| 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 | 37.8 | Very low | 35 | Very low | 251 Ų | 251 | 149.7 Ų | 149.7 | 100% | 1.236 | 82% | 0.818 | S | S | * | * | 0 | 142.5 | 0 | -79.3 | -66.6 | 178.8 | 0 | 0 | 108.4 | |||||
| 2 | S | 39.4 | Very low | 35 | Very low | 110 Ų | 110 | 151.3 Ų | 151.3 | 77% | 0.769 | 82% | 0.815 | S | S | * | * | trans | -100 | 145.7 | -159.7 | -173.7 | 0 | 0 | 0 | 0 | 114 | ||||
| 3 | C | 34.6 | Very low | 35 | Very low | 104 Ų | 104 | 156.8 Ų | 156.8 | 70% | 0.703 | 82% | 0.817 | S | S | * | * | 161.2 | 130.8 | 116.5 | -84.3 | 0 | 0 | 0 | 0 | 115.9 | |||||
| 4 | R | 37.2 | Very low | 35 | Very low | 229 Ų | 229 | 155.6 Ų | 155.6 | 86% | 0.864 | 82% | 0.819 | S | S | * | * | trans | 65.1 | 128.7 | 146.3 | -65.1 | 178.1 | 169.5 | -164.6 | -5.1 | 119.2 | ||||
| 5 | S | 36.1 | Very low | 34.8 | Very low | 92 Ų | 92 | 149.1 Ų | 149.1 | 64% | 0.643 | 80% | 0.804 | S | S | * | * | cis | 78.4 | 137.4 | 48.2 | -65 | 0 | 0 | 0 | 0 | 114.1 | ||||
| 6 | Y | 34.3 | Very low | 34.7 | Very low | 201 Ų | 201 | 149.2 Ų | 149.2 | 79% | 0.788 | 81% | 0.805 | S | S | * | * | cis | -168.5 | 157 | -1.5 | -109.1 | -51.4 | 0 | 0 | 0 | 110.7 | ||||
| 7 | R | 32.5 | Very low | 34.4 | Very low | 228 Ų | 228 | 151.6 Ų | 151.6 | 86% | 0.86 | 81% | 0.806 | S | S | * | * | trans | 63.8 | 159.4 | 153.7 | -70.8 | -179.4 | -173.9 | -165.2 | 1.8 | 119.2 | ||||
| 8 | V | 32.3 | Very low | 34.5 | Very low | 128 Ų | 128 | 149 Ų | 149 | 78% | 0.776 | 80% | 0.802 | S | S | * | * | cis | 164.1 | 127.3 | -29.8 | 143.2 | 0 | 0 | 0 | 0 | 107 | ||||
| 9 | S | 31.6 | Very low | 34.4 | Very low | 110 Ų | 110 | 147.6 Ų | 147.6 | 77% | 0.769 | 81% | 0.805 | S | S | * | * | trans | 153.5 | 117.3 | 152.1 | -76.2 | 0 | 0 | 0 | 0 | 109.9 | ||||
| 10 | S | 37 | Very low | 34.3 | Very low | 124 Ų | 124 | 146 Ų | 146 | 87% | 0.867 | 80% | 0.804 | S | S | * | * | 77.5 | 112 | 76.6 | -171 | 0 | 0 | 0 | 0 | 113.9 | |||||
| 11 | G | 32 | Very low | 34.3 | Very low | 70 Ų | 70 | 144.5 Ų | 144.5 | 72% | 0.722 | 80% | 0.804 | S | S | * | * | trans | 162 | 82.4 | 173.9 | 0 | 0 | 0 | 0 | 0 | 118.3 | ||||
| 12 | H | 34.9 | Very low | 34 | Very low | 169 Ų | 169 | 137.5 Ų | 137.5 | 78% | 0.782 | 79% | 0.786 | S | S | * | * | trans | 22.8 | 112.4 | 145.9 | -74.6 | 74.5 | 0 | 0 | 0 | 123.1 | ||||
| 13 | R | 34.9 | Very low | 33.7 | Very low | 222 Ų | 222 | 140.4 Ų | 140.4 | 84% | 0.838 | 79% | 0.789 | S | S | * | * | 51.5 | 142.6 | 115.4 | -145.6 | -169.1 | -73.6 | -120.2 | 6.7 | 121.9 | |||||
| 14 | V | 35.5 | Very low | 33.6 | Very low | 140 Ų | 140 | 141.1 Ų | 141.1 | 85% | 0.848 | 79% | 0.791 | S | S | * | * | trans | 79.5 | 140.1 | 168.2 | -164.5 | 0 | 0 | 0 | 0 | 114.7 | ||||
| 15 | G | 32.1 | Very low | 34.1 | Very low | 58 Ų | 58 | 135.3 Ų | 135.3 | 60% | 0.598 | 78% | 0.782 | S | S | * | * | cis | 159.5 | 125.6 | -11.2 | 0 | 0 | 0 | 0 | 0 | 114 | ||||
| 16 | N | 33.1 | Very low | 34 | Very low | 151 Ų | 151 | 139.3 Ų | 139.3 | 81% | 0.807 | 79% | 0.791 | S | S | * | * | trans | 60 | 166.9 | 160.6 | -73.3 | 8.3 | 0 | 0 | 0 | 122.8 | ||||
| 17 | F | 30.1 | Very low | 34 | Very low | 190 Ų | 190 | 136.3 Ų | 136.3 | 83% | 0.833 | 79% | 0.789 | S | S | * | * | trans | 78.5 | 121.3 | 175.2 | -51.6 | -76.1 | 0 | 0 | 0 | 115.6 | ||||
| 18 | S | 35.2 | Very low | 34.1 | Very low | 105 Ų | 105 | 133.4 Ų | 133.4 | 73% | 0.734 | 79% | 0.789 | S | S | * | * | cis | 73.5 | 117.9 | 29.3 | -162.9 | 0 | 0 | 0 | 0 | 115 | ||||
| 19 | S | 32.5 | Very low | 34.3 | Very low | 122 Ų | 122 | 134 Ų | 134 | 85% | 0.853 | 79% | 0.788 | S | S | * | * | trans | -150.3 | 131.8 | 168.5 | -74.9 | 0 | 0 | 0 | 0 | 111.5 | ||||
| 20 | C | 33.7 | Very low | 34.3 | Very low | 115 Ų | 115 | 138.3 Ų | 138.3 | 78% | 0.777 | 79% | 0.787 | S | S | * | * | trans | -81.3 | 179.9 | 168.8 | -44.7 | 0 | 0 | 0 | 0 | 108.8 | ||||
| 21 | S | 33.3 | Very low | 33.9 | Very low | 116 Ų | 116 | 140 Ų | 140 | 81% | 0.811 | 78% | 0.779 | S | S | * | * | cis | -165.2 | 160.6 | 19 | -64 | 0 | 0 | 0 | 0 | 109.3 | ||||
| 22 | A | 32.5 | Very low | 33.8 | Very low | 103 Ų | 103 | 147.1 Ų | 147.1 | 85% | 0.851 | 78% | 0.784 | S | S | * | * | trans | -171.2 | 153.3 | 142 | 0 | 0 | 0 | 0 | 0 | 110.8 | ||||
| 23 | M | 32.5 | Very low | 33.6 | Very low | 172 Ų | 172 | 143.3 Ų | 143.3 | 85% | 0.847 | 78% | 0.782 | S | S | * | * | trans | -134.8 | 143.8 | -166.2 | -93.2 | -115.9 | 151.5 | 0 | 0 | 114.5 | ||||
| 24 | T | 32.7 | Very low | 33.3 | Very low | 119 Ų | 119 | 140.5 Ų | 140.5 | 73% | 0.73 | 78% | 0.784 | S | S | * | * | trans | 67.6 | 164.7 | 143 | 54.7 | 0 | 0 | 0 | 0 | 121 | ||||
| 25 | P | 48.1 | Very low | 33.1 | Very low | 106 Ų | 106 | 138.6 Ų | 138.6 | 69% | 0.688 | 78% | 0.776 | S | S | * | * | cis | -140.4 | -167.7 | -29.1 | 32.9 | -11.6 | 0 | 0 | 0 | 115.2 | ||||
| 26 | Q | 33.6 | Very low | 33 | Very low | 177 Ų | 177 | 142.6 Ų | 142.6 | 83% | 0.827 | 79% | 0.789 | S | S | * | * | trans | 96.4 | 93.8 | 152.5 | -72.2 | -179.3 | -1.5 | 0 | 0 | 121.7 | ||||
| 27 | N | 34.4 | Very low | 32.9 | Very low | 138 Ų | 138 | 139.8 Ų | 139.8 | 74% | 0.738 | 78% | 0.781 | S | S | * | * | 41.1 | 112.4 | 108.3 | -150 | -18.8 | 0 | 0 | 0 | 119.7 | |||||
| 28 | L | 35 | Very low | 32.9 | Very low | 167 Ų | 167 | 136.1 Ų | 136.1 | 87% | 0.874 | 78% | 0.778 | S | S | * | * | -162.7 | 139.9 | 125.3 | -130.1 | 85.8 | 0 | 0 | 0 | 115.2 | |||||
| 29 | N | 34.7 | Very low | 32.6 | Very low | 139 Ų | 139 | 142.8 Ų | 142.8 | 74% | 0.743 | 79% | 0.787 | S | S | * | * | trans | -33.2 | 142.5 | 164.7 | -86.1 | -44.8 | 0 | 0 | 0 | 121 | ||||
| 30 | R | 33 | Very low | 32.5 | Very low | 201 Ų | 201 | 142.1 Ų | 142.1 | 76% | 0.758 | 78% | 0.782 | S | S | * | * | 103.9 | 132.1 | 116.4 | -179.8 | 179.2 | -155.2 | 169.7 | 5.1 | 122.8 | |||||
| 31 | F | 29.1 | Very low | 32.4 | Very low | 159 Ų | 159 | 140.2 Ų | 140.2 | 70% | 0.697 | 78% | 0.782 | S | S | * | * | trans | 66.1 | 155.4 | 159.9 | -75.1 | -33.7 | 0 | 0 | 0 | 118 | ||||
| 32 | R | 29.3 | Very low | 33 | Very low | 221 Ų | 221 | 141 Ų | 141 | 83% | 0.834 | 79% | 0.785 | S | S | * | * | cis | -148.7 | 170 | -7.4 | -143.7 | 179.5 | -165.3 | -179.8 | 4.2 | 109.9 | ||||
