD2-CD2 4.26Å; L438-L456 HydrophobicContact CG-CB 4.24Å; L438-L456 HydrophobicContact CG-CD2 4.39Å |
| 439 | L | 97.4 | Very high | 94.2 | Very high | 5 Ų | 5 | 53 Ų | 53 | 3% | 0.026 | 27% | 0.274 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -75 | 125.9 | 178.1 | -171.9 | 74.7 | 0 | 0 | 0 | 110.1 | I234 N250 L254 T428 T441 V452 W453 | I234-L439 HydrophobicContact CB-CD2 4.29Å; I234-L439 HydrophobicContact CD1-CD1 3.99Å; I234-L439 HydrophobicContact CD1-CD2 4.26Å; I234-L439 HydrophobicContact CD1-CG 4.19Å; I234-L439 HydrophobicContact CG2-CD1 4.47Å; I234-L439 HydrophobicContact CG2-CD2 4.11Å; N250-L439 HydrophobicContact CB-CD2 3.64Å; L254-L439 HydrophobicContact CD1-CD1 4.17Å; L254-L439 HydrophobicContact CD1-CD2 4.15Å; T428-L439 HydrophobicContact CG2-CB 4.45Å; T428-L439 HydrophobicContact CG2-CD2 4.49Å; T428-L439 PolarHBondContact O-N 3.26Å; L439-T441 HydrophobicContact CB-CG2 4.49Å; L439-T441 HydrophobicContact CD2-CG2 3.98Å; L439-T441 HydrophobicContact CG-CG2 4.23Å; L439-T441 PolarHBondContact O-N 3.33Å; L439-V452 HydrophobicContact CD1-CG1 4.16Å; L439-V452 WeakPolarHBondContact CD1-O 3.33Å; L439-W453 HydrophobicContact CB-CE3 4.14Å; L439-W453 HydrophobicContact CB-CH2 4.3Å; L439-W453 HydrophobicContact CB-CZ3 3.74Å; L439-W453 HydrophobicContact CD1-CD2 4.28Å; L439-W453 HydrophobicContact CD1-CE3 4.17Å; L439-W453 HydrophobicContact CD1-CH2 3.82Å; L439-W453 HydrophobicContact CD1-CZ2 3.95Å; L439-W453 HydrophobicContact CD1-CZ3 3.94Å; L439-W453 HydrophobicContact CG-CZ3 4.47Å |
| 440 | V | 95.8 | Very high | 93.7 | Very high | 9 Ų | 9 | 54.9 Ų | 54.9 | 6% | 0.055 | 29% | 0.287 | C | S | . | . | trans | -72.2 | 100.6 | 175.7 | -177.9 | 0 | 0 | 0 | 0 | 108.7 | F445 V452 E454 F465 | V440-F445 HydrophobicContact CG1-CB 3.85Å; V440-F445 HydrophobicContact CG1-CD2 3.51Å; V440-F445 HydrophobicContact CG1-CE2 4.21Å; V440-F445 HydrophobicContact CG1-CG 3.75Å; V440-V452 PolarHBondContact N-O 3.38Å; V440-E454 HydrophobicContact CG2-CB 4.14Å; V440-F465 HydrophobicContact CG2-CD1 3.77Å; V440-F465 HydrophobicContact CG2-CE1 3.94Å | ||
| 441 | T | 94.7 | Very high | 93.5 | Very high | 13 Ų | 13 | 55.7 Ų | 55.7 | 8% | 0.08 | 29% | 0.291 | C | S | . | . | trans | -102.9 | -11.2 | -178.4 | 48.2 | 0 | 0 | 0 | 0 | 113.5 | T236 Q237 N250 L439 Q443 | T236-T441 CarbonylContact C-O 3.51Å; T236-T441 WeakPolarHBondContact CA-O 3.4Å; T236-T441 WeakPolarHBondContact CB-O 3.44Å; Q237-T441 PolarHBondContact N-O 3.48Å; N250-T441 WeakPolarHBondContact ND2-CG2 3.32Å; L439-T441 HydrophobicContact CB-CG2 4.49Å; L439-T441 HydrophobicContact CD2-CG2 3.98Å; L439-T441 HydrophobicContact CG-CG2 4.23Å; L439-T441 PolarHBondContact O-N 3.33Å; T441-Q443 PolarHBondContact O-N 3.26Å | ||
| 442 | D | 92.9 | Very high | 93.5 | Very high | 70 Ų | 70 | 54.4 Ų | 54.4 | 37% | 0.374 | 29% | 0.285 | S | S | . | . | B | Isolated β-bridge | trans | -63.2 | 135.3 | -179.9 | 174.6 | -94 | 0 | 0 | 0 | 112.6 | G444 F445 | D442-G444 VanDerWaalsContact C-N 3.26Å; D442-G444 PolarHBondContact O-N 3.37Å; D442-G444 VanDerWaalsContact OD1-CA 3.3Å; D442-G444 WeakPolarHBondContact OD1-CA 3.45Å; D442-G444 PolarHBondContact OD1-N 2.99Å; D442-F445 HydrophobicContact CB-CD2 4.05Å; D442-F445 HydrophobicContact CB-CE2 4.42Å; D442-F445 PolarHBondContact O-N 3.13Å |
| 443 | Q | 90.8 | Very high | 93.5 | Very high | 78 Ų | 78 | 52.6 Ų | 52.6 | 36% | 0.364 | 28% | 0.277 | S | S | . | . | G | 310 helix | trans | -66.1 | -22.8 | -175.5 | -176.7 | 179 | -33.4 | 0 | 0 | 113.6 | L221 Q237 T441 F445 L446 | L221-Q443 HydrophobicContact CD1-CG 4.09Å; Q237-Q443 VanDerWaalsContact O-CB 3.27Å; Q237-Q443 WeakPolarHBondContact O-CB 3.42Å; Q237-Q443 PolarHBondContact O-N 3Å; T441-Q443 PolarHBondContact O-N 3.26Å; Q443-F445 PolarHBondContact O-N 3.21Å; Q443-L446 WeakPolarHBondContact O-CB 3.44Å; Q443-L446 PolarHBondContact O-N 2.83Å; Q443-L446 VanDerWaalsContact O-N 3.08Å |
| 444 | G | 90.6 | Very high | 93.5 | Very high | 67 Ų | 67 | 47.7 Ų | 47.7 | 69% | 0.691 | 26% | 0.257 | S | S | * | . | G | 310 helix | trans | -59.6 | -31.2 | 173.5 | 0 | 0 | 0 | 0 | 0 | 112.8 | D442 L446 | D442-G444 VanDerWaalsContact C-N 3.26Å; D442-G444 PolarHBondContact O-N 3.37Å; D442-G444 VanDerWaalsContact OD1-CA 3.3Å; D442-G444 WeakPolarHBondContact OD1-CA 3.45Å; D442-G444 PolarHBondContact OD1-N 2.99Å; G444-L446 VanDerWaalsContact C-N 3.34Å; G444-L446 PolarHBondContact O-N 3.01Å |
| 445 | F | 91.3 | Very high | 93.7 | Very high | 57 Ų | 57 | 47 Ų | 47 | 25% | 0.25 | 25% | 0.247 | C | C | . | . | G | 310 helix | trans | -87.2 | 8.4 | 176.7 | -60.1 | -77.5 | 0 | 0 | 0 | 114.1 | K223 V440 D442 Q443 Q447 E448 M451 F465 | K223-F445 WeakPolarHBondContact CE-O 3.44Å; K223-F445 PolarHBondContact NZ-O 2.95Å; V440-F445 HydrophobicContact CG1-CB 3.85Å; V440-F445 HydrophobicContact CG1-CD2 3.51Å; V440-F445 HydrophobicContact CG1-CE2 4.21Å; V440-F445 HydrophobicContact CG1-CG 3.75Å; D442-F445 HydrophobicContact CB-CD2 4.05Å; D442-F445 HydrophobicContact CB-CE2 4.42Å; D442-F445 PolarHBondContact O-N 3.13Å; Q443-F445 PolarHBondContact O-N 3.21Å; F445-Q447 VanDerWaalsContact C-N 3.3Å; F445-Q447 PolarHBondContact O-N 3.29Å; F445-E448 PolarHBondContact O-N 2.84Å; F445-E448 VanDerWaalsContact O-N 3.07Å; F445-M451 HydrophobicContact CD1-CB 4.25Å; F445-M451 HydrophobicContact CD1-CG 4.5Å; F445-M451 HydrophobicContact CD1-SD 3.47Å; F445-M451 WeakPolarHBondContact CD1-SD 3.26Å; F445-M451 HydrophobicContact CE1-SD 3.55Å; F445-M451 VanDerWaalsContact CE1-SD 3.55Å; F445-F465 HydrophobicContact CE1-CE2 4.33Å; F445-F465 HydrophobicContact CE1-CZ 4.34Å; F445-F465 HydrophobicContact CE2-CZ 4.36Å; F445-F465 HydrophobicContact CZ-CE1 4.34Å; F445-F465 HydrophobicContact CZ-CE2 4.1Å; F445-F465 AromaticContact CZ-CZ 3.77Å; F445-F465 HydrophobicContact CZ-CZ 3.77Å |
| 446 | L | 91.3 | Very high | 93.7 | Very high | 36 Ų | 36 | 42.4 Ų | 42.4 | 19% | 0.188 | 23% | 0.226 | C | C | . | . | T | Hydrogen-bonded Turn | trans | -52.4 | -44 | -174.7 | 176.3 | 61.8 | 0 | 0 | 0 | 113.6 | L221 K223 T236 Q443 G444 | L221-L446 HydrophobicContact CB-CD1 4.3Å; L221-L446 HydrophobicContact CB-CD2 3.84Å; L221-L446 HydrophobicContact CD1-CD2 3.51Å; L221-L446 HydrophobicContact CG-CD2 4.31Å; K223-L446 HydrophobicContact CB-CD1 3.88Å; K223-L446 HydrophobicContact CG-CD1 4.36Å; T236-L446 HydrophobicContact CG2-CD1 4.24Å; Q443-L446 WeakPolarHBondContact O-CB 3.44Å; Q443-L446 PolarHBondContact O-N 2.83Å; Q443-L446 VanDerWaalsContact O-N 3.08Å; G444-L446 VanDerWaalsContact C-N 3.34Å; G444-L446 PolarHBondContact O-N 3.01Å |
| 447 | Q | 90.9 | Very high | 93.3 | Very high | 167 Ų | 167 | 46.6 Ų | 46.6 | 78% | 0.78 | 25% | 0.246 | S | C | * | . | T | Hydrogen-bonded Turn | trans | -79.8 | -18.7 | -177.6 | -59.9 | -61.9 | -36.7 | 0 | 0 | 113.6 | F445 E449 | F445-Q447 VanDerWaalsContact C-N 3.3Å; F445-Q447 PolarHBondContact O-N 3.29Å; Q447-E449 PolarHBondContact O-N 2.92Å |
| 448 | E | 91 | Very high | 92.9 | Very high | 72 Ų | 72 | 46.4 Ų | 46.4 | 34% | 0.336 | 25% | 0.246 | S | C | . | . | trans | -81.8 | 81.9 | -176.3 | -77.9 | -63.5 | 157.9 | 0 | 0 | 111.1 | K223 F445 S450 M451 | K223-E448 VanDerWaalsContact CE-O 3.27Å; K223-E448 WeakPolarHBondContact CE-O 3.31Å; K223-E448 PolarHBondContact NZ-O 3.41Å; F445-E448 PolarHBondContact O-N 2.84Å; F445-E448 VanDerWaalsContact O-N 3.07Å; E448-S450 PolarHBondContact O-N 3.28Å; E448-S450 PolarHBondContact OE2-OG 2.84Å; E448-M451 HydrophobicContact CB-CB 4.1Å; E448-M451 HydrophobicContact CB-CG 4.04Å; E448-M451 HydrophobicContact CB-SD 4.29Å; E448-M451 HydrophobicContact CG-CE 4.27Å; E448-M451 HydrophobicContact CG-SD 4.29Å; E448-M451 PolarHBondContact O-N 3.24Å | ||
| 449 | E | 86.2 | Confident | 92.5 | Very high | 128 Ų | 128 | 46.5 Ų | 46.5 | 60% | 0.598 | 25% | 0.248 | S | C | * | . | T | Hydrogen-bonded Turn | trans | -52.5 | -24.8 | 174.3 | -73.7 | -151.6 | 148.5 | 0 | 0 | 112.8 | K231 Q447 | K231-E449 IonicContact NZ-OE1 2.77Å; K231-E449 PolarHBondContact NZ-OE1 3.48Å; K231-E449 IonicContact NZ-OE2 2.64Å; Q447-E449 PolarHBondContact O-N 2.92Å |
| 450 | S | 89.1 | Confident | 91.7 | Very high | 39 Ų | 39 | 53.7 Ų | 53.7 | 27% | 0.273 | 28% | 0.281 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -72.8 | -24 | 178.1 | 76.1 | 0 | 0 | 0 | 0 | 114.1 | E448 C466 N467 S473 | E448-S450 PolarHBondContact O-N 3.28Å; E448-S450 PolarHBondContact OE2-OG 2.84Å; S450-C466 CarbonylContact O-C 3.56Å; S450-N467 WeakPolarHBondContact O-CA 3.36Å; S450-N467 PolarHBondContact O-N 3.35Å; S450-S473 WeakPolarHBondContact O-CB 3.33Å; S450-S473 PolarHBondContact O-OG 2.84Å |
| 451 | M | 93.6 | Very high | 90.9 | Very high | 22 Ų | 22 | 55.3 Ų | 55.3 | 11% | 0.108 | 30% | 0.3 | C | S | . | . | trans | -107.2 | 104.5 | -173 | -57.9 | -173.1 | -165.6 | 0 | 0 | 110.1 | K223 F445 E448 F465 | K223-M451 PolarHBondContact NZ-O 3.05Å; F445-M451 HydrophobicContact CD1-CB 4.25Å; F445-M451 HydrophobicContact CD1-CG 4.5Å; F445-M451 HydrophobicContact CD1-SD 3.47Å; F445-M451 WeakPolarHBondContact CD1-SD 3.26Å; F445-M451 HydrophobicContact CE1-SD 3.55Å; F445-M451 VanDerWaalsContact CE1-SD 3.55Å; E448-M451 HydrophobicContact CB-CB 4.1Å; E448-M451 HydrophobicContact CB-CG 4.04Å; E448-M451 HydrophobicContact CB-SD 4.29Å; E448-M451 HydrophobicContact CG-CE 4.27Å; E448-M451 HydrophobicContact CG-SD 4.29Å; E448-M451 PolarHBondContact O-N 3.24Å; M451-F465 HydrophobicContact CG-CB 4.25Å; M451-F465 HydrophobicContact SD-CB 4.46Å; M451-F465 HydrophobicContact SD-CD2 4.33Å; M451-F465 HydrophobicContact SD-CG 4.37Å | ||
| 452 | V | 96 | Very high | 90.3 | Very high | 0 Ų | 0 | 59.4 Ų | 59.4 | 0% | 0 | 32% | 0.321 | C | S | . | . | trans | -128.8 | -38.1 | -173.3 | -179.6 | 0 | 0 | 0 | 0 | 111.9 | I225 L439 V440 C466 | I225-V452 HydrophobicContact CB-CG1 4.39Å; I225-V452 HydrophobicContact CB-CG2 4.28Å; I225-V452 HydrophobicContact CD1-CG1 3.66Å; I225-V452 HydrophobicContact CG2-CG1 4.03Å; I225-V452 HydrophobicContact CG2-CG2 3.68Å; L439-V452 HydrophobicContact CD1-CG1 4.16Å; L439-V452 WeakPolarHBondContact CD1-O 3.33Å; V440-V452 PolarHBondContact N-O 3.38Å; V452-C466 PolarHBondContact N-O 3.01Å | ||
| 453 | W | 96.8 | Very high | 89.9 | Confident | 0 Ų | 0 | 56.8 Ų | 56.8 | 0% | 0 | 31% | 0.311 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -124.9 | 150 | 179.7 | -64.3 | 106.4 | 0 | 0 | 0 | 110.5 | W227 L254 I430 Y437 L438 L439 F465 C466 F470 | W227-W453 HydrophobicContact CE3-CZ2 4.48Å; W227-W453 AromaticContact CH2-CZ2 3.88Å; W227-W453 HydrophobicContact CH2-CZ2 3.88Å; W227-W453 AromaticContact CZ3-CZ2 3.87Å; W227-W453 HydrophobicContact CZ3-CZ2 3.87Å; W227-W453 AromaticContact CZ3-NE1 3.68Å; L254-W453 HydrophobicContact CD1-CH2 3.85Å; L254-W453 HydrophobicContact CD1-CZ2 4.14Å; I430-W453 HydrophobicContact CB-CH2 4.06Å; I430-W453 HydrophobicContact CB-CZ3 4.17Å; I430-W453 HydrophobicContact CG2-CD2 4.19Å; I430-W453 HydrophobicContact CG2-CE3 3.8Å; I430-W453 HydrophobicContact CG2-CH2 3.53Å; I430-W453 HydrophobicContact CG2-CZ2 3.91Å; I430-W453 HydrophobicContact CG2-CZ3 3.47Å; I430-W453 VanDerWaalsContact CG2-CZ3 3.47Å; Y437-W453 HydrophobicContact CD1-CB 4.15Å; Y437-W453 HydrophobicContact CG-CB 4.47Å; L438-W453 CarbonylContact O-C 3.59Å; L438-W453 VanDerWaalsContact O-CA 3.32Å; L438-W453 WeakPolarHBondContact O-CA 3.43Å; L439-W453 HydrophobicContact CB-CE3 4.14Å; L439-W453 HydrophobicContact CB-CH2 4.3Å; L439-W453 HydrophobicContact CB-CZ3 3.74Å; L439-W453 HydrophobicContact CD1-CD2 4.28Å; L439-W453 HydrophobicContact CD1-CE3 4.17Å; L439-W453 HydrophobicContact CD1-CH2 3.82Å; L439-W453 HydrophobicContact CD1-CZ2 3.95Å; L439-W453 HydrophobicContact CD1-CZ3 3.94Å; L439-W453 HydrophobicContact CG-CZ3 4.47Å; W453-F465 CarbonylContact O-C 3.58Å; W453-F465 WeakPolarHBondContact O-CA 3.34Å; W453-C466 HydrophobicContact CB-CB 4.24Å; W453-C466 PolarHBondContact N-O 2.81Å; W453-C466 PolarHBondContact O-N 3.37Å; W453-F470 HydrophobicContact CB-CD1 4.31Å; W453-F470 HydrophobicContact CB-CE1 4.29Å; W453-F470 AromaticContact CD1-CD1 3.87Å; W453-F470 AromaticContact CD1-CE1 3.51Å; W453-F470 AromaticContact CD1-CZ 3.95Å; W453-F470 AromaticContact CD2-CE1 3.7Å; W453-F470 HydrophobicContact CD2-CE1 3.7Å; W453-F470 HydrophobicContact CD2-CZ 4.25Å; W453-F470 AromaticContact CE2-CE1 3.75Å; W453-F470 AromaticContact CE2-CZ 3.81Å; W453-F470 HydrophobicContact CE3-CE1 4.41Å; W453-F470 HydrophobicContact CG-CD1 4Å; W453-F470 AromaticContact CG-CE1 3.59Å; W453-F470 HydrophobicContact CG-CE1 3.59Å; W453-F470 HydrophobicContact CG-CZ 4.36Å; W453-F470 HydrophobicContact CZ2-CZ 4.28Å; W453-F470 AromaticContact NE1-CE1 3.6Å; W453-F470 AromaticContact NE1-CZ 3.58Å |
| 454 | E | 96.1 | Very high | 90 | Very high | 56 Ų | 56 | 56.6 Ų | 56.6 | 26% | 0.262 | 31% | 0.312 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -121.1 | 134.8 | 174.2 | -173.6 | -167.4 | 147.9 | 0 | 0 | 108.9 | Y437 L438 V440 L456 F465 | Y437-E454 CarbonylContact C-O 3.59Å; Y437-E454 WeakPolarHBondContact CA-O 3.45Å; L438-E454 PolarHBondContact N-O 2.94Å; L438-E454 PolarHBondContact O-N 3.29Å; V440-E454 HydrophobicContact CG2-CB 4.14Å; E454-L456 PolarHBondContact O-N 3.27Å; E454-F465 HydrophobicContact CB-CD1 4.11Å; E454-F465 HydrophobicContact CB-CE1 4.1Å; E454-F465 HydrophobicContact CG-CD1 4.18Å; E454-F465 HydrophobicContact CG-CE1 3.93Å |
| 455 | S | 95.7 | Very high | 90.2 | Very high | 13 Ų | 13 | 56.5 Ų | 56.5 | 9% | 0.091 | 29% | 0.293 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -78.1 | 113.6 | -177.2 | 61.5 | 0 | 0 | 0 | 0 | 113.3 | H457 G463 N464 | S455-H457 PolarHBondContact O-N 3.41Å; S455-H457 PolarHBondContact O-ND1 3.44Å; S455-H457 VanDerWaalsContact O-ND1 3.15Å; S455-H457 PolarHBondContact OG-ND1 2.88Å; S455-G463 WeakPolarHBondContact O-CA 3.39Å; S455-N464 PolarHBondContact N-O 3.43Å; S455-N464 WeakPolarHBondContact OG-CB 3.35Å; S455-N464 PolarHBondContact OG-N 2.97Å |
| 456 | L | 95 | Very high | 90.4 | Very high | 14 Ų | 14 | 53.9 Ų | 53.9 | 7% | 0.073 | 28% | 0.281 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -85.1 | 90.1 | 173.2 | -176.4 | 66 | 0 | 0 | 0 | 109.5 | L400 L405 L408 F420 M429 L436 L438 E454 | L400-L456 HydrophobicContact CD2-CD1 3.88Å; L405-L456 HydrophobicContact CD1-CD2 4.26Å; L405-L456 HydrophobicContact CD1-CG 3.94Å; L408-L456 HydrophobicContact CD2-CD2 4.35Å; F420-L456 HydrophobicContact CD1-CD2 4.21Å; F420-L456 HydrophobicContact CE1-CD2 3.74Å; F420-L456 HydrophobicContact CZ-CD2 3.91Å; M429-L456 HydrophobicContact SD-CD2 4.37Å; L436-L456 HydrophobicContact CB-CB 4.02Å; L436-L456 HydrophobicContact CB-CD2 4.44Å; L436-L456 HydrophobicContact CD1-CD2 4.3Å; L436-L456 PolarHBondContact O-N 3.49Å; L438-L456 HydrophobicContact CD1-CD1 4.36Å; L438-L456 HydrophobicContact CD1-CD2 4.45Å; L438-L456 HydrophobicContact CD2-CD2 4.26Å; L438-L456 HydrophobicContact CG-CB 4.24Å; L438-L456 HydrophobicContact CG-CD2 4.39Å; E454-L456 PolarHBondContact O-N 3.27Å |
| 457 | H | 90 | Very high | 90.5 | Very high | 92 Ų | 92 | 54.1 Ų | 54.1 | 43% | 0.426 | 28% | 0.283 | S | S | . | . | trans | -129 | -2.5 | -173.6 | 75 | -81.8 | 0 | 0 | 0 | 114.4 | S455 | S455-H457 PolarHBondContact O-N 3.41Å; S455-H457 PolarHBondContact O-ND1 3.44Å; S455-H457 VanDerWaalsContact O-ND1 3.15Å; S455-H457 PolarHBondContact OG-ND1 2.88Å | ||
| 458 | N | 89.4 | Confident | 90.7 | Very high | 19 Ų | 19 | 46.7 Ų | 46.7 | 10% | 0.102 | 25% | 0.249 | C | C | . | . | S | Bend | trans | -148.6 | -179.1 | 178.4 | 66.2 | 60 | 0 | 0 | 0 | 110.8 | E460 G461 D462 | N458-E460 PolarHBondContact OD1-N 3.24Å; N458-G461 PolarHBondContact OD1-N 3.38Å; N458-D462 PolarHBondContact ND2-OD1 2.85Å; N458-D462 PolarHBondContact OD1-OD1 3.38Å |