| 33 | A | 29.9 | Very low | 32.9 | Very low | 88 Ų | 88 | 139.3 Ų | 139.3 | 73% | 0.727 | 78% | 0.777 | S | S | * | * | trans | -55.3 | 159.6 | 177 | 0 | 0 | 0 | 0 | 0 | 115.9 | ||||
| 34 | N | 28.8 | Very low | 32.9 | Very low | 164 Ų | 164 | 141.3 Ų | 141.3 | 88% | 0.877 | 78% | 0.781 | S | S | * | * | trans | -139.2 | 142.2 | 136.6 | -124.8 | 5.2 | 0 | 0 | 0 | 111.5 | ||||
| 35 | S | 31.5 | Very low | 33.1 | Very low | 99 Ų | 99 | 146.9 Ų | 146.9 | 69% | 0.692 | 79% | 0.789 | S | S | * | * | trans | -74.1 | 162.5 | 172 | 51 | 0 | 0 | 0 | 0 | 112.4 | ||||
| 36 | V | 30.6 | Very low | 32.4 | Very low | 142 Ų | 142 | 145.5 Ų | 145.5 | 86% | 0.861 | 79% | 0.794 | S | S | * | * | -163 | 159 | 119.6 | 163.5 | 0 | 0 | 0 | 0 | 109 | |||||
| 37 | S | 30.8 | Very low | 32.4 | Very low | 93 Ų | 93 | 145.6 Ų | 145.6 | 65% | 0.65 | 80% | 0.799 | S | S | * | * | trans | -93.9 | 156.2 | -162.4 | 52.1 | 0 | 0 | 0 | 0 | 117.5 | ||||
| 38 | C | 30.4 | Very low | 32.2 | Very low | 113 Ų | 113 | 142.8 Ų | 142.8 | 76% | 0.764 | 80% | 0.803 | S | S | * | * | trans | 37.4 | 128 | 134 | -52.6 | 0 | 0 | 0 | 0 | 122.3 | ||||
| 39 | W | 28.1 | Very low | 32 | Very low | 245 Ų | 245 | 140 Ų | 140 | 93% | 0.928 | 80% | 0.797 | S | S | * | * | -164.8 | 124.9 | 128.4 | -100 | 14.3 | 0 | 0 | 0 | 108.1 | |||||
| 40 | S | 31.6 | Very low | 31.9 | Very low | 107 Ų | 107 | 143.7 Ų | 143.7 | 75% | 0.748 | 81% | 0.807 | S | S | * | * | 91.9 | 132.2 | 79.3 | -62.7 | 0 | 0 | 0 | 0 | 112.8 | |||||
| 41 | G | 30.5 | Very low | 31.7 | Very low | 75 Ų | 75 | 137.6 Ų | 137.6 | 77% | 0.773 | 81% | 0.806 | S | S | * | * | trans | -81.1 | -148.5 | 179.2 | 0 | 0 | 0 | 0 | 0 | 113.5 | ||||
| 42 | P | 46.3 | Very low | 31.9 | Very low | 134 Ų | 134 | 136.3 Ų | 136.3 | 87% | 0.87 | 82% | 0.817 | S | S | * | * | cis | -109.6 | -166.5 | 1.6 | 42.4 | -30.6 | 0 | 0 | 0 | 111.8 | ||||
| 43 | G | 30.3 | Very low | 32.1 | Very low | 67 Ų | 67 | 137.9 Ų | 137.9 | 69% | 0.691 | 82% | 0.823 | S | S | * | * | cis | 118.2 | 121.8 | -5.1 | 0 | 0 | 0 | 0 | 0 | 114.4 | ||||
| 44 | F | 31.8 | Very low | 32.2 | Very low | 214 Ų | 214 | 139 Ų | 139 | 94% | 0.939 | 83% | 0.826 | S | S | * | * | trans | -145.9 | 145 | 178.9 | -127.8 | -89.1 | 0 | 0 | 0 | 112.6 | ||||
| 45 | R | 37.5 | Very low | 32.4 | Very low | 236 Ų | 236 | 137.7 Ų | 137.7 | 89% | 0.891 | 82% | 0.823 | S | S | * | * | trans | -118.6 | 145.8 | 170.5 | -76 | -174 | -179.1 | -132.5 | 3.9 | 109.9 | ||||
| 46 | G | 33.6 | Very low | 32.6 | Very low | 77 Ų | 77 | 140.7 Ų | 140.7 | 79% | 0.794 | 83% | 0.83 | S | S | * | * | trans | -141.8 | 136.7 | 164.9 | 0 | 0 | 0 | 0 | 0 | 110.2 | ||||
| 47 | L | 34.2 | Very low | 32.7 | Very low | 179 Ų | 179 | 139.3 Ų | 139.3 | 94% | 0.937 | 82% | 0.822 | S | S | * | * | trans | -95.7 | 156.8 | 177.9 | -76.3 | 80.6 | 0 | 0 | 0 | 110.7 | ||||
| 48 | G | 30.3 | Very low | 32.7 | Very low | 78 Ų | 78 | 144.8 Ų | 144.8 | 80% | 0.804 | 83% | 0.834 | S | S | * | * | trans | 161 | 100.3 | 159.1 | 0 | 0 | 0 | 0 | 0 | 115.7 | ||||
| 49 | S | 30.4 | Very low | 32.7 | Very low | 108 Ų | 108 | 142.5 Ų | 142.5 | 76% | 0.755 | 83% | 0.83 | S | S | * | * | trans | -27.7 | 140 | 169.9 | -70.9 | 0 | 0 | 0 | 0 | 118.1 | ||||
| 50 | F | 32.7 | Very low | 32.9 | Very low | 218 Ų | 218 | 136.5 Ų | 136.5 | 96% | 0.956 | 83% | 0.825 | S | S | * | * | -158 | 145.3 | 97.9 | -101.5 | -75.7 | 0 | 0 | 0 | 109.6 | |||||
| 51 | G | 28.1 | Very low | 33.1 | Very low | 72 Ų | 72 | 142.4 Ų | 142.4 | 74% | 0.742 | 83% | 0.833 | S | S | * | * | trans | -114.3 | 147.3 | -174 | 0 | 0 | 0 | 0 | 0 | 113.2 | ||||
| 52 | S | 34.2 | Very low | 33.2 | Very low | 132 Ų | 132 | 144 Ų | 144 | 92% | 0.923 | 83% | 0.832 | S | S | * | * | trans | -144.4 | 127.6 | 149.1 | -89.9 | 0 | 0 | 0 | 0 | 108.4 | ||||
| 53 | R | 32.4 | Very low | 33.1 | Very low | 255 Ų | 255 | 143.8 Ų | 143.8 | 96% | 0.962 | 83% | 0.831 | S | S | * | * | trans | -87 | 131.5 | -177.5 | -74.4 | 171.3 | 158.3 | -176.5 | -6.9 | 110.6 | ||||
| 54 | S | 33 | Very low | 33.2 | Very low | 112 Ų | 112 | 152.3 Ų | 152.3 | 78% | 0.783 | 84% | 0.842 | S | S | * | * | trans | -160.8 | 157.3 | 148.3 | -167.8 | 0 | 0 | 0 | 0 | 110.4 | ||||
| 55 | V | 31.9 | Very low | 33.1 | Very low | 135 Ų | 135 | 153.2 Ų | 153.2 | 82% | 0.818 | 84% | 0.839 | S | S | * | * | trans | 74.8 | 125.4 | 178.4 | -168.8 | 0 | 0 | 0 | 0 | 116.3 | ||||
| 56 | I | 37.1 | Very low | 32.8 | Very low | 163 Ų | 163 | 146.6 Ų | 146.6 | 84% | 0.836 | 84% | 0.835 | S | S | * | * | trans | -92.2 | 150.2 | 179.4 | -70.3 | 169.2 | 0 | 0 | 0 | 110.1 | ||||
| 57 | T | 31.5 | Very low | 32.7 | Very low | 112 Ų | 112 | 148 Ų | 148 | 69% | 0.687 | 84% | 0.839 | S | S | * | * | trans | -86.8 | 175 | -176 | 35.1 | 0 | 0 | 0 | 0 | 115.3 | ||||
| 58 | F | 30.5 | Very low | 32.5 | Very low | 208 Ų | 208 | 146.9 Ų | 146.9 | 91% | 0.912 | 84% | 0.839 | S | S | * | * | trans | 91.1 | 130 | 168.8 | -65.1 | -85.7 | 0 | 0 | 0 | 116.6 | ||||
| 59 | G | 30.1 | Very low | 32.6 | Very low | 66 Ų | 66 | 146.2 Ų | 146.2 | 68% | 0.68 | 83% | 0.832 | S | S | * | * | cis | -172.1 | 152.5 | -3.8 | 0 | 0 | 0 | 0 | 0 | 114.3 | ||||
| 60 | S | 32.7 | Very low | 33.6 | Very low | 119 Ų | 119 | 146.6 Ų | 146.6 | 83% | 0.832 | 83% | 0.832 | S | S | * | * | trans | -79.1 | 131.4 | -177.6 | -39.7 | 0 | 0 | 0 | 0 | 112.2 | ||||
| 61 | Y | 36 | Very low | 33.7 | Very low | 230 Ų | 230 | 147.7 Ų | 147.7 | 90% | 0.902 | 83% | 0.83 | S | S | * | * | trans | -142.5 | 119.5 | 160.3 | -90.7 | -77.2 | 0 | 0 | 0 | 112.7 | ||||
| 62 | S | 32.5 | Very low | 34.5 | Very low | 108 Ų | 108 | 149.6 Ų | 149.6 | 76% | 0.755 | 83% | 0.83 | S | S | * | * | P | Polyproline II helix | trans | -92.7 | 142.3 | 159.9 | -48.9 | 0 | 0 | 0 | 0 | 109.6 | ||
| 63 | P | 45.3 | Very low | 34.5 | Very low | 130 Ų | 130 | 150 Ų | 150 | 84% | 0.844 | 83% | 0.827 | S | S | * | * | P | Polyproline II helix | trans | -88.2 | 118.1 | 166.8 | 32.1 | -29 | 0 | 0 | 0 | 110.8 | ||
| 64 | R | 32.3 | Very low | 34.3 | Very low | 246 Ų | 246 | 149.7 Ų | 149.7 | 93% | 0.928 | 83% | 0.825 | S | S | * | * | P | Polyproline II helix | trans | -83.8 | 134.8 | 162.4 | -74.2 | -173.4 | -176.9 | -127.8 | 1 | 109.5 | ||
| 65 | R | 28.7 | Very low | 34.2 | Very low | 233 Ų | 233 | 150.3 Ų | 150.3 | 88% | 0.879 | 83% | 0.828 | S | S | * | * | P | Polyproline II helix | trans | -73.1 | 138.6 | 163.6 | -62.9 | 179.4 | -176.5 | 167.7 | 1.8 | 109.3 | ||
| 66 | A | 31.4 | Very low | 34 | Very low | 98 Ų | 98 | 147.3 Ų | 147.3 | 81% | 0.81 | 83% | 0.825 | S | S | * | * | P | Polyproline II helix | trans | -103.8 | 134.6 | 158.2 | 0 | 0 | 0 | 0 | 0 | 108.5 | ||
| 67 | A | 31.7 | Very low | 34.1 | Very low | 106 Ų | 106 | 146.2 Ų | 146.2 | 88% | 0.876 | 83% | 0.825 | S | S | * | * | P | Polyproline II helix | trans | -88.6 | 154.1 | 179 | 0 | 0 | 0 | 0 | 0 | 111.3 | ||
| 68 | V | 30.8 | Very low | 34 | Very low | 155 Ų | 155 | 144.2 Ų | 144.2 | 94% | 0.939 | 83% | 0.827 | S | S | * | * | trans | -113.2 | 136.3 | -177.4 | 170.8 | 0 | 0 | 0 | 0 | 111.2 | ||||
| 69 | G | 31.2 | Very low | 34.3 | Very low | 64 Ų | 64 | 144.5 Ų | 144.5 | 66% | 0.66 | 83% | 0.828 | S | S | * | * | trans | 136 | 160.4 | 155.4 | 0 | 0 | 0 | 0 | 0 | 114.8 | ||||
| 70 | P | 51.2 | Low | 34.3 | Very low | 116 Ų | 116 | 144.9 Ų | 144.9 | 75% | 0.753 | 83% | 0.832 | S | S | * | * | cis | -140 | 156.9 | -14.1 | 38.6 | -21.1 | 0 | 0 | 0 | 117 | ||||
| 71 | R | 35.3 | Very low | 34.5 | Very low | 241 Ų | 241 | 144.7 Ų | 144.7 | 91% | 0.909 | 84% | 0.838 | S | S | * | * | trans | 68.8 | 165.5 | 156.1 | -73.2 | 177.5 | 172.8 | 165 | -1.2 | 118.4 | ||||
| 72 | P | 45.3 | Very low | 34.2 | Very low | 113 Ų | 113 | 137.3 Ų | 137.3 | 73% | 0.734 | 83% | 0.832 | S | S | * | * | cis | -129.9 | 170.6 | 3.3 | 39.9 | -22.9 | 0 | 0 | 0 | 117.8 | ||||
| 73 | V | 33.3 | Very low | 34.2 | Very low | 141 Ų | 141 | 138.8 Ų | 138.8 | 86% | 0.855 | 84% | 0.841 | S | S | * | * | trans | 5 | 122.8 | 154.2 | -173.9 | 0 | 0 | 0 | 0 | 120.3 | ||||
| 74 | R | 28.2 | Very low | 33.4 | Very low | 248 Ų | 248 | 136.5 Ų | 136.5 | 94% | 0.936 | 84% | 0.841 | S | S | * | * | -158.8 | 153.8 | 129.5 | -137.7 | 176.8 | -177.4 | -173.2 | -0.1 | 113.7 | |||||
| 75 | C | 30.4 | Very low | 33.4 | Very low | 124 Ų | 124 | 133.9 Ų | 133.9 | 84% | 0.838 | 84% | 0.841 | S | S | * | * | trans | -71.4 | 150.3 | 176.5 | -176.8 | 0 | 0 | 0 | 0 | 112.6 | ||||
| 76 | G | 29.7 | Very low | 33.4 | Very low | 73 Ų | 73 | 125.7 Ų | 125.7 | 75% | 0.753 | 83% | 0.829 | S | S | * | * | trans | -176.1 | 106.1 | 170.6 | 0 | 0 | 0 | 0 | 0 | 112.7 | ||||
| 77 | V | 37.4 | Very low | 33.5 | Very low | 139 Ų | 139 | 131.3 Ų | 131.3 | 84% | 0.842 | 84% | 0.836 | S | S | * | * | trans | -77.1 | 133.9 | 167.4 | 175.7 | 0 | 0 | 0 | 0 | 108.5 | ||||
| 78 | G | 30 | Very low | 33.4 | Very low | 70 Ų | 70 | 129.7 Ų | 129.7 | 72% | 0.722 | 83% | 0.83 | S | S | * | * | trans | -151.6 | 105.6 | 178.3 | 0 | 0 | 0 | 0 | 0 | 112.3 | ||||
| 79 | F | 36.4 | Very low | 33.6 | Very low | 214 Ų | 214 | 130.7 Ų | 130.7 | 94% | 0.939 | 83% | 0.83 | S | S | * | * | trans | -65.9 | 135 | 162.2 | -95.3 | -110 | 0 | 0 | 0 | 109.2 | ||||
| 80 | G | 30.5 | Very low | 33.7 | Very low | 75 Ų | 75 | 131.2 Ų | 131.2 | 77% | 0.773 | 84% | 0.835 | S | S | * | * | trans | -147.1 | 94.7 | 177.5 | 0 | 0 | 0 | 0 | 0 | 111 | ||||
| 81 | A | 36.7 | Very low | 32.9 | Very low | 114 Ų | 114 | 138.1 Ų | 138.1 | 94% | 0.942 | 85% | 0.846 | S | S | * | * | trans | -69.5 | 131 | 170.8 | 0 | 0 | 0 | 0 | 0 | 109.7 | ||||
| 82 | G | 29.8 | Very low | 32.7 | Very low | 76 Ų | 76 | 130.4 Ų | 130.4 | 78% | 0.784 | 84% | 0.841 | S | S | * | * | trans | -136.9 | 96.8 | 178.9 | 0 | 0 | 0 | 0 | 0 | 110.2 | ||||
| 83 | C | 32.3 | Very low | 32.2 | Very low | 139 Ų | 139 | 132 Ų | 132 | 94% | 0.939 | 85% | 0.849 | S | S | * | * | trans | -72.1 | 139 | 176.1 | 43.9 | 0 | 0 | 0 | 0 | 111.7 | ||||
| 84 | G | 29.5 | Very low | 32.1 | Very low | 82 Ų | 82 | 129 Ų | 129 | 85% | 0.845 | 85% | 0.846 | S | S | * | * | trans | -157.3 | 119.5 | 173.8 | 0 | 0 | 0 | 0 | 0 | 109.3 | ||||
| 85 | M | 30.9 | Very low | 32.5 | Very low | 190 Ų | 190 | 125.5 Ų | 125.5 | 94% | 0.936 | 85% | 0.845 | S | S | * | * | trans | -118.8 | 141.4 | -162.9 | -172.6 | 76.5 | 169 | 0 | 0 | 111.7 | ||||
| 86 | G | 29.2 | Very low | 32.5 | Very low | 61 Ų | 61 | 123 Ų | 123 | 63% | 0.629 | 84% | 0.84 | S | S | * | * | trans | 90.9 | 151.3 | 163.8 | 0 | 0 | 0 | 0 | 0 | 115.9 | ||||
| 87 | F | 33.4 | Very low | 33.1 | Very low | 216 Ų | 216 | 126 Ų | 126 | 95% | 0.947 | 85% | 0.847 | S | S | * | * | cis | -155.1 | 149.7 | -3.5 | -115.4 | -86.8 | 0 | 0 | 0 | 108.3 | ||||
| 88 | G | 29.4 | Very low | 32.8 | Very low | 73 Ų | 73 | 123.4 Ų | 123.4 | 75% | 0.753 | 85% | 0.847 | S | S | * | * | trans | 177.2 | 122.4 | 174.1 | 0 | 0 | 0 | 0 | 0 | 113.2 | ||||
| 89 | D | 35.9 | Very low | 33 | Very low | 175 Ų | 175 | 125.5 Ų | 125.5 | 94% | 0.936 | 86% | 0.858 | S | S | * | * | trans | -73.2 | 149.8 | -166.4 | -78.9 | -68.8 | 0 | 0 | 0 | 116.5 | ||||
| 90 | G | 32.3 | Very low | 32.7 | Very low | 75 Ų | 75 | 119.2 Ų | 119.2 | 77% | 0.773 | 85% | 0.854 | S | S | * | * | trans | -168.5 | 104.9 | 167.5 | 0 | 0 | 0 | 0 | 0 | 112.5 | ||||
| 91 | R | 36 | Very low | 32.8 | Very low | 262 Ų | 262 | 121.4 Ų | 121.4 | 99% | 0.989 | 86% | 0.857 | S | S | * | * | trans | -72.3 | 135.9 | 178.4 | -65.8 | 177.8 | 174.4 | -138.9 | -0.5 | 111.5 | ||||
| 92 | G | 30.9 | Very low | 32.2 | Very low | 78 Ų | 78 | 121.5 Ų | 121.5 | 80% | 0.804 | 85% | 0.849 | S | S | * | * | trans | -168.1 | 109.9 | 172.2 | 0 | 0 | 0 | 0 | 0 | 113.7 | ||||
| 93 | V | 33.6 | Very low | 32.2 | Very low | 148 Ų | 148 | 125 Ų | 125 | 90% | 0.897 | 86% | 0.856 | S | S | * | * | trans | -62.6 | 135.7 | -175.9 | 175.1 | 0 | 0 | 0 | 0 | 113.5 | ||||
| 94 | G | 31.4 | Very low | 32.1 | Very low | 77 Ų | 77 | 122 Ų | 122 | 79% | 0.794 | 85% | 0.848 | S | S | * | * | trans | -169.5 | 120.5 | 166.6 | 0 | 0 | 0 | 0 | 0 | 111.8 | ||||
| 95 | L | 36 | Very low | 32.3 | Very low | 175 Ų | 175 | 126.9 Ų | 126.9 | 92% | 0.916 | 85% | 0.854 | S | S | * | * | trans | -98.7 | 131.3 | -166.1 | -77.7 | 153.4 | 0 | 0 | 0 | 114 | ||||
| 96 | G | 30.8 | Very low | 32.2 | Very low | 70 Ų | 70 | 121.5 Ų | 121.5 | 72% | 0.722 | 85% | 0.847 | S | S | * | * | trans | 97.1 | 109.9 | 135.9 | 0 | 0 | 0 | 0 | 0 | 119.8 | ||||
| 97 | P | 43.1 | Very low | 32.3 | Very low | 138 Ų | 138 | 129.4 Ų | 129.4 | 90% | 0.896 | 86% | 0.864 | S | S | * | * | trans | -97.2 | 150.1 | 149.2 | 36.2 | -29.1 | 0 | 0 | 0 | 111.2 | ||||