| 459 | V | 87.2 | Confident | 90.8 | Very high | 20 Ų | 20 | 48 Ų | 48 | 12% | 0.121 | 26% | 0.259 | C | S | . | . | S | Bend | trans | -101.3 | -6.3 | 178.3 | -48.7 | 0 | 0 | 0 | 0 | 113.9 | L400 Y402 R422 | L400-V459 HydrophobicContact CD2-CG1 4.44Å; L400-V459 HydrophobicContact CG-CB 4.41Å; L400-V459 HydrophobicContact CG-CG1 4.07Å; Y402-V459 HydrophobicContact CD1-CG1 3.9Å; Y402-V459 HydrophobicContact CD2-CG1 4.12Å; Y402-V459 HydrophobicContact CD2-CG2 4.3Å; Y402-V459 HydrophobicContact CE1-CG1 3.99Å; Y402-V459 HydrophobicContact CE1-CG2 4.21Å; Y402-V459 HydrophobicContact CE2-CG1 4.19Å; Y402-V459 HydrophobicContact CE2-CG2 3.63Å; Y402-V459 HydrophobicContact CG-CG1 3.97Å; R422-V459 PolarHBondContact NH2-O 2.75Å |
| 460 | E | 81.3 | Confident | 91.2 | Very high | 155 Ų | 155 | 43.1 Ų | 43.1 | 72% | 0.724 | 24% | 0.236 | S | C | * | . | S | Bend | trans | -92.9 | -33.3 | -168.5 | -67.9 | 175.2 | -144.8 | 0 | 0 | 112.6 | Y402 N458 | Y402-E460 PolarHBondContact OH-OE1 3.36Å; N458-E460 PolarHBondContact OD1-N 3.24Å |
| 461 | G | 78.7 | Confident | 91.3 | Very high | 44 Ų | 44 | 50 Ų | 50 | 45% | 0.454 | 26% | 0.256 | S | S | . | . | trans | 106.6 | 11.5 | 173 | 0 | 0 | 0 | 0 | 0 | 115.9 | N458 G463 | N458-G461 PolarHBondContact OD1-N 3.38Å; G461-G463 PolarHBondContact O-N 3.01Å | ||
| 462 | D | 82.8 | Confident | 91.1 | Very high | 98 Ų | 98 | 54.2 Ų | 54.2 | 52% | 0.524 | 28% | 0.278 | S | S | . | . | trans | -79.2 | 46 | 169.9 | 64.6 | -46.7 | 0 | 0 | 0 | 112.4 | N458 N464 | N458-D462 PolarHBondContact ND2-OD1 2.85Å; N458-D462 PolarHBondContact OD1-OD1 3.38Å; D462-N464 PolarHBondContact O-ND2 2.84Å | ||
| 463 | G | 84.9 | Confident | 90.4 | Very high | 15 Ų | 15 | 55.3 Ų | 55.3 | 16% | 0.155 | 29% | 0.286 | C | S | . | . | P | Polyproline II helix | trans | -59.3 | 146.4 | 178 | 0 | 0 | 0 | 0 | 0 | 112.6 | S455 G461 | S455-G463 WeakPolarHBondContact O-CA 3.39Å; G461-G463 PolarHBondContact O-N 3.01Å |
| 464 | N | 92.4 | Very high | 88.8 | Confident | 75 Ų | 75 | 62.3 Ų | 62.3 | 40% | 0.401 | 32% | 0.318 | S | S | . | . | P | Polyproline II helix | trans | -99.6 | 126 | -179.6 | -44.9 | 143.1 | 0 | 0 | 0 | 110.9 | S455 D462 L472 | S455-N464 PolarHBondContact N-O 3.43Å; S455-N464 WeakPolarHBondContact OG-CB 3.35Å; S455-N464 PolarHBondContact OG-N 2.97Å; D462-N464 PolarHBondContact O-ND2 2.84Å; N464-L472 HydrophobicContact CB-CD2 3.56Å |
| 465 | F | 94.9 | Very high | 86.8 | Confident | 64 Ų | 64 | 63.1 Ų | 63.1 | 28% | 0.281 | 34% | 0.335 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -70.1 | 141.5 | 178.1 | -61.2 | -61.5 | 0 | 0 | 0 | 112.7 | V440 F445 M451 W453 E454 S473 | V440-F465 HydrophobicContact CG2-CD1 3.77Å; V440-F465 HydrophobicContact CG2-CE1 3.94Å; F445-F465 HydrophobicContact CE1-CE2 4.33Å; F445-F465 HydrophobicContact CE1-CZ 4.34Å; F445-F465 HydrophobicContact CE2-CZ 4.36Å; F445-F465 HydrophobicContact CZ-CE1 4.34Å; F445-F465 HydrophobicContact CZ-CE2 4.1Å; F445-F465 AromaticContact CZ-CZ 3.77Å; F445-F465 HydrophobicContact CZ-CZ 3.77Å; M451-F465 HydrophobicContact CG-CB 4.25Å; M451-F465 HydrophobicContact SD-CB 4.46Å; M451-F465 HydrophobicContact SD-CD2 4.33Å; M451-F465 HydrophobicContact SD-CG 4.37Å; W453-F465 CarbonylContact O-C 3.58Å; W453-F465 WeakPolarHBondContact O-CA 3.34Å; E454-F465 HydrophobicContact CB-CD1 4.11Å; E454-F465 HydrophobicContact CB-CE1 4.1Å; E454-F465 HydrophobicContact CG-CD1 4.18Å; E454-F465 HydrophobicContact CG-CE1 3.93Å; F465-S473 PolarHBondContact O-N 3.1Å |
| 466 | C | 94.6 | Very high | 84.5 | Confident | 2 Ų | 2 | 67.2 Ų | 67.2 | 1% | 0.014 | 36% | 0.361 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -138.6 | 153 | -175.5 | -66.7 | 0 | 0 | 0 | 0 | 111.3 | S450 V452 W453 R471 S473 | S450-C466 CarbonylContact O-C 3.56Å; V452-C466 PolarHBondContact N-O 3.01Å; W453-C466 HydrophobicContact CB-CB 4.24Å; W453-C466 PolarHBondContact N-O 2.81Å; W453-C466 PolarHBondContact O-N 3.37Å; C466-R471 CarbonylContact C-O 3.55Å; C466-R471 WeakPolarHBondContact CA-O 3.43Å; C466-R471 WeakPolarHBondContact CB-O 3.06Å; C466-S473 VanDerWaalsContact C-OG 3.25Å |
| 467 | N | 94.4 | Very high | 81.9 | Confident | 42 Ų | 42 | 73.7 Ų | 73.7 | 23% | 0.225 | 39% | 0.39 | C | S | . | . | trans | -78.9 | 179.7 | 176.3 | 86.7 | -22.7 | 0 | 0 | 0 | 112.1 | S450 D469 F470 R471 S473 | S450-N467 WeakPolarHBondContact O-CA 3.36Å; S450-N467 PolarHBondContact O-N 3.35Å; N467-D469 PolarHBondContact ND2-OD2 3.11Å; N467-D469 VanDerWaalsContact ND2-OD2 3.12Å; N467-D469 PolarHBondContact O-N 2.96Å; N467-D469 WeakPolarHBondContact OD1-CA 3.34Å; N467-D469 PolarHBondContact OD1-N 3.35Å; N467-F470 PolarHBondContact O-N 3.31Å; N467-F470 PolarHBondContact OD1-N 3.43Å; N467-R471 PolarHBondContact N-O 3.48Å; N467-R471 WeakPolarHBondContact OD1-CB 3.11Å; N467-R471 PolarHBondContact OD1-N 2.9Å; N467-S473 PolarHBondContact N-OG 3.24Å | ||
| 468 | S | 94.4 | Very high | 79.5 | Confident | 10 Ų | 10 | 80 Ų | 80 | 7% | 0.07 | 41% | 0.41 | C | S | . | . | T | Hydrogen-bonded Turn | trans | -57 | -20.4 | 179.3 | -63.9 | 0 | 0 | 0 | 0 | 115 | T226 | T226-S468 VanDerWaalsContact O-CB 3.25Å; T226-S468 WeakPolarHBondContact O-CB 3.37Å |
| 469 | D | 93.6 | Very high | 77.1 | Confident | 99 Ų | 99 | 84 Ų | 84 | 53% | 0.529 | 44% | 0.438 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -101.2 | 12.7 | 179.8 | -47.6 | -67.7 | 0 | 0 | 0 | 112.8 | N467 R471 | N467-D469 PolarHBondContact ND2-OD2 3.11Å; N467-D469 VanDerWaalsContact ND2-OD2 3.12Å; N467-D469 PolarHBondContact O-N 2.96Å; N467-D469 WeakPolarHBondContact OD1-CA 3.34Å; N467-D469 PolarHBondContact OD1-N 3.35Å; D469-R471 HydrophobicContact CB-CG 4.19Å; D469-R471 PolarHBondContact O-N 3.09Å |
| 470 | F | 93.6 | Very high | 74.9 | Confident | 27 Ų | 27 | 88 Ų | 88 | 12% | 0.118 | 46% | 0.464 | C | S | . | . | S | Bend | trans | 57.6 | 34.3 | -176.7 | -49.7 | -88.3 | 0 | 0 | 0 | 113.5 | W227 I430 H432 Y437 W453 N467 | W227-F470 HydrophobicContact CH2-CE2 4.08Å; W227-F470 AromaticContact CH2-CZ 3.9Å; W227-F470 HydrophobicContact CH2-CZ 3.9Å; W227-F470 AromaticContact CZ3-CE2 3.85Å; W227-F470 HydrophobicContact CZ3-CE2 3.85Å; W227-F470 AromaticContact CZ3-CZ 3.83Å; W227-F470 HydrophobicContact CZ3-CZ 3.83Å; I430-F470 HydrophobicContact CD1-CZ 4.18Å; I430-F470 HydrophobicContact CG2-CE1 3.59Å; I430-F470 HydrophobicContact CG2-CZ 3.65Å; H432-F470 HydrophobicContact CB-CD1 4.19Å; H432-F470 HydrophobicContact CB-CD2 4.08Å; H432-F470 HydrophobicContact CB-CE1 4.19Å; H432-F470 HydrophobicContact CB-CE2 4.09Å; H432-F470 HydrophobicContact CB-CG 4.13Å; H432-F470 HydrophobicContact CB-CZ 4.16Å; H432-F470 AromaticContact CE1-CD2 3.5Å; H432-F470 VanDerWaalsContact CE1-CD2 3.5Å; H432-F470 WeakPolarHBondContact CE1-CD2 3.37Å; H432-F470 AromaticContact CE1-CG 3.76Å; H432-F470 AromaticContact CG-CD2 3.56Å; H432-F470 AromaticContact CG-CE2 3.93Å; H432-F470 AromaticContact CG-CG 3.8Å; H432-F470 WeakPolarHBondContact ND1-CB 3.4Å; H432-F470 AromaticContact ND1-CD2 3.26Å; H432-F470 VanDerWaalsContact ND1-CD2 3.26Å; H432-F470 WeakPolarHBondContact ND1-CD2 3.46Å; H432-F470 AromaticContact ND1-CG 3.21Å; H432-F470 WeakPolarHBondContact ND1-CG 3.27Å; H432-F470 AromaticContact NE2-CD2 3.99Å; Y437-F470 AromaticContact CD1-CD1 3.93Å; Y437-F470 HydrophobicContact CD1-CD1 3.93Å; Y437-F470 AromaticContact CD2-CD1 3.55Å; Y437-F470 HydrophobicContact CD2-CD1 3.55Å; Y437-F470 AromaticContact CD2-CE1 3.81Å; Y437-F470 HydrophobicContact CD2-CE1 3.81Å; Y437-F470 HydrophobicContact CE1-CD1 4.07Å; Y437-F470 HydrophobicContact CE2-CB 4.43Å; Y437-F470 AromaticContact CE2-CD1 3.71Å; Y437-F470 HydrophobicContact CE2-CD1 3.71Å; Y437-F470 HydrophobicContact CE2-CE1 4.38Å; Y437-F470 HydrophobicContact CE2-CG 4.33Å; Y437-F470 AromaticContact CG-CD1 3.66Å; Y437-F470 HydrophobicContact CG-CD1 3.66Å; Y437-F470 AromaticContact CG-CE1 3.87Å; Y437-F470 HydrophobicContact CG-CE1 3.87Å; Y437-F470 AromaticContact CZ-CD1 3.96Å; W453-F470 HydrophobicContact CB-CD1 4.31Å; W453-F470 HydrophobicContact CB-CE1 4.29Å; W453-F470 AromaticContact CD1-CD1 3.87Å; W453-F470 AromaticContact CD1-CE1 3.51Å; W453-F470 AromaticContact CD1-CZ 3.95Å; W453-F470 AromaticContact CD2-CE1 3.7Å; W453-F470 HydrophobicContact CD2-CE1 3.7Å; W453-F470 HydrophobicContact CD2-CZ 4.25Å; W453-F470 AromaticContact CE2-CE1 3.75Å; W453-F470 AromaticContact CE2-CZ 3.81Å; W453-F470 HydrophobicContact CE3-CE1 4.41Å; W453-F470 HydrophobicContact CG-CD1 4Å; W453-F470 AromaticContact CG-CE1 3.59Å; W453-F470 HydrophobicContact CG-CE1 3.59Å; W453-F470 HydrophobicContact CG-CZ 4.36Å; W453-F470 HydrophobicContact CZ2-CZ 4.28Å; W453-F470 AromaticContact NE1-CE1 3.6Å; W453-F470 AromaticContact NE1-CZ 3.58Å; N467-F470 PolarHBondContact O-N 3.31Å; N467-F470 PolarHBondContact OD1-N 3.43Å |
| 471 | R | 92 | Very high | 73.1 | Confident | 183 Ų | 183 | 83.8 Ų | 83.8 | 69% | 0.691 | 46% | 0.456 | S | S | * | . | trans | -90.4 | 133 | 168.4 | -56 | -70.8 | -67.7 | -157.7 | -3.5 | 108.1 | C466 N467 D469 S473 | C466-R471 CarbonylContact C-O 3.55Å; C466-R471 WeakPolarHBondContact CA-O 3.43Å; C466-R471 WeakPolarHBondContact CB-O 3.06Å; N467-R471 PolarHBondContact N-O 3.48Å; N467-R471 WeakPolarHBondContact OD1-CB 3.11Å; N467-R471 PolarHBondContact OD1-N 2.9Å; D469-R471 HydrophobicContact CB-CG 4.19Å; D469-R471 PolarHBondContact O-N 3.09Å; R471-S473 PolarHBondContact O-N 3.34Å | ||
| 472 | L | 90.3 | Very high | 71.4 | Confident | 110 Ų | 110 | 86.3 Ų | 86.3 | 58% | 0.576 | 47% | 0.472 | S | S | * | . | B | Isolated β-bridge | trans | -53.2 | 120.4 | 174.9 | -77.6 | 167.1 | 0 | 0 | 0 | 110.6 | N464 H474 | N464-L472 HydrophobicContact CB-CD2 3.56Å; L472-H474 PolarHBondContact O-N 3.12Å |
| 473 | S | 79.9 | Confident | 69.7 | Low | 24 Ų | 24 | 86 Ų | 86 | 17% | 0.168 | 48% | 0.484 | C | S | . | . | trans | -86.2 | 100.3 | 178.7 | -63.8 | 0 | 0 | 0 | 0 | 108.2 | S450 F465 C466 N467 R471 A475 | S450-S473 WeakPolarHBondContact O-CB 3.33Å; S450-S473 PolarHBondContact O-OG 2.84Å; F465-S473 PolarHBondContact O-N 3.1Å; C466-S473 VanDerWaalsContact C-OG 3.25Å; N467-S473 PolarHBondContact N-OG 3.24Å; R471-S473 PolarHBondContact O-N 3.34Å; S473-A475 PolarHBondContact O-N 3.08Å | ||
| 474 | H | 64.1 | Low | 67.8 | Low | 147 Ų | 147 | 92.6 Ų | 92.6 | 68% | 0.681 | 51% | 0.514 | S | S | * | . | P | Polyproline II helix | trans | -60.2 | 133.7 | 163.5 | -75.4 | 33.5 | 0 | 0 | 0 | 107.9 | L472 | L472-H474 PolarHBondContact O-N 3.12Š|
| 475 | A | 54.5 | Low | 66.3 | Low | 73 Ų | 73 | 96 Ų | 96 | 60% | 0.603 | 53% | 0.532 | S | S | * | . | P | Polyproline II helix | trans | -48.9 | 135.9 | 159.2 | 0 | 0 | 0 | 0 | 0 | 107.5 | S473 E477 | S473-A475 PolarHBondContact O-N 3.08Å; A475-E477 PolarHBondContact O-N 3.05Å |
| 476 | P | 47.3 | Very low | 64.6 | Low | 99 Ų | 99 | 98.4 Ų | 98.4 | 64% | 0.643 | 55% | 0.554 | S | S | * | * | P | Polyproline II helix | trans | -53.7 | 120.4 | -168.7 | 20.4 | -32.9 | 0 | 0 | 0 | 109.4 | R478 | P476-R478 PolarHBondContact O-N 3.39Š|
| 477 | E | 39.8 | Very low | 62.7 | Low | 149 Ų | 149 | 102.2 Ų | 102.2 | 70% | 0.696 | 58% | 0.578 | S | S | * | * | P | Polyproline II helix | trans | -52.2 | 117.6 | 174.2 | -78.9 | -161.5 | 142.4 | 0 | 0 | 107.1 | A475 P479 | A475-E477 PolarHBondContact O-N 3.05Å; E477-P479 VanDerWaalsContact O-CD 3.28Å; E477-P479 WeakPolarHBondContact O-CD 3.26Å |
| 478 | R | 40 | Very low | 61 | Low | 224 Ų | 224 | 102.7 Ų | 102.7 | 85% | 0.845 | 59% | 0.585 | S | S | * | * | trans | -52 | 112.2 | 162 | 165.9 | 177.3 | -80.2 | 156.1 | -4.8 | 104.4 | P476 | P476-R478 PolarHBondContact O-N 3.39Š| ||
| 479 | P | 38.3 | Very low | 59.6 | Low | 104 Ų | 104 | 107.1 Ų | 107.1 | 68% | 0.675 | 62% | 0.616 | S | S | * | * | trans | -55.2 | 127.7 | -160.8 | 17.3 | -31.6 | 0 | 0 | 0 | 108.6 | E477 A481 | E477-P479 VanDerWaalsContact O-CD 3.28Å; E477-P479 WeakPolarHBondContact O-CD 3.26Å; P479-A481 VanDerWaalsContact O-CA 3.27Å; P479-A481 WeakPolarHBondContact O-CA 3.28Å; P479-A481 PolarHBondContact O-N 3.34Å | ||
| 480 | P | 41 | Very low | 58.3 | Low | 105 Ų | 105 | 110 Ų | 110 | 68% | 0.682 | 63% | 0.626 | S | S | * | * | trans | -51.2 | 111.2 | -161.4 | 16.3 | -31.4 | 0 | 0 | 0 | 109.6 | A482 | P480-A482 WeakPolarHBondContact O-CA 3.42Å; P480-A482 PolarHBondContact O-N 2.95Å | ||
| 481 | A | 43.7 | Very low | 56.9 | Low | 66 Ų | 66 | 114.2 Ų | 114.2 | 55% | 0.545 | 65% | 0.646 | S | S | . | * | trans | -51.3 | 106.4 | -148.9 | 0 | 0 | 0 | 0 | 0 | 111.7 | P479 A483 L484 | P479-A481 VanDerWaalsContact O-CA 3.27Å; P479-A481 WeakPolarHBondContact O-CA 3.28Å; P479-A481 PolarHBondContact O-N 3.34Å; A481-A483 VanDerWaalsContact C-N 3.31Å; A481-A483 PolarHBondContact O-N 3.15Å; A481-L484 HydrophobicContact CB-CD1 4.42Å | ||
| 482 | A | 42.5 | Very low | 55.6 | Low | 96 Ų | 96 | 110.8 Ų | 110.8 | 79% | 0.793 | 64% | 0.638 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -66.5 | 84.7 | -159 | 0 | 0 | 0 | 0 | 0 | 112.6 | P480 L484 | P480-A482 WeakPolarHBondContact O-CA 3.42Å; P480-A482 PolarHBondContact O-N 2.95Å; A482-L484 VanDerWaalsContact C-N 3.29Å; A482-L484 PolarHBondContact O-N 3.36Å |
| 483 | A | 46.5 | Very low | 54.6 | Low | 93 Ų | 93 | 110.2 Ų | 110.2 | 77% | 0.769 | 63% | 0.633 | S | S | * | * | T | Hydrogen-bonded Turn | trans | 43.7 | 50.2 | -175 | 0 | 0 | 0 | 0 | 0 | 113.6 | A481 L485 | A481-A483 VanDerWaalsContact C-N 3.31Å; A481-A483 PolarHBondContact O-N 3.15Å; A483-L485 VanDerWaalsContact C-N 3.27Å; A483-L485 PolarHBondContact O-N 2.89Å |
| 484 | L | 46.3 | Very low | 54.2 | Low | 152 Ų | 152 | 117 Ų | 117 | 80% | 0.796 | 66% | 0.655 | S | S | * | * | trans | -63.3 | 96.5 | 161 | -77.8 | 179.4 | 0 | 0 | 0 | 108.2 | A481 A482 | A481-L484 HydrophobicContact CB-CD1 4.42Å; A482-L484 VanDerWaalsContact C-N 3.29Å; A482-L484 PolarHBondContact O-N 3.36Å | ||
| 485 | L | 61.4 | Low | 54.5 | Low | 148 Ų | 148 | 115.8 Ų | 115.8 | 78% | 0.775 | 65% | 0.649 | S | S | * | * | P | Polyproline II helix | trans | -49.1 | 144.6 | 162.8 | -68.2 | 166.5 | 0 | 0 | 0 | 108.4 | A483 | A483-L485 VanDerWaalsContact C-N 3.27Å; A483-L485 PolarHBondContact O-N 2.89Å |
| 486 | P | 59 | Low | 55.4 | Low | 114 Ų | 114 | 116.8 Ų | 116.8 | 74% | 0.74 | 64% | 0.643 | S | S | * | * | P | Polyproline II helix | trans | -53.9 | 130.3 | 175.7 | 23.6 | -33.3 | 0 | 0 | 0 | 108.7 | S488 | P486-S488 PolarHBondContact O-N 3.39Š|
| 487 | P | 54.1 | Low | 56.7 | Low | 81 Ų | 81 | 115.2 Ų | 115.2 | 53% | 0.526 | 63% | 0.63 | S | S | . | * | P | Polyproline II helix | trans | -56.6 | 140.2 | -172.9 | 23.1 | -33.9 | 0 | 0 | 0 | 109.6 | E491 | P487-E491 HydrophobicContact CB-CB 4.47Š|
| 488 | S | 59.3 | Low | 58.3 | Low | 52 Ų | 52 | 114.3 Ų | 114.3 | 36% | 0.364 | 63% | 0.626 | S | S | . | * | P | Polyproline II helix | trans | -62.1 | 150.4 | -179.6 | 71.3 | 0 | 0 | 0 | 0 | 109.6 | P486 Q490 E491 Q492 | P486-S488 PolarHBondContact O-N 3.39Å; S488-Q490 PolarHBondContact O-N 3.08Å; S488-E491 WeakPolarHBondContact CB-OE2 3.46Å; S488-E491 PolarHBondContact N-OE2 2.88Å; S488-E491 PolarHBondContact O-N 2.99Å; S488-E491 PolarHBondContact OG-N 3.04Å; S488-E491 PolarHBondContact OG-OE2 2.92Å; S488-Q492 PolarHBondContact O-N 2.85Å |
| 489 | S | 64.3 | Low | 59.9 | Low | 104 Ų | 104 | 108.5 Ų | 108.5 | 73% | 0.727 | 61% | 0.611 | S | S | * | * | H | α-helix | trans | -58.4 | -19.9 | 178.2 | -46 | 0 | 0 | 0 | 0 | 112.6 | Q493 | S489-Q493 WeakPolarHBondContact O-CB 3.31Å; S489-Q493 PolarHBondContact O-N 3.04Å; S489-Q493 VanDerWaalsContact O-N 3.12Å |
| 490 | Q | 66.1 | Low | 61.8 | Low | 158 Ų | 158 | 111.5 Ų | 111.5 | 74% | 0.738 | 61% | 0.61 | S | S | * | * | H | α-helix | trans | -75 | -39.7 | 171.5 | -64.2 | -168 | -92.7 | 0 | 0 | 112.9 | S488 Q493 R494 | S488-Q490 PolarHBondContact O-N 3.08Å; Q490-Q493 PolarHBondContact O-N 3.03Å; Q490-R494 WeakPolarHBondContact O-CB 3.49Å; Q490-R494 WeakPolarHBondContact O-CG 3.47Å; Q490-R494 PolarHBondContact O-N 3.01Å |