| 98 | G | 30.6 | Very low | 32.1 | Very low | 83 Ų | 83 | 122.9 Ų | 122.9 | 86% | 0.856 | 86% | 0.858 | S | S | * | * | trans | -175.7 | 119.5 | 174 | 0 | 0 | 0 | 0 | 0 | 113 | ||||
| 99 | A | 34.7 | Very low | 32.4 | Very low | 114 Ų | 114 | 124.8 Ų | 124.8 | 94% | 0.942 | 87% | 0.867 | S | S | * | * | trans | -97 | 155.2 | -176.5 | 0 | 0 | 0 | 0 | 0 | 112.8 | ||||
| 100 | G | 30 | Very low | 32.2 | Very low | 83 Ų | 83 | 120.2 Ų | 120.2 | 86% | 0.856 | 86% | 0.861 | S | S | * | * | trans | -159.5 | 128.5 | 170.1 | 0 | 0 | 0 | 0 | 0 | 110.2 | ||||
| 101 | S | 31.6 | Very low | 32.4 | Very low | 121 Ų | 121 | 122.5 Ų | 122.5 | 85% | 0.846 | 87% | 0.865 | S | S | * | * | trans | -117.8 | 140.9 | -168.4 | 174 | 0 | 0 | 0 | 0 | 112 | ||||
| 102 | C | 24.9 | Very low | 32.2 | Very low | 115 Ų | 115 | 114 Ų | 114 | 78% | 0.777 | 86% | 0.859 | S | S | * | * | trans | -164.6 | 128 | 145.6 | 48.6 | 0 | 0 | 0 | 0 | 114.8 | ||||
| 103 | V | 30.6 | Very low | 32.3 | Very low | 151 Ų | 151 | 117.7 Ų | 117.7 | 92% | 0.915 | 86% | 0.859 | S | S | * | * | trans | 58.6 | 121.9 | 138.2 | -175 | 0 | 0 | 0 | 0 | 120.4 | ||||
| 104 | G | 29.4 | Very low | 32.2 | Very low | 76 Ų | 76 | 113.7 Ų | 113.7 | 78% | 0.784 | 85% | 0.847 | S | S | * | * | trans | 162.3 | 81.1 | 159.4 | 0 | 0 | 0 | 0 | 0 | 115.8 | ||||
| 105 | L | 32.9 | Very low | 32.4 | Very low | 184 Ų | 184 | 120.5 Ų | 120.5 | 96% | 0.963 | 85% | 0.85 | S | S | * | * | trans | -89.6 | 149.5 | 167.3 | -68.2 | 166.1 | 0 | 0 | 0 | 110.2 | ||||
| 106 | G | 28.4 | Very low | 32.2 | Very low | 77 Ų | 77 | 115.8 Ų | 115.8 | 79% | 0.794 | 85% | 0.845 | S | S | * | * | trans | 158.3 | 113.4 | 159.1 | 0 | 0 | 0 | 0 | 0 | 118 | ||||
| 107 | F | 32.4 | Very low | 32.3 | Very low | 226 Ų | 226 | 122.3 Ų | 122.3 | 99% | 0.991 | 85% | 0.853 | S | S | * | * | trans | -54.6 | 161.3 | 161.8 | -86.9 | -116.6 | 0 | 0 | 0 | 114 | ||||
| 108 | G | 28.8 | Very low | 31.8 | Very low | 79 Ų | 79 | 119.4 Ų | 119.4 | 81% | 0.814 | 85% | 0.848 | S | S | * | * | trans | 174.5 | 96.8 | 156.4 | 0 | 0 | 0 | 0 | 0 | 116.1 | ||||
| 109 | A | 36 | Very low | 31.8 | Very low | 113 Ų | 113 | 118.8 Ų | 118.8 | 93% | 0.934 | 84% | 0.842 | S | S | * | * | trans | -84.8 | 146 | 156.9 | 0 | 0 | 0 | 0 | 0 | 109.3 | ||||
| 110 | G | 31 | Very low | 32.2 | Very low | 80 Ų | 80 | 119.4 Ų | 119.4 | 83% | 0.825 | 84% | 0.837 | S | S | * | * | trans | -162.5 | 119.9 | -179.1 | 0 | 0 | 0 | 0 | 0 | 113.9 | ||||
| 111 | S | 36.5 | Very low | 32.3 | Very low | 123 Ų | 123 | 119.4 Ų | 119.4 | 86% | 0.86 | 84% | 0.836 | S | S | * | * | trans | -73 | 140.5 | 177.1 | -52.9 | 0 | 0 | 0 | 0 | 112.4 | ||||
| 112 | G | 32.5 | Very low | 32.3 | Very low | 83 Ų | 83 | 123.2 Ų | 123.2 | 86% | 0.856 | 84% | 0.838 | S | S | * | * | trans | -98.9 | 102.6 | 170.1 | 0 | 0 | 0 | 0 | 0 | 112 | ||||
| 113 | I | 32.1 | Very low | 32.8 | Very low | 156 Ų | 156 | 121.2 Ų | 121.2 | 80% | 0.8 | 84% | 0.837 | S | S | * | * | trans | -79.9 | 137.4 | 169.1 | -68.2 | 174.1 | 0 | 0 | 0 | 108.8 | ||||
| 114 | G | 33.2 | Very low | 32.9 | Very low | 63 Ų | 63 | 124.1 Ų | 124.1 | 65% | 0.649 | 83% | 0.833 | S | S | * | * | trans | -80.7 | 160.3 | -176.7 | 0 | 0 | 0 | 0 | 0 | 114.5 | ||||
| 115 | Y | 34.9 | Very low | 32.9 | Very low | 220 Ų | 220 | 132.2 Ų | 132.2 | 86% | 0.863 | 84% | 0.84 | S | S | * | * | trans | -140.9 | 119.6 | 156.7 | -94 | -84.5 | 0 | 0 | 0 | 108.6 | ||||
| 116 | G | 31.9 | Very low | 33 | Very low | 77 Ų | 77 | 129.5 Ų | 129.5 | 79% | 0.794 | 83% | 0.83 | S | S | * | * | trans | -97.2 | 129.8 | 167.4 | 0 | 0 | 0 | 0 | 0 | 109.6 | ||||
| 117 | F | 32.5 | Very low | 33.2 | Very low | 207 Ų | 207 | 129.5 Ų | 129.5 | 91% | 0.908 | 83% | 0.83 | S | S | * | * | trans | -118.9 | 127.4 | 168.4 | -127.9 | -91.5 | 0 | 0 | 0 | 108.7 | ||||
| 118 | G | 32.2 | Very low | 33.2 | Very low | 76 Ų | 76 | 122.1 Ų | 122.1 | 78% | 0.784 | 82% | 0.818 | S | S | * | * | trans | -84.8 | 160 | -175.6 | 0 | 0 | 0 | 0 | 0 | 113.6 | ||||
| 119 | G | 31.5 | Very low | 33.5 | Very low | 71 Ų | 71 | 125.8 Ų | 125.8 | 73% | 0.732 | 83% | 0.825 | S | S | * | * | trans | -177.7 | 118.3 | 172.7 | 0 | 0 | 0 | 0 | 0 | 110.4 | ||||
| 120 | P | 42.1 | Very low | 33.4 | Very low | 127 Ų | 127 | 124 Ų | 124 | 83% | 0.825 | 82% | 0.817 | S | S | * | * | trans | -86.3 | 132.5 | -167.5 | 32.3 | -34.3 | 0 | 0 | 0 | 113.3 | ||||
| 121 | G | 32.2 | Very low | 33.7 | Very low | 82 Ų | 82 | 127 Ų | 127 | 85% | 0.845 | 82% | 0.819 | S | S | * | * | trans | -85.1 | 107 | 171.2 | 0 | 0 | 0 | 0 | 0 | 112.2 | ||||
| 122 | F | 32.9 | Very low | 34 | Very low | 202 Ų | 202 | 126.8 Ų | 126.8 | 89% | 0.886 | 82% | 0.815 | S | S | * | * | trans | -65.8 | 130 | 166.6 | -109.6 | -107.6 | 0 | 0 | 0 | 110.4 | ||||
| 123 | G | 34.8 | Very low | 34.2 | Very low | 73 Ų | 73 | 127.2 Ų | 127.2 | 75% | 0.753 | 81% | 0.81 | S | S | * | * | trans | -145.4 | 110.5 | -179.1 | 0 | 0 | 0 | 0 | 0 | 112.5 | ||||
| 124 | Y | 32.2 | Very low | 34.6 | Very low | 212 Ų | 212 | 124.3 Ų | 124.3 | 83% | 0.831 | 81% | 0.81 | S | S | * | * | trans | -64.3 | 151 | -176 | -70 | -104.1 | 0 | 0 | 0 | 114 | ||||
| 125 | R | 30 | Very low | 35 | Very low | 246 Ų | 246 | 127 Ų | 127 | 93% | 0.928 | 82% | 0.816 | S | S | * | * | trans | -131.6 | 138.8 | 137.3 | -140.9 | -175.6 | -151.1 | -95.1 | 4.7 | 111.6 | ||||
| 126 | V | 34.6 | Very low | 35.3 | Very low | 126 Ų | 126 | 121.8 Ų | 121.8 | 76% | 0.764 | 81% | 0.811 | S | S | * | * | trans | -93.3 | 137.2 | -176 | 165.1 | 0 | 0 | 0 | 0 | 110.8 | ||||
| 127 | G | 33.8 | Very low | 35.7 | Very low | 77 Ų | 77 | 126.1 Ų | 126.1 | 79% | 0.794 | 82% | 0.815 | S | S | * | * | trans | 89.8 | 130.7 | 136.7 | 0 | 0 | 0 | 0 | 0 | 118.6 | ||||
| 128 | G | 31.3 | Very low | 36.3 | Very low | 72 Ų | 72 | 122.1 Ų | 122.1 | 74% | 0.742 | 81% | 0.807 | S | S | * | * | trans | 153.1 | 77.3 | 157.4 | 0 | 0 | 0 | 0 | 0 | 117.2 | ||||
| 129 | V | 34.9 | Very low | 36.8 | Very low | 156 Ų | 156 | 123.2 Ų | 123.2 | 95% | 0.945 | 81% | 0.809 | S | S | * | * | trans | 50.7 | 114.1 | 145.8 | -171.9 | 0 | 0 | 0 | 0 | 118.9 | ||||
| 130 | G | 35 | Very low | 37.2 | Very low | 75 Ų | 75 | 125.7 Ų | 125.7 | 77% | 0.773 | 81% | 0.81 | S | S | * | * | trans | 176.9 | 72.3 | 171.3 | 0 | 0 | 0 | 0 | 0 | 115.5 | ||||
| 131 | V | 36 | Very low | 37.5 | Very low | 142 Ų | 142 | 126.3 Ų | 126.3 | 86% | 0.861 | 81% | 0.811 | S | S | * | * | trans | -90 | 152.1 | 164.1 | 169.8 | 0 | 0 | 0 | 0 | 107.6 | ||||
| 132 | P | 43.9 | Very low | 38.3 | Very low | 119 Ų | 119 | 126.9 Ų | 126.9 | 77% | 0.773 | 80% | 0.798 | S | S | * | * | cis | -118.3 | -163.7 | 4.7 | 34 | -11.9 | 0 | 0 | 0 | 111.3 | ||||
| 133 | A | 36 | Very low | 38.8 | Very low | 92 Ų | 92 | 122.1 Ų | 122.1 | 76% | 0.76 | 78% | 0.782 | S | S | * | * | cis | -151.1 | 150.7 | 13.3 | 0 | 0 | 0 | 0 | 0 | 111.8 | ||||
| 134 | A | 40.3 | Very low | 39.7 | Very low | 96 Ų | 96 | 127.3 Ų | 127.3 | 79% | 0.793 | 78% | 0.783 | S | S | * | * | trans | -89 | 136.2 | 173.1 | 0 | 0 | 0 | 0 | 0 | 111.4 | ||||
| 135 | P | 42.8 | Very low | 40.8 | Very low | 120 Ų | 120 | 122.1 Ų | 122.1 | 78% | 0.779 | 78% | 0.778 | S | S | * | * | trans | -71.2 | 131 | 164.6 | -13.9 | 29.3 | 0 | 0 | 0 | 110.6 | I137 | P135-I137 PolarHBondContact O-N 3.43Š| ||
| 136 | S | 40.4 | Very low | 41.7 | Very low | 110 Ų | 110 | 116.9 Ų | 116.9 | 77% | 0.769 | 77% | 0.768 | S | S | * | * | trans | -39.1 | 123.8 | 172.4 | 49.7 | 0 | 0 | 0 | 0 | 115.2 | T138 | S136-T138 PolarHBondContact O-N 2.7Š| ||
| 137 | I | 41.1 | Very low | 42.3 | Very low | 168 Ų | 168 | 117.6 Ų | 117.6 | 86% | 0.862 | 77% | 0.767 | S | S | * | * | P | Polyproline II helix | trans | -68.1 | 122.4 | 163.1 | -62.7 | 173 | 0 | 0 | 0 | 108.4 | P135 | P135-I137 PolarHBondContact O-N 3.43Š|
| 138 | T | 45.1 | Very low | 42.9 | Very low | 123 Ų | 123 | 119.2 Ų | 119.2 | 76% | 0.755 | 76% | 0.761 | S | S | * | * | P | Polyproline II helix | trans | -64.3 | 148.1 | 177.9 | 40.1 | 0 | 0 | 0 | 0 | 112.8 | S136 | S136-T138 PolarHBondContact O-N 2.7Š|
| 139 | A | 41.2 | Very low | 43.7 | Very low | 98 Ų | 98 | 121.8 Ų | 121.8 | 81% | 0.81 | 77% | 0.765 | S | S | * | * | P | Polyproline II helix | trans | -59.2 | 143.6 | -173.4 | 0 | 0 | 0 | 0 | 0 | 114.3 | T141 | A139-T141 PolarHBondContact O-N 2.86Š|
| 140 | V | 40.9 | Very low | 43.9 | Very low | 124 Ų | 124 | 121.6 Ų | 121.6 | 75% | 0.752 | 76% | 0.758 | S | S | * | * | trans | -77.6 | 112.3 | -180 | 179.6 | 0 | 0 | 0 | 0 | 110.8 | V142 | V140-V142 HydrophobicContact CG1-CG2 3.83Å; V140-V142 PolarHBondContact O-N 2.97Å; V140-V142 VanDerWaalsContact O-N 3.16Å | ||
| 141 | T | 47.7 | Very low | 44.5 | Very low | 139 Ų | 139 | 124.7 Ų | 124.7 | 85% | 0.853 | 76% | 0.757 | S | S | * | * | trans | -78.4 | 93.9 | 166.7 | -55.5 | 0 | 0 | 0 | 0 | 109.7 | A139 N143 | A139-T141 PolarHBondContact O-N 2.86Å; T141-N143 PolarHBondContact O-N 3.5Å; T141-N143 VanDerWaalsContact O-N 3.14Å | ||
| 142 | V | 49.2 | Very low | 45.3 | Very low | 95 Ų | 95 | 124.6 Ų | 124.6 | 58% | 0.576 | 75% | 0.751 | S | S | * | * | trans | -71.3 | 105.4 | 177.2 | -178.3 | 0 | 0 | 0 | 0 | 110.1 | V140 K144 | V140-V142 HydrophobicContact CG1-CG2 3.83Å; V140-V142 PolarHBondContact O-N 2.97Å; V140-V142 VanDerWaalsContact O-N 3.16Å; V142-K144 PolarHBondContact O-N 2.93Å | ||
| 143 | N | 43.3 | Very low | 45.5 | Very low | 102 Ų | 102 | 127.3 Ų | 127.3 | 55% | 0.545 | 75% | 0.753 | S | S | . | * | trans | -72 | 106.5 | 170.7 | -169.4 | -31.6 | 0 | 0 | 0 | 109.5 | T141 S145 | T141-N143 PolarHBondContact O-N 3.5Å; T141-N143 VanDerWaalsContact O-N 3.14Å; N143-S145 PolarHBondContact O-N 3.15Å; N143-S145 PolarHBondContact OD1-N 3.35Å | ||
| 144 | K | 54.7 | Low | 46.4 | Very low | 181 Ų | 181 | 128 Ų | 128 | 79% | 0.787 | 74% | 0.743 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -69.9 | 1.2 | -174 | -68.5 | -173.4 | 176.9 | -178.8 | 0 | 114.8 | V142 | V142-K144 PolarHBondContact O-N 2.93Š|
| 145 | S | 54.7 | Low | 47.1 | Very low | 103 Ų | 103 | 127.3 Ų | 127.3 | 72% | 0.72 | 73% | 0.726 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -97.4 | 7.3 | 179.9 | -54.4 | 0 | 0 | 0 | 0 | 114.6 | N143 | N143-S145 PolarHBondContact O-N 3.15Å; N143-S145 PolarHBondContact OD1-N 3.35Å |
| 146 | L | 49.2 | Very low | 48.1 | Very low | 136 Ų | 136 | 126.3 Ų | 126.3 | 71% | 0.712 | 72% | 0.719 | S | S | * | * | trans | -115.8 | 18.9 | 178.9 | -64.1 | 175.6 | 0 | 0 | 0 | 113.6 | ||||
| 147 | L | 48 | Very low | 49.5 | Very low | 142 Ų | 142 | 125.3 Ų | 125.3 | 74% | 0.743 | 71% | 0.705 | S | S | * | * | trans | -100.2 | 44.2 | 177 | -70.2 | 173.9 | 0 | 0 | 0 | 112.7 | ||||
| 148 | T | 45.7 | Very low | 50.6 | Low | 110 Ų | 110 | 119 Ų | 119 | 68% | 0.675 | 68% | 0.679 | S | S | * | * | trans | -91.1 | 117.1 | 159.5 | 40.1 | 0 | 0 | 0 | 0 | 108.5 | L150 | T148-L150 PolarHBondContact O-N 2.83Š| ||
| 149 | P | 47.4 | Very low | 51.7 | Low | 127 Ų | 127 | 118.8 Ų | 118.8 | 83% | 0.825 | 67% | 0.669 | S | S | * | * | trans | -64.8 | 102.3 | 174.3 | -19.5 | 32.4 | 0 | 0 | 0 | 109.5 | N151 | P149-N151 PolarHBondContact O-N 3.01Š| ||
| 150 | L | 39 | Very low | 53.3 | Low | 152 Ų | 152 | 120.9 Ų | 120.9 | 80% | 0.796 | 66% | 0.656 | S | S | * | * | trans | -67.2 | 99.6 | 167.5 | -78 | 169.8 | 0 | 0 | 0 | 107.6 | T148 L152 | T148-L150 PolarHBondContact O-N 2.83Å; L150-L152 PolarHBondContact O-N 2.98Å | ||
| 151 | N | 47.3 | Very low | 55 | Low | 139 Ų | 139 | 118.5 Ų | 118.5 | 74% | 0.743 | 64% | 0.642 | S | S | * | * | trans | -72.9 | 74.5 | 177.9 | -161.6 | 8.9 | 0 | 0 | 0 | 109.2 | P149 E153 | P149-N151 PolarHBondContact O-N 3.01Å; N151-E153 PolarHBondContact O-N 2.9Å; N151-E153 VanDerWaalsContact O-N 3.15Å | ||
| 152 | L | 52.8 | Low | 56.5 | Low | 141 Ų | 141 | 118.8 Ų | 118.8 | 74% | 0.738 | 63% | 0.631 | S | S | * | * | trans | -72.4 | 99.3 | 166.8 | -67.3 | 174.6 | 0 | 0 | 0 | 106.9 | L150 I154 | L150-L152 PolarHBondContact O-N 2.98Å; L152-I154 VanDerWaalsContact C-N 3.27Å; L152-I154 PolarHBondContact O-N 3.29Å | ||
| 153 | E | 49.8 | Very low | 57.9 | Low | 176 Ų | 176 | 120.1 Ų | 120.1 | 82% | 0.822 | 63% | 0.629 | S | S | * | * | trans | -60.1 | 94.2 | 165.3 | -67.2 | -175.3 | 170.9 | 0 | 0 | 108.1 | N151 D155 | N151-E153 PolarHBondContact O-N 2.9Å; N151-E153 VanDerWaalsContact O-N 3.15Å; E153-D155 PolarHBondContact O-N 3.27Å; E153-D155 VanDerWaalsContact O-N 3.1Å | ||