| 491 | E | 64.6 | Low | 63.6 | Low | 116 Ų | 116 | 112 Ų | 112 | 54% | 0.542 | 61% | 0.607 | S | S | . | * | H | α-helix | trans | -69.2 | -40.9 | 176.3 | -72.7 | 154.6 | 129.5 | 0 | 0 | 111 | P487 S488 Q493 R494 Q495 | P487-E491 HydrophobicContact CB-CB 4.47Å; S488-E491 WeakPolarHBondContact CB-OE2 3.46Å; S488-E491 PolarHBondContact N-OE2 2.88Å; S488-E491 PolarHBondContact O-N 2.99Å; S488-E491 PolarHBondContact OG-N 3.04Å; S488-E491 PolarHBondContact OG-OE2 2.92Å; E491-Q493 VanDerWaalsContact C-N 3.33Å; E491-Q493 PolarHBondContact O-N 2.91Å; E491-R494 WeakPolarHBondContact O-CB 3.34Å; E491-R494 PolarHBondContact O-N 3Å; E491-R494 VanDerWaalsContact O-N 3.14Å; E491-Q495 PolarHBondContact O-N 2.91Å |
| 492 | Q | 65.3 | Low | 65.3 | Low | 112 Ų | 112 | 112.8 Ų | 112.8 | 52% | 0.523 | 61% | 0.605 | S | S | . | * | H | α-helix | trans | -62.6 | -39.9 | 174.1 | -158.9 | 170.3 | 10.8 | 0 | 0 | 111.5 | S488 Q495 I496 | S488-Q492 PolarHBondContact O-N 2.85Å; Q492-Q495 PolarHBondContact O-N 3.16Å; Q492-I496 WeakPolarHBondContact O-CD1 3.49Å; Q492-I496 VanDerWaalsContact O-CG1 3.31Å; Q492-I496 WeakPolarHBondContact O-CG1 3.5Å; Q492-I496 PolarHBondContact O-N 3.29Å |
| 493 | Q | 67.4 | Low | 66.8 | Low | 98 Ų | 98 | 110.9 Ų | 110.9 | 46% | 0.458 | 59% | 0.588 | S | S | . | * | H | α-helix | trans | -65 | -42 | 171 | -173.1 | 63.3 | 55.8 | 0 | 0 | 112.4 | S489 Q490 E491 Q495 I496 D497 | S489-Q493 WeakPolarHBondContact O-CB 3.31Å; S489-Q493 PolarHBondContact O-N 3.04Å; S489-Q493 VanDerWaalsContact O-N 3.12Å; Q490-Q493 PolarHBondContact O-N 3.03Å; E491-Q493 VanDerWaalsContact C-N 3.33Å; E491-Q493 PolarHBondContact O-N 2.91Å; Q493-Q495 PolarHBondContact O-N 3.23Å; Q493-I496 PolarHBondContact O-N 2.97Å; Q493-D497 PolarHBondContact NE2-OD1 3.26Å; Q493-D497 WeakPolarHBondContact O-CB 3.29Å; Q493-D497 PolarHBondContact O-N 3.5Å |
| 494 | R | 72.7 | Confident | 68.3 | Low | 166 Ų | 166 | 108.2 Ų | 108.2 | 63% | 0.626 | 56% | 0.563 | S | S | * | * | H | α-helix | trans | -60.3 | -31.2 | 176.7 | -69.1 | -101.4 | 66.9 | -178.5 | -0.1 | 112.6 | Q490 E491 D497 Q498 | Q490-R494 WeakPolarHBondContact O-CB 3.49Å; Q490-R494 WeakPolarHBondContact O-CG 3.47Å; Q490-R494 PolarHBondContact O-N 3.01Å; E491-R494 WeakPolarHBondContact O-CB 3.34Å; E491-R494 PolarHBondContact O-N 3Å; E491-R494 VanDerWaalsContact O-N 3.14Å; R494-D497 IonicContact NE-OD2 3.97Å; R494-D497 IonicContact NH2-OD2 2.72Å; R494-Q498 WeakPolarHBondContact O-CB 3.36Å; R494-Q498 PolarHBondContact O-N 3.3Å |
| 495 | Q | 70.7 | Confident | 69.7 | Low | 122 Ų | 122 | 103.8 Ų | 103.8 | 57% | 0.57 | 54% | 0.544 | S | S | * | . | H | α-helix | trans | -76.1 | -47 | 177.5 | -154.9 | 160 | 6.7 | 0 | 0 | 110.6 | E491 Q492 Q493 D497 Q498 D499 | E491-Q495 PolarHBondContact O-N 2.91Å; Q492-Q495 PolarHBondContact O-N 3.16Å; Q493-Q495 PolarHBondContact O-N 3.23Å; Q495-D497 VanDerWaalsContact C-N 3.33Å; Q495-D497 PolarHBondContact O-N 3.23Å; Q495-Q498 WeakPolarHBondContact O-CB 3.41Å; Q495-Q498 PolarHBondContact O-N 3.36Å; Q495-D499 PolarHBondContact O-N 2.97Å |
| 496 | I | 72.4 | Confident | 70.2 | Confident | 93 Ų | 93 | 101.6 Ų | 101.6 | 48% | 0.477 | 53% | 0.533 | S | S | . | . | H | α-helix | trans | -57.1 | -43.7 | 171.8 | -66.8 | 163.1 | 0 | 0 | 0 | 111.8 | Q492 Q493 Q498 Y500 | Q492-I496 WeakPolarHBondContact O-CD1 3.49Å; Q492-I496 VanDerWaalsContact O-CG1 3.31Å; Q492-I496 WeakPolarHBondContact O-CG1 3.5Å; Q492-I496 PolarHBondContact O-N 3.29Å; Q493-I496 PolarHBondContact O-N 2.97Å; I496-Q498 PolarHBondContact O-N 3.39Å; I496-Y500 WeakPolarHBondContact O-CB 3.49Å; I496-Y500 PolarHBondContact O-N 2.89Å |
| 497 | D | 74.9 | Confident | 70.6 | Confident | 66 Ų | 66 | 102.6 Ų | 102.6 | 35% | 0.353 | 53% | 0.528 | S | S | . | . | H | α-helix | trans | -59.7 | -35.2 | 175.9 | -66.8 | -11.3 | 0 | 0 | 0 | 112 | Q493 R494 Q495 L501 | Q493-D497 PolarHBondContact NE2-OD1 3.26Å; Q493-D497 WeakPolarHBondContact O-CB 3.29Å; Q493-D497 PolarHBondContact O-N 3.5Å; R494-D497 IonicContact NE-OD2 3.97Å; R494-D497 IonicContact NH2-OD2 2.72Å; Q495-D497 VanDerWaalsContact C-N 3.33Å; Q495-D497 PolarHBondContact O-N 3.23Å; D497-L501 WeakPolarHBondContact O-CB 3.35Å; D497-L501 PolarHBondContact O-N 3.02Å |
| 498 | Q | 72.8 | Confident | 71.1 | Confident | 131 Ų | 131 | 104.7 Ų | 104.7 | 61% | 0.612 | 53% | 0.531 | S | S | * | . | H | α-helix | trans | -77 | -47.4 | -177.9 | -169 | 174.8 | 134.8 | 0 | 0 | 111.1 | R494 Q495 I496 Y500 L501 V502 | R494-Q498 WeakPolarHBondContact O-CB 3.36Å; R494-Q498 PolarHBondContact O-N 3.3Å; Q495-Q498 WeakPolarHBondContact O-CB 3.41Å; Q495-Q498 PolarHBondContact O-N 3.36Å; I496-Q498 PolarHBondContact O-N 3.39Å; Q498-Y500 VanDerWaalsContact C-N 3.3Å; Q498-Y500 PolarHBondContact O-N 3.02Å; Q498-L501 PolarHBondContact O-N 2.68Å; Q498-L501 VanDerWaalsContact O-N 3.14Å; Q498-V502 WeakPolarHBondContact O-CG2 3.38Å; Q498-V502 PolarHBondContact O-N 3.07Å |
| 499 | D | 73.7 | Confident | 71 | Confident | 102 Ų | 102 | 109.3 Ų | 109.3 | 55% | 0.545 | 55% | 0.546 | S | S | . | . | H | α-helix | trans | -62.4 | -39.6 | 176.6 | -63.8 | -22.1 | 0 | 0 | 0 | 110.9 | Q495 V502 A503 | Q495-D499 PolarHBondContact O-N 2.97Å; D499-V502 PolarHBondContact O-N 3Å; D499-A503 WeakPolarHBondContact O-CB 3.36Å; D499-A503 PolarHBondContact O-N 3Å |
| 500 | Y | 77.9 | Confident | 70.4 | Confident | 166 Ų | 166 | 112.1 Ų | 112.1 | 65% | 0.651 | 55% | 0.548 | S | S | * | . | H | α-helix | trans | -61.3 | -42.7 | 172.7 | -178.3 | -99.2 | 0 | 0 | 0 | 112.3 | I496 Q498 A503 V504 | I496-Y500 WeakPolarHBondContact O-CB 3.49Å; I496-Y500 PolarHBondContact O-N 2.89Å; Q498-Y500 VanDerWaalsContact C-N 3.3Å; Q498-Y500 PolarHBondContact O-N 3.02Å; Y500-A503 PolarHBondContact O-N 2.91Å; Y500-V504 HydrophobicContact CD1-CG2 4.26Å; Y500-V504 HydrophobicContact CE1-CG2 3.86Å; Y500-V504 HydrophobicContact CE2-CG2 4.21Å; Y500-V504 WeakPolarHBondContact O-CB 3.47Å; Y500-V504 WeakPolarHBondContact O-CG2 3.32Å; Y500-V504 PolarHBondContact O-N 3.21Å |
| 501 | L | 79.4 | Confident | 69.5 | Low | 116 Ų | 116 | 112.9 Ų | 112.9 | 61% | 0.607 | 55% | 0.551 | S | S | * | * | H | α-helix | trans | -67 | -36.1 | 178.3 | -163.8 | 69.8 | 0 | 0 | 0 | 112.3 | D497 Q498 S505 | D497-L501 WeakPolarHBondContact O-CB 3.35Å; D497-L501 PolarHBondContact O-N 3.02Å; Q498-L501 PolarHBondContact O-N 2.68Å; Q498-L501 VanDerWaalsContact O-N 3.14Å; L501-S505 WeakPolarHBondContact O-CB 3.45Å; L501-S505 PolarHBondContact O-N 3.07Å; L501-S505 PolarHBondContact O-OG 3.5Å |
| 502 | V | 79.1 | Confident | 68.6 | Low | 83 Ų | 83 | 110.5 Ų | 110.5 | 50% | 0.503 | 56% | 0.558 | S | S | . | * | H | α-helix | trans | -66.6 | -45.6 | 172.4 | 172.9 | 0 | 0 | 0 | 0 | 111.2 | Q498 D499 V504 S505 L506 | Q498-V502 WeakPolarHBondContact O-CG2 3.38Å; Q498-V502 PolarHBondContact O-N 3.07Å; D499-V502 PolarHBondContact O-N 3Å; V502-V504 PolarHBondContact O-N 2.82Å; V502-S505 WeakPolarHBondContact O-CB 3.47Å; V502-S505 PolarHBondContact O-N 3.15Å; V502-S505 VanDerWaalsContact O-N 3.17Å; V502-L506 HydrophobicContact CG1-CD1 4.24Å; V502-L506 PolarHBondContact O-N 3.17Å |
| 503 | A | 73.9 | Confident | 67.4 | Low | 55 Ų | 55 | 108.8 Ų | 108.8 | 46% | 0.455 | 56% | 0.563 | S | S | . | * | H | α-helix | trans | -60.7 | -45 | 177.6 | 0 | 0 | 0 | 0 | 0 | 112.3 | D499 Y500 S505 L506 Q507 | D499-A503 WeakPolarHBondContact O-CB 3.36Å; D499-A503 PolarHBondContact O-N 3Å; Y500-A503 PolarHBondContact O-N 2.91Å; A503-S505 VanDerWaalsContact C-N 3.31Å; A503-S505 PolarHBondContact O-N 3.09Å; A503-L506 PolarHBondContact O-N 2.68Å; A503-Q507 PolarHBondContact O-N 3.01Å |
| 504 | V | 78.9 | Confident | 66.7 | Low | 38 Ų | 38 | 110.9 Ų | 110.9 | 23% | 0.23 | 59% | 0.585 | C | S | . | * | H | α-helix | trans | -63.8 | -35.5 | 175.3 | 171.1 | 0 | 0 | 0 | 0 | 111.8 | Y500 V502 Q507 Q508 | Y500-V504 HydrophobicContact CD1-CG2 4.26Å; Y500-V504 HydrophobicContact CE1-CG2 3.86Å; Y500-V504 HydrophobicContact CE2-CG2 4.21Å; Y500-V504 WeakPolarHBondContact O-CB 3.47Å; Y500-V504 WeakPolarHBondContact O-CG2 3.32Å; Y500-V504 PolarHBondContact O-N 3.21Å; V502-V504 PolarHBondContact O-N 2.82Å; V504-Q507 PolarHBondContact O-N 2.88Å; V504-Q508 WeakPolarHBondContact O-CG 3.47Å; V504-Q508 PolarHBondContact O-N 3.19Å |
| 505 | S | 75.5 | Confident | 65.8 | Low | 58 Ų | 58 | 105.6 Ų | 105.6 | 41% | 0.406 | 58% | 0.583 | S | S | . | * | H | α-helix | trans | -67.2 | -42.3 | 176.6 | -59.1 | 0 | 0 | 0 | 0 | 112.3 | L501 V502 A503 Q508 Q509 | L501-S505 WeakPolarHBondContact O-CB 3.45Å; L501-S505 PolarHBondContact O-N 3.07Å; L501-S505 PolarHBondContact O-OG 3.5Å; V502-S505 WeakPolarHBondContact O-CB 3.47Å; V502-S505 PolarHBondContact O-N 3.15Å; V502-S505 VanDerWaalsContact O-N 3.17Å; A503-S505 VanDerWaalsContact C-N 3.31Å; A503-S505 PolarHBondContact O-N 3.09Å; S505-Q508 PolarHBondContact O-N 2.8Å; S505-Q509 WeakPolarHBondContact O-CG 3.45Å; S505-Q509 PolarHBondContact O-N 3.18Å; S505-Q509 VanDerWaalsContact O-N 3.08Å |
| 506 | L | 72.6 | Confident | 65 | Low | 103 Ų | 103 | 106.1 Ų | 106.1 | 54% | 0.539 | 60% | 0.596 | S | S | . | * | H | α-helix | trans | -61 | -42.9 | 172.9 | -91.5 | 157.1 | 0 | 0 | 0 | 111.9 | V502 A503 Q509 Q510 | V502-L506 HydrophobicContact CG1-CD1 4.24Å; V502-L506 PolarHBondContact O-N 3.17Å; A503-L506 PolarHBondContact O-N 2.68Å; L506-Q509 PolarHBondContact O-N 3.03Å; L506-Q510 PolarHBondContact O-N 3.45Å |
| 507 | Q | 67.8 | Low | 64.2 | Low | 134 Ų | 134 | 106.4 Ų | 106.4 | 63% | 0.626 | 60% | 0.598 | S | S | * | * | H | α-helix | trans | -65.5 | -41.8 | 178.6 | -165 | 168.8 | 23.7 | 0 | 0 | 112.1 | A503 V504 Q509 Q510 | A503-Q507 PolarHBondContact O-N 3.01Å; V504-Q507 PolarHBondContact O-N 2.88Å; Q507-Q509 VanDerWaalsContact C-N 3.33Å; Q507-Q509 PolarHBondContact O-N 3.3Å; Q507-Q510 PolarHBondContact O-N 3.47Å |
| 508 | Q | 63.2 | Low | 63.9 | Low | 126 Ų | 126 | 106.4 Ų | 106.4 | 59% | 0.589 | 60% | 0.603 | S | S | * | * | H | α-helix | trans | -68.2 | -28.6 | 175.8 | -72.5 | 177.4 | 20.2 | 0 | 0 | 113.3 | V504 S505 Q510 E511 | V504-Q508 WeakPolarHBondContact O-CG 3.47Å; V504-Q508 PolarHBondContact O-N 3.19Å; S505-Q508 PolarHBondContact O-N 2.8Å; Q508-Q510 VanDerWaalsContact C-N 3.26Å; Q508-Q510 PolarHBondContact O-N 3.47Å; Q508-E511 PolarHBondContact O-N 3.05Å |
| 509 | Q | 57.3 | Low | 63.2 | Low | 149 Ų | 149 | 106.7 Ų | 106.7 | 70% | 0.696 | 61% | 0.609 | S | S | * | * | H | α-helix | trans | -69.1 | -23.2 | 174.2 | -77.9 | -177.2 | -10.1 | 0 | 0 | 113.1 | S505 L506 Q507 | S505-Q509 WeakPolarHBondContact O-CG 3.45Å; S505-Q509 PolarHBondContact O-N 3.18Å; S505-Q509 VanDerWaalsContact O-N 3.08Å; L506-Q509 PolarHBondContact O-N 3.03Å; Q507-Q509 VanDerWaalsContact C-N 3.33Å; Q507-Q509 PolarHBondContact O-N 3.3Å |
| 510 | Q | 52.1 | Low | 63.1 | Low | 163 Ų | 163 | 108.5 Ų | 108.5 | 76% | 0.762 | 62% | 0.618 | S | S | * | * | H | α-helix | trans | -77.9 | -21.4 | 175.8 | -69.7 | -177.6 | -19.4 | 0 | 0 | 113.5 | L506 Q507 Q508 G512 | L506-Q510 PolarHBondContact O-N 3.45Å; Q507-Q510 PolarHBondContact O-N 3.47Å; Q508-Q510 VanDerWaalsContact C-N 3.26Å; Q508-Q510 PolarHBondContact O-N 3.47Å; Q510-G512 VanDerWaalsContact C-N 3.26Å; Q510-G512 PolarHBondContact O-N 3.35Å |
| 511 | E | 47.6 | Very low | 63.1 | Low | 173 Ų | 173 | 105.9 Ų | 105.9 | 81% | 0.808 | 61% | 0.612 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -81 | -2.3 | 174.9 | -61.2 | -171.5 | 136.7 | 0 | 0 | 113.3 | Q508 | Q508-E511 PolarHBondContact O-N 3.05Š|
| 512 | G | 46.2 | Very low | 63 | Low | 66 Ų | 66 | 103.8 Ų | 103.8 | 68% | 0.68 | 60% | 0.601 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -99.8 | -4.7 | -166.3 | 0 | 0 | 0 | 0 | 0 | 117.8 | Q510 | Q510-G512 VanDerWaalsContact C-N 3.26Å; Q510-G512 PolarHBondContact O-N 3.35Å |
| 513 | A | 39.9 | Very low | 63 | Low | 76 Ų | 76 | 102.6 Ų | 102.6 | 63% | 0.628 | 60% | 0.6 | S | S | * | * | trans | -132.8 | 130.9 | -171 | 0 | 0 | 0 | 0 | 0 | 113.2 | G515 | A513-G515 VanDerWaalsContact C-N 3.27Å; A513-G515 PolarHBondContact O-N 3.49Å | ||
| 514 | P | 51.3 | Low | 63.4 | Low | 143 Ų | 143 | 108.2 Ų | 108.2 | 93% | 0.929 | 61% | 0.609 | S | S | * | * | trans | -78.5 | 74.3 | 175.9 | 33.1 | -34.8 | 0 | 0 | 0 | 111.2 | ||||
| 515 | G | 55.3 | Low | 63.6 | Low | 55 Ų | 55 | 110.7 Ų | 110.7 | 57% | 0.567 | 62% | 0.618 | S | S | * | * | trans | -81.3 | -176.8 | 168.1 | 0 | 0 | 0 | 0 | 0 | 112.9 | A513 | A513-G515 VanDerWaalsContact C-N 3.27Å; A513-G515 PolarHBondContact O-N 3.49Å | ||
| 516 | P | 53.1 | Low | 63.9 | Low | 132 Ų | 132 | 112.7 Ų | 112.7 | 86% | 0.857 | 62% | 0.624 | S | S | * | * | S | Bend | trans | -60.5 | 157.9 | 164.4 | 29.8 | -34.9 | 0 | 0 | 0 | 110.7 | S518 | P516-S518 PolarHBondContact O-N 3.39Š|
| 517 | L | 54.8 | Low | 64.4 | Low | 100 Ų | 100 | 114.3 Ų | 114.3 | 52% | 0.524 | 63% | 0.629 | S | S | . | * | trans | -43.3 | 133.5 | -178.4 | -67.3 | 168 | 0 | 0 | 0 | 111.8 | ||||
| 518 | S | 68.6 | Low | 65.1 | Low | 65 Ų | 65 | 113.4 Ų | 113.4 | 46% | 0.455 | 62% | 0.624 | S | S | . | * | trans | -59.7 | 143.9 | 176 | -179.1 | 0 | 0 | 0 | 0 | 110.1 | P516 L520 E521 L522 | P516-S518 PolarHBondContact O-N 3.39Å; S518-L520 PolarHBondContact O-N 2.89Å; S518-E521 PolarHBondContact N-OE2 3.28Å; S518-E521 WeakPolarHBondContact O-CA 3.28Å; S518-E521 WeakPolarHBondContact O-CB 3.24Å; S518-E521 PolarHBondContact O-N 2.99Å; S518-L522 PolarHBondContact O-N 3.26Å | ||
| 519 | D | 58.7 | Low | 66.1 | Low | 137 Ų | 137 | 111.9 Ų | 111.9 | 73% | 0.733 | 62% | 0.617 | S | S | * | * | H | α-helix | trans | -52 | -32.2 | 176.7 | -72.5 | -19.4 | 0 | 0 | 0 | 112.2 | A523 | D519-A523 WeakPolarHBondContact O-CB 3.45Å; D519-A523 PolarHBondContact O-N 3.16Å |
| 520 | L | 71.6 | Confident | 67.3 | Low | 141 Ų | 141 | 110.9 Ų | 110.9 | 74% | 0.738 | 61% | 0.613 | S | S | * | * | H | α-helix | trans | -65 | -40.6 | 174.4 | -169 | 81.2 | 0 | 0 | 0 | 112.6 | S518 R524 | S518-L520 PolarHBondContact O-N 2.89Å; L520-R524 VanDerWaalsContact O-CB 3.25Å; L520-R524 WeakPolarHBondContact O-CB 3.38Å; L520-R524 PolarHBondContact O-N 3.32Å; L520-R524 VanDerWaalsContact O-N 3.13Å |
| 521 | E | 78 | Confident | 68.7 | Low | 110 Ų | 110 | 110.3 Ų | 110.3 | 51% | 0.514 | 61% | 0.605 | S | S | . | * | H | α-helix | trans | -74.1 | -42.6 | 178.2 | -64.2 | 179.8 | 118.9 | 0 | 0 | 111 | S518 R524 Q525 | S518-E521 PolarHBondContact N-OE2 3.28Å; S518-E521 WeakPolarHBondContact O-CA 3.28Å; S518-E521 WeakPolarHBondContact O-CB 3.24Å; S518-E521 PolarHBondContact O-N 2.99Å; E521-R524 PolarHBondContact O-N 2.89Å; E521-Q525 PolarHBondContact O-N 3.39Å |
| 522 | L | 77 | Confident | 70.4 | Confident | 73 Ų | 73 | 107.6 Ų | 107.6 | 38% | 0.382 | 59% | 0.592 | S | S | . | * | H | α-helix | trans | -63.6 | -46.2 | 176.9 | -178.3 | 59.9 | 0 | 0 | 0 | 111.4 | S518 R524 Q525 L526 | S518-L522 PolarHBondContact O-N 3.26Å; L522-R524 VanDerWaalsContact C-N 3.29Å; L522-R524 PolarHBondContact O-N 3.09Å; L522-Q525 PolarHBondContact O-N 3.38Å; L522-L526 HydrophobicContact CD1-CD1 4.41Å; L522-L526 HydrophobicContact CD1-CG 4.47Å; L522-L526 HydrophobicContact CG-CD1 4.22Å; L522-L526 WeakPolarHBondContact O-CG 3.44Å; L522-L526 PolarHBondContact O-N 3.02Å |
| 523 | A | 78.8 | Confident | 72.1 | Confident | 58 Ų | 58 | 110.9 Ų | 110.9 | 48% | 0.479 | 59% | 0.589 | S | S | . | * | H | α-helix | trans | -60.3 | -39.5 | 174 | 0 | 0 | 0 | 0 | 0 | 111.9 | D519 Q527 | D519-A523 WeakPolarHBondContact O-CB 3.45Å; D519-A523 PolarHBondContact O-N 3.16Å; A523-Q527 VanDerWaalsContact O-CB 3.29Å; A523-Q527 WeakPolarHBondContact O-CB 3.46Å; A523-Q527 PolarHBondContact O-N 2.62Å |