| 154 | I | 54.9 | Low | 59.7 | Low | 105 Ų | 105 | 118.6 Ų | 118.6 | 54% | 0.538 | 62% | 0.621 | S | S | . | * | trans | -66.5 | 112.6 | 175.5 | -60.7 | 173.5 | 0 | 0 | 0 | 106.4 | L152 Q159 | L152-I154 VanDerWaalsContact C-N 3.27Å; L152-I154 PolarHBondContact O-N 3.29Å; I154-Q159 HydrophobicContact CG2-CG 3.93Å | ||
| 155 | D | 54.5 | Low | 61 | Low | 83 Ų | 83 | 114.6 Ų | 114.6 | 44% | 0.444 | 61% | 0.605 | S | S | . | * | trans | -41.3 | 121.4 | 179.8 | 169.9 | 16.2 | 0 | 0 | 0 | 111.3 | E153 N157 A158 Q159 | E153-D155 PolarHBondContact O-N 3.27Å; E153-D155 VanDerWaalsContact O-N 3.1Å; D155-N157 PolarHBondContact O-N 3Å; D155-N157 VanDerWaalsContact O-N 3.13Å; D155-N157 WeakPolarHBondContact OD1-CB 3.49Å; D155-N157 PolarHBondContact OD1-N 2.96Å; D155-A158 HydrophobicContact CB-CB 4.09Å; D155-A158 WeakPolarHBondContact O-CA 3.43Å; D155-A158 WeakPolarHBondContact O-CB 3.47Å; D155-A158 PolarHBondContact O-N 3.41Å; D155-Q159 PolarHBondContact O-N 2.74Å | ||
| 156 | P | 64.3 | Low | 62.4 | Low | 99 Ų | 99 | 116 Ų | 116 | 64% | 0.643 | 60% | 0.598 | S | S | * | * | H | α-helix | trans | -61.2 | -20.9 | -179.2 | 23.4 | -33.3 | 0 | 0 | 0 | 113.3 | R160 | P156-R160 PolarHBondContact O-N 3.4Å |
| 157 | N | 67.9 | Low | 64 | Low | 88 Ų | 88 | 113.8 Ų | 113.8 | 47% | 0.471 | 58% | 0.584 | S | S | . | * | H | α-helix | trans | -69.8 | -42.7 | 167.9 | -79.8 | -46.2 | 0 | 0 | 0 | 112 | D155 Q159 R160 V161 | D155-N157 PolarHBondContact O-N 3Å; D155-N157 VanDerWaalsContact O-N 3.13Å; D155-N157 WeakPolarHBondContact OD1-CB 3.49Å; D155-N157 PolarHBondContact OD1-N 2.96Å; N157-Q159 VanDerWaalsContact C-N 3.32Å; N157-Q159 PolarHBondContact O-N 2.86Å; N157-R160 PolarHBondContact O-N 3.2Å; N157-R160 VanDerWaalsContact O-N 3.14Å; N157-R160 PolarHBondContact OD1-NH1 3.39Å; N157-V161 WeakPolarHBondContact O-CG2 3.24Å; N157-V161 PolarHBondContact O-N 3.15Å |
| 158 | A | 65.5 | Low | 65.7 | Low | 37 Ų | 37 | 113.7 Ų | 113.7 | 31% | 0.306 | 58% | 0.58 | S | S | . | * | H | α-helix | trans | -64.4 | -33.1 | 179.5 | 0 | 0 | 0 | 0 | 0 | 113 | D155 K162 | D155-A158 HydrophobicContact CB-CB 4.09Å; D155-A158 WeakPolarHBondContact O-CA 3.43Å; D155-A158 WeakPolarHBondContact O-CB 3.47Å; D155-A158 PolarHBondContact O-N 3.41Å; A158-K162 WeakPolarHBondContact O-CB 3.44Å; A158-K162 WeakPolarHBondContact O-CG 3.46Å; A158-K162 PolarHBondContact O-N 3.37Å; A158-K162 VanDerWaalsContact O-N 3.12Å |
| 159 | Q | 67.6 | Low | 67.5 | Low | 118 Ų | 118 | 113 Ų | 113 | 55% | 0.551 | 57% | 0.571 | S | S | * | * | H | α-helix | trans | -70.4 | -37.2 | 171.3 | -87.7 | -175.4 | -8.1 | 0 | 0 | 113.1 | I154 D155 N157 K163 | I154-Q159 HydrophobicContact CG2-CG 3.93Å; D155-Q159 PolarHBondContact O-N 2.74Å; N157-Q159 VanDerWaalsContact C-N 3.32Å; N157-Q159 PolarHBondContact O-N 2.86Å; Q159-K163 WeakPolarHBondContact O-CB 3.45Å; Q159-K163 PolarHBondContact O-N 3.23Å |
| 160 | R | 74.3 | Confident | 69.3 | Low | 141 Ų | 141 | 112.1 Ų | 112.1 | 53% | 0.532 | 55% | 0.554 | S | S | . | * | H | α-helix | trans | -63.6 | -51.1 | 173.4 | -100.9 | 176.5 | 53 | -114.1 | -7.8 | 111.5 | P156 N157 K162 K163 D164 | P156-R160 PolarHBondContact O-N 3.4Å; N157-R160 PolarHBondContact O-N 3.2Å; N157-R160 VanDerWaalsContact O-N 3.14Å; N157-R160 PolarHBondContact OD1-NH1 3.39Å; R160-K162 VanDerWaalsContact C-N 3.33Å; R160-K162 PolarHBondContact O-N 3.33Å; R160-K163 WeakPolarHBondContact O-CA 3.23Å; R160-K163 WeakPolarHBondContact O-CB 3.2Å; R160-K163 PolarHBondContact O-N 3Å; R160-D164 VanDerWaalsContact O-CG 3.24Å; R160-D164 PolarHBondContact O-N 3.24Å |
| 161 | V | 78.3 | Confident | 71.5 | Confident | 75 Ų | 75 | 108.4 Ų | 108.4 | 46% | 0.455 | 54% | 0.538 | S | S | . | . | H | α-helix | trans | -57.2 | -45.1 | 177.9 | 175.6 | 0 | 0 | 0 | 0 | 111.2 | N157 K163 D164 E165 | N157-V161 WeakPolarHBondContact O-CG2 3.24Å; N157-V161 PolarHBondContact O-N 3.15Å; V161-K163 VanDerWaalsContact C-N 3.27Å; V161-K163 PolarHBondContact O-N 3.3Å; V161-D164 PolarHBondContact O-N 3.48Å; V161-E165 HydrophobicContact CG1-CG 4.23Å; V161-E165 WeakPolarHBondContact O-CB 3.33Å; V161-E165 WeakPolarHBondContact O-CG 3.37Å; V161-E165 PolarHBondContact O-N 3.17Å |
| 162 | K | 77.6 | Confident | 73.5 | Confident | 144 Ų | 144 | 106.1 Ų | 106.1 | 63% | 0.626 | 53% | 0.525 | S | S | * | . | H | α-helix | trans | -64.3 | -27.6 | 175.5 | -76.2 | 179.6 | 178.2 | 178.7 | 0 | 114.1 | A158 R160 K166 | A158-K162 WeakPolarHBondContact O-CB 3.44Å; A158-K162 WeakPolarHBondContact O-CG 3.46Å; A158-K162 PolarHBondContact O-N 3.37Å; A158-K162 VanDerWaalsContact O-N 3.12Å; R160-K162 VanDerWaalsContact C-N 3.33Å; R160-K162 PolarHBondContact O-N 3.33Å; K162-K166 WeakPolarHBondContact O-CB 3.16Å; K162-K166 PolarHBondContact O-N 3.34Å; K162-K166 VanDerWaalsContact O-N 3.14Å |
| 163 | K | 79 | Confident | 75.2 | Confident | 123 Ų | 123 | 103.7 Ų | 103.7 | 54% | 0.535 | 51% | 0.513 | S | S | . | . | H | α-helix | trans | -75.1 | -44.4 | 173.6 | -171.9 | -174.5 | 171.8 | -166.5 | 0 | 110.7 | Q159 R160 V161 K166 E167 | Q159-K163 WeakPolarHBondContact O-CB 3.45Å; Q159-K163 PolarHBondContact O-N 3.23Å; R160-K163 WeakPolarHBondContact O-CA 3.23Å; R160-K163 WeakPolarHBondContact O-CB 3.2Å; R160-K163 PolarHBondContact O-N 3Å; V161-K163 VanDerWaalsContact C-N 3.27Å; V161-K163 PolarHBondContact O-N 3.3Å; K163-K166 CarbonylContact O-C 3.58Å; K163-K166 WeakPolarHBondContact O-CB 3.38Å; K163-K166 PolarHBondContact O-N 2.87Å; K163-E167 WeakPolarHBondContact CE-OE1 3.41Å; K163-E167 WeakPolarHBondContact O-CG 3.48Å; K163-E167 PolarHBondContact O-N 3.03Å |
| 164 | D | 81.9 | Confident | 77.1 | Confident | 70 Ų | 70 | 100.8 Ų | 100.8 | 37% | 0.374 | 50% | 0.503 | S | S | . | . | H | α-helix | trans | -65.6 | -43.5 | 179.1 | -60.3 | -18.4 | 0 | 0 | 0 | 110.7 | R160 V161 K166 E167 Q168 | R160-D164 VanDerWaalsContact O-CG 3.24Å; R160-D164 PolarHBondContact O-N 3.24Å; V161-D164 PolarHBondContact O-N 3.48Å; D164-K166 PolarHBondContact O-N 3Å; D164-E167 PolarHBondContact O-N 3.08Å; D164-Q168 WeakPolarHBondContact O-CG 3.29Å; D164-Q168 PolarHBondContact O-N 3.23Å |