| 524 | R | 82.8 | Confident | 73.9 | Confident | 173 Ų | 173 | 112.1 Ų | 112.1 | 65% | 0.653 | 58% | 0.582 | S | S | * | * | H | α-helix | trans | -67.8 | -35.7 | 176.1 | -174.7 | 179.9 | 178.7 | 117.1 | 1.6 | 112.7 | L520 E521 L522 Q528 | L520-R524 VanDerWaalsContact O-CB 3.25Å; L520-R524 WeakPolarHBondContact O-CB 3.38Å; L520-R524 PolarHBondContact O-N 3.32Å; L520-R524 VanDerWaalsContact O-N 3.13Å; E521-R524 PolarHBondContact O-N 2.89Å; L522-R524 VanDerWaalsContact C-N 3.29Å; L522-R524 PolarHBondContact O-N 3.09Å; R524-Q528 PolarHBondContact O-N 2.66Å |
| 525 | Q | 83.5 | Confident | 75 | Confident | 90 Ų | 90 | 109.8 Ų | 109.8 | 42% | 0.421 | 56% | 0.559 | S | S | . | * | H | α-helix | trans | -68 | -49.9 | 174.3 | -178.3 | 177.3 | -29.1 | 0 | 0 | 110.9 | E521 L522 Q527 Q528 E529 | E521-Q525 PolarHBondContact O-N 3.39Å; L522-Q525 PolarHBondContact O-N 3.38Å; Q525-Q527 VanDerWaalsContact C-N 3.29Å; Q525-Q527 PolarHBondContact O-N 2.99Å; Q525-Q528 WeakPolarHBondContact O-CA 3.35Å; Q525-Q528 WeakPolarHBondContact O-CB 3.14Å; Q525-Q528 PolarHBondContact O-N 2.62Å; Q525-E529 WeakPolarHBondContact CG-OE1 3.46Å; Q525-E529 PolarHBondContact NE2-OE1 2.85Å; Q525-E529 PolarHBondContact O-N 2.9Å |
| 526 | L | 80.8 | Confident | 75.8 | Confident | 99 Ų | 99 | 112.6 Ų | 112.6 | 52% | 0.518 | 56% | 0.557 | S | S | . | * | H | α-helix | trans | -57 | -42.8 | 177.6 | -71.2 | 169.5 | 0 | 0 | 0 | 111.6 | L522 Q528 E529 E530 | L522-L526 HydrophobicContact CD1-CD1 4.41Å; L522-L526 HydrophobicContact CD1-CG 4.47Å; L522-L526 HydrophobicContact CG-CD1 4.22Å; L522-L526 WeakPolarHBondContact O-CG 3.44Å; L522-L526 PolarHBondContact O-N 3.02Å; L526-Q528 VanDerWaalsContact C-N 3.29Å; L526-Q528 PolarHBondContact O-N 3.02Å; L526-E529 PolarHBondContact O-N 3.28Å; L526-E530 PolarHBondContact O-N 3.39Å |
| 527 | Q | 83.2 | Confident | 76.7 | Confident | 138 Ų | 138 | 111 Ų | 111 | 65% | 0.645 | 54% | 0.541 | S | S | * | . | H | α-helix | trans | -63.1 | -31 | 174.7 | -175 | 172.3 | 75.3 | 0 | 0 | 113.1 | A523 Q525 Y531 | A523-Q527 VanDerWaalsContact O-CB 3.29Å; A523-Q527 WeakPolarHBondContact O-CB 3.46Å; A523-Q527 PolarHBondContact O-N 2.62Å; Q525-Q527 VanDerWaalsContact C-N 3.29Å; Q525-Q527 PolarHBondContact O-N 2.99Å; Q527-Y531 WeakPolarHBondContact O-CB 3.49Å; Q527-Y531 PolarHBondContact O-N 3.16Å |
| 528 | Q | 83.9 | Confident | 77.3 | Confident | 114 Ų | 114 | 112.6 Ų | 112.6 | 53% | 0.533 | 55% | 0.546 | S | S | . | . | H | α-helix | trans | -76 | -35.9 | 172.7 | -78.5 | -167.5 | -24.6 | 0 | 0 | 113.1 | R524 Q525 L526 Y531 Q532 | R524-Q528 PolarHBondContact O-N 2.66Å; Q525-Q528 WeakPolarHBondContact O-CA 3.35Å; Q525-Q528 WeakPolarHBondContact O-CB 3.14Å; Q525-Q528 PolarHBondContact O-N 2.62Å; L526-Q528 VanDerWaalsContact C-N 3.29Å; L526-Q528 PolarHBondContact O-N 3.02Å; Q528-Y531 PolarHBondContact O-N 3.04Å; Q528-Q532 WeakPolarHBondContact O-CG 3.36Å; Q528-Q532 PolarHBondContact O-N 3.39Å |
| 529 | E | 84.1 | Confident | 77 | Confident | 95 Ų | 95 | 116.2 Ų | 116.2 | 44% | 0.444 | 56% | 0.555 | S | S | . | * | H | α-helix | trans | -67.8 | -43.1 | 176.7 | -71.2 | 179.3 | -161.6 | 0 | 0 | 111.4 | Q525 L526 Y531 Q532 Q533 | Q525-E529 WeakPolarHBondContact CG-OE1 3.46Å; Q525-E529 PolarHBondContact NE2-OE1 2.85Å; Q525-E529 PolarHBondContact O-N 2.9Å; L526-E529 PolarHBondContact O-N 3.28Å; E529-Y531 PolarHBondContact O-N 3.5Å; E529-Q532 PolarHBondContact O-N 3.04Å; E529-Q533 WeakPolarHBondContact O-CB 3.42Å; E529-Q533 PolarHBondContact O-N 3.33Å |
| 530 | E | 83.1 | Confident | 77 | Confident | 127 Ų | 127 | 117 Ų | 117 | 59% | 0.593 | 56% | 0.555 | S | S | * | * | H | α-helix | trans | -58.9 | -46.3 | 172.8 | -172.9 | -178.9 | -160.3 | 0 | 0 | 111.4 | L526 Q532 Q533 Q534 | L526-E530 PolarHBondContact O-N 3.39Å; E530-Q532 VanDerWaalsContact C-N 3.32Å; E530-Q532 PolarHBondContact O-N 2.9Å; E530-Q533 PolarHBondContact O-N 2.87Å; E530-Q534 WeakPolarHBondContact O-CB 3.46Å; E530-Q534 PolarHBondContact O-N 3.49Å |
| 531 | Y | 81.1 | Confident | 76.3 | Confident | 152 Ų | 152 | 118.5 Ų | 118.5 | 60% | 0.596 | 56% | 0.558 | S | S | * | * | H | α-helix | trans | -64.4 | -34.8 | 179.6 | -153.2 | -99.5 | 0 | 0 | 0 | 112.8 | Q527 Q528 E529 Q535 | Q527-Y531 WeakPolarHBondContact O-CB 3.49Å; Q527-Y531 PolarHBondContact O-N 3.16Å; Q528-Y531 PolarHBondContact O-N 3.04Å; E529-Y531 PolarHBondContact O-N 3.5Å; Y531-Q535 VanDerWaalsContact CE1-NE2 3.31Å; Y531-Q535 WeakPolarHBondContact O-CG 3.26Å; Y531-Q535 PolarHBondContact O-N 2.91Å; Y531-Q535 VanDerWaalsContact O-N 3.13Å |
| 532 | Q | 83.4 | Confident | 75.3 | Confident | 115 Ų | 115 | 116.9 Ų | 116.9 | 54% | 0.537 | 56% | 0.564 | S | S | . | * | H | α-helix | trans | -69.4 | -42.7 | 172.7 | -74.9 | -179.1 | 54 | 0 | 0 | 112 | Q528 E529 E530 Q534 Q535 Q536 | Q528-Q532 WeakPolarHBondContact O-CG 3.36Å; Q528-Q532 PolarHBondContact O-N 3.39Å; E529-Q532 PolarHBondContact O-N 3.04Å; E530-Q532 VanDerWaalsContact C-N 3.32Å; E530-Q532 PolarHBondContact O-N 2.9Å; Q532-Q534 VanDerWaalsContact C-N 3.33Å; Q532-Q534 PolarHBondContact O-N 3.37Å; Q532-Q535 PolarHBondContact O-N 3.11Å; Q532-Q536 WeakPolarHBondContact O-CG 3.22Å; Q532-Q536 PolarHBondContact O-N 3.29Å |
| 533 | Q | 80.8 | Confident | 73.9 | Confident | 135 Ų | 135 | 116.1 Ų | 116.1 | 63% | 0.631 | 57% | 0.574 | S | S | * | * | H | α-helix | trans | -63.6 | -40.8 | 178.5 | -157.6 | 178.4 | 117.2 | 0 | 0 | 111.1 | E529 E530 Q535 Q536 L537 | E529-Q533 WeakPolarHBondContact O-CB 3.42Å; E529-Q533 PolarHBondContact O-N 3.33Å; E530-Q533 PolarHBondContact O-N 2.87Å; Q533-Q535 PolarHBondContact O-N 3.35Å; Q533-Q536 PolarHBondContact O-N 3.35Å; Q533-L537 WeakPolarHBondContact O-CG 3.29Å; Q533-L537 PolarHBondContact O-N 3.42Å |
| 534 | Q | 77.4 | Confident | 72.3 | Confident | 103 Ų | 103 | 119.5 Ų | 119.5 | 48% | 0.481 | 59% | 0.591 | S | S | . | * | H | α-helix | trans | -65.8 | -36.1 | 175.6 | -159.5 | 174.6 | 102.7 | 0 | 0 | 112.5 | E530 Q532 L537 Q538 | E530-Q534 WeakPolarHBondContact O-CB 3.46Å; E530-Q534 PolarHBondContact O-N 3.49Å; Q532-Q534 VanDerWaalsContact C-N 3.33Å; Q532-Q534 PolarHBondContact O-N 3.37Å; Q534-L537 PolarHBondContact O-N 3.15Å; Q534-Q538 PolarHBondContact O-N 3.28Å; Q534-Q538 VanDerWaalsContact O-N 3.1Å |
| 535 | Q | 74.9 | Confident | 70.5 | Confident | 94 Ų | 94 | 115.9 Ų | 115.9 | 44% | 0.439 | 60% | 0.598 | S | S | . | * | H | α-helix | trans | -67.1 | -37.9 | 171.1 | -77.5 | -175.5 | 35.4 | 0 | 0 | 113.1 | Y531 Q532 Q533 Q538 Q539 | Y531-Q535 VanDerWaalsContact CE1-NE2 3.31Å; Y531-Q535 WeakPolarHBondContact O-CG 3.26Å; Y531-Q535 PolarHBondContact O-N 2.91Å; Y531-Q535 VanDerWaalsContact O-N 3.13Å; Q532-Q535 PolarHBondContact O-N 3.11Å; Q533-Q535 PolarHBondContact O-N 3.35Å; Q535-Q538 PolarHBondContact O-N 3.25Å; Q535-Q539 WeakPolarHBondContact O-CG 3.5Å; Q535-Q539 PolarHBondContact O-N 3.01Å |
| 536 | Q | 73.3 | Confident | 68.5 | Low | 113 Ų | 113 | 117.6 Ų | 117.6 | 53% | 0.528 | 62% | 0.617 | S | S | . | * | H | α-helix | trans | -65.5 | -39.1 | 175.2 | -70.3 | -175.2 | 25.7 | 0 | 0 | 111.7 | Q532 Q533 Q539 Q540 | Q532-Q536 WeakPolarHBondContact O-CG 3.22Å; Q532-Q536 PolarHBondContact O-N 3.29Å; Q533-Q536 PolarHBondContact O-N 3.35Å; Q536-Q539 PolarHBondContact O-N 3.25Å; Q536-Q540 WeakPolarHBondContact O-CG 3.4Å; Q536-Q540 PolarHBondContact O-N 3.08Å |
| 537 | L | 70.7 | Confident | 66.3 | Low | 99 Ų | 99 | 119.4 Ų | 119.4 | 52% | 0.518 | 63% | 0.632 | S | S | . | * | H | α-helix | trans | -61.9 | -42.2 | 173.8 | -74.1 | 165.1 | 0 | 0 | 0 | 112.2 | Q533 Q534 Q540 Q541 | Q533-L537 WeakPolarHBondContact O-CG 3.29Å; Q533-L537 PolarHBondContact O-N 3.42Å; Q534-L537 PolarHBondContact O-N 3.15Å; L537-Q540 PolarHBondContact O-N 3.2Å; L537-Q541 PolarHBondContact O-N 3.39Å |
| 538 | Q | 66.9 | Low | 64.5 | Low | 133 Ų | 133 | 118.4 Ų | 118.4 | 62% | 0.621 | 64% | 0.637 | S | S | * | * | H | α-helix | trans | -65.3 | -38.9 | 174.1 | -74.5 | -174.4 | 6.1 | 0 | 0 | 112.8 | Q534 Q535 Q540 Q541 A542 | Q534-Q538 PolarHBondContact O-N 3.28Å; Q534-Q538 VanDerWaalsContact O-N 3.1Å; Q535-Q538 PolarHBondContact O-N 3.25Å; Q538-Q540 VanDerWaalsContact C-N 3.34Å; Q538-Q540 PolarHBondContact O-N 3.07Å; Q538-Q541 PolarHBondContact O-N 3.19Å; Q538-A542 PolarHBondContact O-N 3.32Å |
| 539 | Q | 62.1 | Low | 62 | Low | 141 Ų | 141 | 121.2 Ų | 121.2 | 66% | 0.659 | 65% | 0.651 | S | S | * | * | H | α-helix | trans | -67.4 | -32.5 | 175.9 | -72.6 | -178.8 | 47.2 | 0 | 0 | 112.8 | Q535 Q536 A542 | Q535-Q539 WeakPolarHBondContact O-CG 3.5Å; Q535-Q539 PolarHBondContact O-N 3.01Å; Q536-Q539 PolarHBondContact O-N 3.25Å; Q539-A542 PolarHBondContact O-N 2.96Å |
| 540 | Q | 59.4 | Low | 59.6 | Low | 153 Ų | 153 | 124.3 Ų | 124.3 | 72% | 0.715 | 67% | 0.665 | S | S | * | * | H | α-helix | trans | -73.4 | -24.1 | 175.8 | -71.7 | -178.6 | 34.9 | 0 | 0 | 113.6 | Q536 L537 Q538 | Q536-Q540 WeakPolarHBondContact O-CG 3.4Å; Q536-Q540 PolarHBondContact O-N 3.08Å; L537-Q540 PolarHBondContact O-N 3.2Å; Q538-Q540 VanDerWaalsContact C-N 3.34Å; Q538-Q540 PolarHBondContact O-N 3.07Å |
| 541 | Q | 56.8 | Low | 57.1 | Low | 173 Ų | 173 | 124.7 Ų | 124.7 | 81% | 0.808 | 68% | 0.675 | S | S | * | * | H | α-helix | trans | -81.7 | -16.4 | 170.8 | -67 | -171.3 | 7.9 | 0 | 0 | 113.3 | L537 Q538 G543 | L537-Q541 PolarHBondContact O-N 3.39Å; Q538-Q541 PolarHBondContact O-N 3.19Å; Q541-G543 PolarHBondContact O-N 3.37Å |
| 542 | A | 57.9 | Low | 54.7 | Low | 77 Ų | 77 | 129.4 Ų | 129.4 | 64% | 0.636 | 69% | 0.692 | S | S | * | * | trans | -81.7 | 50.1 | 177.7 | 0 | 0 | 0 | 0 | 0 | 113.5 | Q538 Q539 | Q538-A542 PolarHBondContact O-N 3.32Å; Q539-A542 PolarHBondContact O-N 2.96Å | ||
| 543 | G | 46.5 | Very low | 52.1 | Low | 57 Ų | 57 | 127.6 Ų | 127.6 | 59% | 0.588 | 70% | 0.704 | S | S | * | * | P | Polyproline II helix | trans | -61.5 | 147.2 | 172.7 | 0 | 0 | 0 | 0 | 0 | 112.5 | Q541 | Q541-G543 PolarHBondContact O-N 3.37Š|
| 544 | P | 45.2 | Very low | 49.9 | Very low | 129 Ų | 129 | 131 Ų | 131 | 84% | 0.838 | 72% | 0.72 | S | S | * | * | P | Polyproline II helix | trans | -68.6 | 137.6 | -169.1 | 26.8 | -35.1 | 0 | 0 | 0 | 113.4 | ||
| 545 | A | 45.8 | Very low | 47.6 | Very low | 97 Ų | 97 | 130.1 Ų | 130.1 | 80% | 0.802 | 74% | 0.739 | S | S | * | * | P | Polyproline II helix | trans | -66.2 | 131.1 | 178 | 0 | 0 | 0 | 0 | 0 | 112.1 | ||
| 546 | P | 40.9 | Very low | 45.6 | Very low | 126 Ų | 126 | 130.7 Ų | 130.7 | 82% | 0.818 | 75% | 0.753 | S | S | * | * | P | Polyproline II helix | trans | -76.7 | 134.3 | 178.9 | 30.1 | -34.1 | 0 | 0 | 0 | 112 | ||
| 547 | T | 36.1 | Very low | 43.8 | Very low | 136 Ų | 136 | 133 Ų | 133 | 83% | 0.834 | 76% | 0.764 | S | S | * | * | P | Polyproline II helix | trans | -75.7 | 146.3 | 169.8 | 37.6 | 0 | 0 | 0 | 0 | 111.6 | ||
| 548 | P | 44.2 | Very low | 42.1 | Very low | 117 Ų | 117 | 137 Ų | 137 | 76% | 0.76 | 78% | 0.78 | S | S | * | * | P | Polyproline II helix | trans | -94.5 | 129.5 | -170.2 | 34.1 | -33.3 | 0 | 0 | 0 | 113.6 | ||
| 549 | Q | 31.4 | Very low | 40.5 | Very low | 174 Ų | 174 | 134.7 Ų | 134.7 | 81% | 0.813 | 78% | 0.783 | S | S | * | * | trans | -157.9 | 112.5 | 147.7 | -121.7 | 165.5 | -3.8 | 0 | 0 | 116.5 | ||||
| 550 | Q | 33.1 | Very low | 39.2 | Very low | 160 Ų | 160 | 140.1 Ų | 140.1 | 75% | 0.748 | 80% | 0.798 | S | S | * | * | trans | 44.2 | 111 | 138.2 | -62 | 178.7 | -65.8 | 0 | 0 | 122.5 | ||||
| 551 | V | 32.3 | Very low | 38.2 | Very low | 134 Ų | 134 | 143.4 Ų | 143.4 | 81% | 0.812 | 80% | 0.803 | S | S | * | * | 43.6 | 116.3 | 126.9 | -156.4 | 0 | 0 | 0 | 0 | 119.3 | |||||
| 552 | R | 29.2 | Very low | 37.2 | Very low | 252 Ų | 252 | 146.8 Ų | 146.8 | 95% | 0.951 | 81% | 0.809 | S | S | * | * | 154.8 | 135.7 | 106.6 | -163.6 | 170.9 | -169.5 | 170.5 | 1.7 | 112.6 | |||||
| 553 | G | 30.3 | Very low | 36.3 | Very low | 76 Ų | 76 | 150 Ų | 150 | 78% | 0.784 | 81% | 0.811 | S | S | * | * | trans | 153.4 | 129.8 | 163.4 | 0 | 0 | 0 | 0 | 0 | 114.2 | ||||
| 554 | Q | 33 | Very low | 35.7 | Very low | 208 Ų | 208 | 156.7 Ų | 156.7 | 97% | 0.972 | 82% | 0.824 | S | S | * | * | trans | -97.9 | 144.8 | 169.5 | -67 | 163.7 | -40.8 | 0 | 0 | 109.1 | ||||
| 555 | G | 30.4 | Very low | 35.5 | Very low | 84 Ų | 84 | 158.1 Ų | 158.1 | 87% | 0.866 | 82% | 0.819 | S | S | * | * | trans | -162.5 | 126.8 | 172.2 | 0 | 0 | 0 | 0 | 0 | 109.8 | ||||
| 556 | S | 33.1 | Very low | 35.2 | Very low | 105 Ų | 105 | 157.8 Ų | 157.8 | 73% | 0.734 | 81% | 0.811 | S | S | * | * | trans | -119.8 | 179.4 | -170.8 | 59.4 | 0 | 0 | 0 | 0 | 112.3 | ||||
| 557 | Q | 33.7 | Very low | 35.1 | Very low | 163 Ų | 163 | 158.7 Ų | 158.7 | 76% | 0.762 | 81% | 0.809 | S | S | * | * | trans | 88.5 | 110.7 | 176 | -55 | 177.4 | 23.9 | 0 | 0 | 113.4 | ||||
| 558 | Q | 35.6 | Very low | 34.9 | Very low | 183 Ų | 183 | 157.6 Ų | 157.6 | 86% | 0.855 | 81% | 0.805 | S | S | * | * | 73.9 | 144.1 | 80.2 | -74.3 | -179.1 | -8 | 0 | 0 | 113.7 | |||||
| 559 | A | 33.5 | Very low | 34.6 | Very low | 84 Ų | 84 | 158.2 Ų | 158.2 | 69% | 0.694 | 81% | 0.807 | S | S | * | * | cis | -175.5 | 150.3 | -20.7 | 0 | 0 | 0 | 0 | 0 | 109.1 | ||||
| 560 | R | 35.5 | Very low | 34.8 | Very low | 255 Ų | 255 | 157.2 Ų | 157.2 | 96% | 0.962 | 81% | 0.806 | S | S | * | * | trans | -168.6 | 142.4 | 141.4 | -106.9 | 158 | -167.6 | -153.5 | 0.8 | 111.8 | ||||
| 561 | R | 37.8 | Very low | 35.2 | Very low | 221 Ų | 221 | 160.7 Ų | 160.7 | 83% | 0.834 | 83% | 0.828 | S | S | * | * | trans | -95.8 | 152.7 | 179.3 | -73.1 | 172.9 | 158.5 | 165.4 | -10.2 | 111.3 | ||||
| 562 | R | 35.6 | Very low | 35.3 | Very low | 244 Ų | 244 | 162 Ų | 162 | 92% | 0.921 | 83% | 0.829 | S | S | * | * | -170.1 | 130.5 | 109 | -106.6 | 176.8 | 174.6 | 176.5 | -2.7 | 112 | |||||
| 563 | E | 39.3 | Very low | 35.6 | Very low | 146 Ų | 146 | 157.3 Ų | 157.3 | 68% | 0.682 | 82% | 0.822 | S | S | * | * | trans | -80.6 | 157.5 | 164.1 | -49.3 | 95.4 | 145.2 | 0 | 0 | 111.4 | ||||
| 564 | K | 34.7 | Very low | 35.9 | Very low | 197 Ų | 197 | 161.8 Ų | 161.8 | 86% | 0.857 | 82% | 0.824 | S | S | * | * | -167.8 | 146.6 | 116.1 | -119.6 | -162.8 | 169.5 | -145.8 | 0 | 114.2 | |||||
| 565 | E | 40 | Very low | 36.1 | Very low | 158 Ų | 158 | 159.1 Ų | 159.1 | 74% | 0.738 | 82% | 0.816 | S | S | * | * | trans | -84.4 | -171.8 | 162.8 | -43.1 | 100.9 | 132.5 | 0 | 0 | 110.5 | ||||
| 566 | S | 40.2 | Very low | 36.5 | Very low | 91 Ų | 91 | 163.8 Ų | 163.8 | 64% | 0.636 | 81% | 0.813 | S | S | * | * | cis | -162.6 | 176.7 | 11.8 | 59.7 | 0 | 0 | 0 | 0 | 113.1 | ||||
| 567 | D | 38.4 | Very low | 36.7 | Very low | 145 Ų | 145 | 167.7 Ų | 167.7 | 78% | 0.775 | 82% | 0.818 | S | S | * | * | trans | 63.9 | 105.2 | 147 | -50.9 | -35.6 | 0 | 0 | 0 | 124 | ||||
| 568 | C | 32.1 | Very low | 36.9 | Very low | 112 Ų | 112 | 168 Ų | 168 | 76% | 0.757 | 82% | 0.822 | S | S | * | * | 7.3 | 132.6 | 122 | -165.8 | 0 | 0 | 0 | 0 | 121.2 | |||||
| 569 | V | 37.6 | Very low | 37 | Very low | 131 Ų | 131 | 166.8 Ų | 166.8 | 79% | 0.794 | 82% | 0.819 | S | S | * | * | trans | -146.2 | 144.9 | 132.1 | 170.1 | 0 | 0 | 0 | 0 | 108 | ||||
| 570 | I | 36.1 | Very low | 37.3 | Very low | 153 Ų | 153 | 173.8 Ų | 173.8 | 79% | 0.785 | 83% | 0.83 | S | S | * | * | trans | -109 | 143.8 | 164.4 | -65.1 | 175.7 | 0 | 0 | 0 | 108.5 | ||||
| 571 | L | 40.4 | Very low | 37.5 | Very low | 232 Ų | 232 | 166.4 Ų | 166.4 | 100% | 1.215 | 82% | 0.818 | S | S | * | * | trans | -137.5 | 0 | 164.3 | -96.6 | 170.1 | 0 | 0 | 0 | 108.5 |
Retrieved 571 of 571 residues in 564.6 ms
(Link to these results)