| 165 | E | 82.1 | Confident | 78.8 | Confident | 98 Ų | 98 | 101.4 Ų | 101.4 | 46% | 0.458 | 50% | 0.502 | S | S | . | . | H | α-helix | trans | -57.2 | -45.2 | 169.2 | -76 | 178.2 | 156.6 | 0 | 0 | 111.6 | V161 E167 Q168 I169 | V161-E165 HydrophobicContact CG1-CG 4.23Å; V161-E165 WeakPolarHBondContact O-CB 3.33Å; V161-E165 WeakPolarHBondContact O-CG 3.37Å; V161-E165 PolarHBondContact O-N 3.17Å; E165-E167 VanDerWaalsContact C-N 3.28Å; E165-E167 PolarHBondContact O-N 2.98Å; E165-Q168 PolarHBondContact O-N 3.44Å; E165-I169 WeakPolarHBondContact O-CB 3.4Å; E165-I169 VanDerWaalsContact O-CG1 3.22Å; E165-I169 WeakPolarHBondContact O-CG1 3.5Å; E165-I169 PolarHBondContact O-N 2.89Å |
| 166 | K | 83.6 | Confident | 80.5 | Confident | 133 Ų | 133 | 102.9 Ų | 102.9 | 58% | 0.578 | 51% | 0.505 | S | S | * | . | H | α-helix | trans | -64 | -32.6 | 177.2 | -176.2 | 174.6 | -176.2 | 174.2 | 0 | 112.1 | K162 K163 D164 K170 | K162-K166 WeakPolarHBondContact O-CB 3.16Å; K162-K166 PolarHBondContact O-N 3.34Å; K162-K166 VanDerWaalsContact O-N 3.14Å; K163-K166 CarbonylContact O-C 3.58Å; K163-K166 WeakPolarHBondContact O-CB 3.38Å; K163-K166 PolarHBondContact O-N 2.87Å; D164-K166 PolarHBondContact O-N 3Å; K166-K170 WeakPolarHBondContact O-CB 3.4Å; K166-K170 WeakPolarHBondContact O-CG 3.48Å; K166-K170 PolarHBondContact O-N 2.79Å |
| 167 | E | 82.4 | Confident | 81.7 | Confident | 88 Ų | 88 | 100.3 Ų | 100.3 | 41% | 0.411 | 49% | 0.492 | S | S | . | . | H | α-helix | trans | -78.1 | -34.9 | 175.5 | -73.3 | 179.1 | -164.1 | 0 | 0 | 112.5 | K163 D164 E165 K170 T171 | K163-E167 WeakPolarHBondContact CE-OE1 3.41Å; K163-E167 WeakPolarHBondContact O-CG 3.48Å; K163-E167 PolarHBondContact O-N 3.03Å; D164-E167 PolarHBondContact O-N 3.08Å; E165-E167 VanDerWaalsContact C-N 3.28Å; E165-E167 PolarHBondContact O-N 2.98Å; E167-K170 PolarHBondContact O-N 3.47Å; E167-T171 WeakPolarHBondContact O-CB 3.47Å; E167-T171 PolarHBondContact O-N 3.38Å; E167-T171 PolarHBondContact O-OG1 3.4Å |
| 168 | Q | 83.6 | Confident | 82.8 | Confident | 140 Ų | 140 | 99.2 Ų | 99.2 | 65% | 0.654 | 49% | 0.491 | S | S | * | . | H | α-helix | trans | -65.2 | -46.1 | 169.2 | -71.1 | 179.8 | 17.5 | 0 | 0 | 111.6 | D164 E165 K170 T171 L172 | D164-Q168 WeakPolarHBondContact O-CG 3.29Å; D164-Q168 PolarHBondContact O-N 3.23Å; E165-Q168 PolarHBondContact O-N 3.44Å; Q168-K170 PolarHBondContact O-N 3.38Å; Q168-T171 WeakPolarHBondContact O-CB 3.31Å; Q168-T171 PolarHBondContact O-N 2.88Å; Q168-T171 VanDerWaalsContact O-N 3.13Å; Q168-L172 WeakPolarHBondContact O-CB 3.1Å; Q168-L172 PolarHBondContact O-N 2.87Å |
| 169 | I | 83.8 | Confident | 84.1 | Confident | 96 Ų | 96 | 103.9 Ų | 103.9 | 49% | 0.492 | 51% | 0.505 | S | S | . | . | H | α-helix | trans | -62.5 | -40.7 | 175.6 | -69.7 | 165.3 | 0 | 0 | 0 | 110.8 | E165 L172 N173 | E165-I169 WeakPolarHBondContact O-CB 3.4Å; E165-I169 VanDerWaalsContact O-CG1 3.22Å; E165-I169 WeakPolarHBondContact O-CG1 3.5Å; E165-I169 PolarHBondContact O-N 2.89Å; I169-L172 PolarHBondContact O-N 3.08Å; I169-N173 VanDerWaalsContact O-CB 3.28Å; I169-N173 WeakPolarHBondContact O-CB 3.41Å; I169-N173 VanDerWaalsContact O-CG 3.24Å; I169-N173 PolarHBondContact O-N 2.98Å; I169-N173 PolarHBondContact O-ND2 2.98Å |
| 170 | K | 84.9 | Confident | 85.3 | Confident | 109 Ų | 109 | 102.7 Ų | 102.7 | 47% | 0.474 | 50% | 0.501 | S | S | . | . | H | α-helix | trans | -59.8 | -46.1 | 170.6 | -80.1 | 169.3 | 175.9 | -175.7 | 0 | 111.9 | K166 E167 Q168 L172 N173 N174 | K166-K170 WeakPolarHBondContact O-CB 3.4Å; K166-K170 WeakPolarHBondContact O-CG 3.48Å; K166-K170 PolarHBondContact O-N 2.79Å; E167-K170 PolarHBondContact O-N 3.47Å; Q168-K170 PolarHBondContact O-N 3.38Å; K170-L172 VanDerWaalsContact C-N 3.3Å; K170-L172 PolarHBondContact O-N 3.02Å; K170-N173 PolarHBondContact O-N 2.99Å; K170-N174 WeakPolarHBondContact O-CB 3.19Å; K170-N174 PolarHBondContact O-N 2.8Å; K170-N174 PolarHBondContact O-OD1 2.65Å |
| 171 | T | 86.1 | Confident | 86.1 | Confident | 74 Ų | 74 | 100.7 Ų | 100.7 | 45% | 0.454 | 50% | 0.501 | S | S | . | . | H | α-helix | trans | -64 | -38.3 | 179.7 | -57.6 | 0 | 0 | 0 | 0 | 111.3 | E167 Q168 K175 | E167-T171 WeakPolarHBondContact O-CB 3.47Å; E167-T171 PolarHBondContact O-N 3.38Å; E167-T171 PolarHBondContact O-OG1 3.4Å; Q168-T171 WeakPolarHBondContact O-CB 3.31Å; Q168-T171 PolarHBondContact O-N 2.88Å; Q168-T171 VanDerWaalsContact O-N 3.13Å; T171-K175 WeakPolarHBondContact O-CG 3.38Å; T171-K175 PolarHBondContact O-N 2.97Å; T171-K175 VanDerWaalsContact O-N 3.1Å |
| 172 | L | 88.5 | Confident | 86.9 | Confident | 90 Ų | 90 | 102.2 Ų | 102.2 | 47% | 0.471 | 50% | 0.501 | S | S | . | . | H | α-helix | trans | -69.7 | -42.7 | 175.6 | -163.8 | 72 | 0 | 0 | 0 | 111.6 | Q168 I169 K170 N174 K175 F176 | Q168-L172 WeakPolarHBondContact O-CB 3.1Å; Q168-L172 PolarHBondContact O-N 2.87Å; I169-L172 PolarHBondContact O-N 3.08Å; K170-L172 VanDerWaalsContact C-N 3.3Å; K170-L172 PolarHBondContact O-N 3.02Å; L172-N174 PolarHBondContact O-N 3.47Å; L172-K175 WeakPolarHBondContact O-CB 3.42Å; L172-K175 PolarHBondContact O-N 3.37Å; L172-F176 HydrophobicContact CD1-CE2 4.39Å; L172-F176 HydrophobicContact CD2-CE2 3.83Å; L172-F176 HydrophobicContact CG-CD2 4.06Å; L172-F176 HydrophobicContact CG-CE2 3.64Å; L172-F176 HydrophobicContact CG-CZ 4.47Å; L172-F176 VanDerWaalsContact O-CD2 3.28Å; L172-F176 WeakPolarHBondContact O-CD2 3.26Å; L172-F176 PolarHBondContact O-N 3.37Å |
| 173 | N | 88.3 | Confident | 87.7 | Confident | 90 Ų | 90 | 99 Ų | 99 | 48% | 0.481 | 49% | 0.494 | S | S | . | . | H | α-helix | trans | -64.2 | -37.8 | 174.5 | -76.4 | -15.8 | 0 | 0 | 0 | 112.3 | I169 K170 K175 F176 A177 | I169-N173 VanDerWaalsContact O-CB 3.28Å; I169-N173 WeakPolarHBondContact O-CB 3.41Å; I169-N173 VanDerWaalsContact O-CG 3.24Å; I169-N173 PolarHBondContact O-N 2.98Å; I169-N173 PolarHBondContact O-ND2 2.98Å; K170-N173 PolarHBondContact O-N 2.99Å; N173-K175 VanDerWaalsContact C-N 3.32Å; N173-K175 PolarHBondContact O-N 3.39Å; N173-F176 PolarHBondContact O-N 3.47Å; N173-A177 WeakPolarHBondContact O-CB 3.23Å; N173-A177 PolarHBondContact O-N 3.39Å |
| 174 | N | 89.3 | Confident | 88.3 | Confident | 115 Ų | 115 | 100.4 Ų | 100.4 | 62% | 0.615 | 50% | 0.496 | S | S | * | . | H | α-helix | trans | -64.4 | -38.3 | 173.2 | -69.9 | -6.8 | 0 | 0 | 0 | 111.3 | K170 L172 S178 | K170-N174 WeakPolarHBondContact O-CB 3.19Å; K170-N174 PolarHBondContact O-N 2.8Å; K170-N174 PolarHBondContact O-OD1 2.65Å; L172-N174 PolarHBondContact O-N 3.47Å; N174-S178 PolarHBondContact O-N 2.88Å |
| 175 | K | 91 | Very high | 88.9 | Confident | 119 Ų | 119 | 101.7 Ų | 101.7 | 52% | 0.517 | 50% | 0.498 | S | S | . | . | H | α-helix | trans | -64.9 | -45 | 171.8 | -71.9 | 171.1 | -179.1 | -179.1 | 0 | 111.4 | T171 L172 N173 A177 S178 F179 | T171-K175 WeakPolarHBondContact O-CG 3.38Å; T171-K175 PolarHBondContact O-N 2.97Å; T171-K175 VanDerWaalsContact O-N 3.1Å; L172-K175 WeakPolarHBondContact O-CB 3.42Å; L172-K175 PolarHBondContact O-N 3.37Å; N173-K175 VanDerWaalsContact C-N 3.32Å; N173-K175 PolarHBondContact O-N 3.39Å; K175-A177 PolarHBondContact O-N 2.73Å; K175-S178 PolarHBondContact O-N 3.39Å; K175-S178 PolarHBondContact O-OG 3.48Å; K175-F179 WeakPolarHBondContact O-CD2 3.25Å; K175-F179 PolarHBondContact O-N 2.94Å |
| 176 | F | 91.2 | Very high | 89.6 | Confident | 113 Ų | 113 | 100.6 Ų | 100.6 | 50% | 0.496 | 50% | 0.495 | S | S | . | . | H | α-helix | trans | -61.4 | -41.9 | 175.1 | -76.8 | -55.5 | 0 | 0 | 0 | 112.7 | L172 N173 S178 F179 I180 | L172-F176 HydrophobicContact CD1-CE2 4.39Å; L172-F176 HydrophobicContact CD2-CE2 3.83Å; L172-F176 HydrophobicContact CG-CD2 4.06Å; L172-F176 HydrophobicContact CG-CE2 3.64Å; L172-F176 HydrophobicContact CG-CZ 4.47Å; L172-F176 VanDerWaalsContact O-CD2 3.28Å; L172-F176 WeakPolarHBondContact O-CD2 3.26Å; L172-F176 PolarHBondContact O-N 3.37Å; N173-F176 PolarHBondContact O-N 3.47Å; F176-S178 PolarHBondContact O-N 3.43Å; F176-F179 PolarHBondContact O-N 2.9Å; F176-I180 WeakPolarHBondContact O-CB 3.02Å; F176-I180 WeakPolarHBondContact O-CD1 3.37Å; F176-I180 VanDerWaalsContact O-CG1 3.25Å; F176-I180 WeakPolarHBondContact O-CG1 3.12Å; F176-I180 PolarHBondContact O-N 3.12Å |
| 177 | A | 88.5 | Confident | 90 | Very high | 46 Ų | 46 | 99.5 Ų | 99.5 | 38% | 0.38 | 49% | 0.492 | S | S | . | . | H | α-helix | trans | -57.7 | -49 | 173.2 | 0 | 0 | 0 | 0 | 0 | 111.1 | N173 K175 F179 I180 D181 | N173-A177 WeakPolarHBondContact O-CB 3.23Å; N173-A177 PolarHBondContact O-N 3.39Å; K175-A177 PolarHBondContact O-N 2.73Å; A177-F179 VanDerWaalsContact C-N 3.31Å; A177-F179 PolarHBondContact O-N 3.35Å; A177-I180 PolarHBondContact O-N 3.19Å; A177-I180 VanDerWaalsContact O-N 3.14Å; A177-D181 PolarHBondContact O-N 2.97Å |
| 178 | S | 90.9 | Very high | 90.6 | Very high | 65 Ų | 65 | 101.8 Ų | 101.8 | 46% | 0.455 | 50% | 0.503 | S | S | . | . | H | α-helix | trans | -63.3 | -33.1 | 177.8 | 71.8 | 0 | 0 | 0 | 0 | 113.9 | N174 K175 F176 K182 | N174-S178 PolarHBondContact O-N 2.88Å; K175-S178 PolarHBondContact O-N 3.39Å; K175-S178 PolarHBondContact O-OG 3.48Å; F176-S178 PolarHBondContact O-N 3.43Å; S178-K182 WeakPolarHBondContact O-CB 3.46Å; S178-K182 PolarHBondContact O-N 3.41Å |
| 179 | F | 94.3 | Very high | 91.1 | Very high | 135 Ų | 135 | 99.3 Ų | 99.3 | 59% | 0.592 | 49% | 0.491 | S | S | * | . | H | α-helix | trans | -71.1 | -40.9 | 172.4 | -78.8 | -59.3 | 0 | 0 | 0 | 112.3 | K175 F176 A177 D181 K182 V183 | K175-F179 WeakPolarHBondContact O-CD2 3.25Å; K175-F179 PolarHBondContact O-N 2.94Å; F176-F179 PolarHBondContact O-N 2.9Å; A177-F179 VanDerWaalsContact C-N 3.31Å; A177-F179 PolarHBondContact O-N 3.35Å; F179-D181 VanDerWaalsContact C-N 3.35Å; F179-K182 PolarHBondContact O-N 3.41Å; F179-V183 WeakPolarHBondContact O-CG2 3.26Å; F179-V183 PolarHBondContact O-N 2.97Å |
| 180 | I | 91.1 | Very high | 91.6 | Very high | 92 Ų | 92 | 99 Ų | 99 | 47% | 0.472 | 49% | 0.491 | S | S | . | . | H | α-helix | trans | -61.2 | -44.5 | 175.2 | -70.8 | 163.1 | 0 | 0 | 0 | 110.3 | F176 A177 K182 V183 R184 | F176-I180 WeakPolarHBondContact O-CB 3.02Å; F176-I180 WeakPolarHBondContact O-CD1 3.37Å; F176-I180 VanDerWaalsContact O-CG1 3.25Å; F176-I180 WeakPolarHBondContact O-CG1 3.12Å; F176-I180 PolarHBondContact O-N 3.12Å; A177-I180 PolarHBondContact O-N 3.19Å; A177-I180 VanDerWaalsContact O-N 3.14Å; I180-K182 VanDerWaalsContact C-N 3.33Å; I180-K182 PolarHBondContact O-N 2.9Å; I180-V183 PolarHBondContact O-N 3.16Å; I180-R184 WeakPolarHBondContact O-CB 3.38Å; I180-R184 WeakPolarHBondContact O-CG 3.34Å; I180-R184 PolarHBondContact O-N 3.36Å |
| 181 | D | 92.8 | Very high | 92.1 | Very high | 99 Ų | 99 | 100.7 Ų | 100.7 | 53% | 0.529 | 50% | 0.498 | S | S | . | . | H | α-helix | trans | -63.8 | -39 | 176 | -68.9 | -27.3 | 0 | 0 | 0 | 111.6 | A177 F179 R184 F185 | A177-D181 PolarHBondContact O-N 2.97Å; F179-D181 VanDerWaalsContact C-N 3.35Å; D181-R184 PolarHBondContact O-N 2.82Å; D181-F185 WeakPolarHBondContact O-CB 3.49Å; D181-F185 PolarHBondContact O-N 2.83Å |
| 182 | K | 94.6 | Very high | 92.5 | Very high | 107 Ų | 107 | 103 Ų | 103 | 47% | 0.465 | 51% | 0.507 | S | S | . | . | H | α-helix | trans | -67.2 | -39.3 | 175.9 | -173.8 | 57.6 | 178.2 | 177.4 | 0 | 112.7 | S178 F179 I180 F185 L186 | S178-K182 WeakPolarHBondContact O-CB 3.46Å; S178-K182 PolarHBondContact O-N 3.41Å; F179-K182 PolarHBondContact O-N 3.41Å; I180-K182 VanDerWaalsContact C-N 3.33Å; I180-K182 PolarHBondContact O-N 2.9Å; K182-F185 PolarHBondContact O-N 3.38Å; K182-L186 HydrophobicContact CG-CD1 4.32Å; K182-L186 VanDerWaalsContact O-CG 3.32Å; K182-L186 WeakPolarHBondContact O-CG 3.4Å; K182-L186 PolarHBondContact O-N 3.32Å |
| 183 | V | 94.5 | Very high | 92.8 | Very high | 77 Ų | 77 | 103.8 Ų | 103.8 | 47% | 0.467 | 51% | 0.511 | S | S | . | . | H | α-helix | trans | -64.4 | -48 | 174.2 | 170.4 | 0 | 0 | 0 | 0 | 110.1 | F179 I180 F185 L186 E187 | F179-V183 WeakPolarHBondContact O-CG2 3.26Å; F179-V183 PolarHBondContact O-N 2.97Å; I180-V183 PolarHBondContact O-N 3.16Å; V183-F185 VanDerWaalsContact C-N 3.31Å; V183-F185 PolarHBondContact O-N 2.93Å; V183-L186 CarbonylContact O-C 3.59Å; V183-L186 PolarHBondContact O-N 2.92Å; V183-E187 HydrophobicContact CG1-CG 4.24Å; V183-E187 WeakPolarHBondContact O-CG 3.22Å; V183-E187 PolarHBondContact O-N 2.86Å |
| 184 | R | 91.7 | Very high | 92.9 | Very high | 153 Ų | 153 | 105.1 Ų | 105.1 | 58% | 0.577 | 51% | 0.514 | S | S | * | . | H | α-helix | trans | -57.8 | -41.6 | 176.3 | -74.6 | 174.9 | 173 | -156.7 | -2.7 | 112.8 | I180 D181 E187 Q188 | I180-R184 WeakPolarHBondContact O-CB 3.38Å; I180-R184 WeakPolarHBondContact O-CG 3.34Å; I180-R184 PolarHBondContact O-N 3.36Å; D181-R184 PolarHBondContact O-N 2.82Å; R184-E187 PolarHBondContact O-N 3.4Å; R184-Q188 WeakPolarHBondContact O-CB 3.31Å; R184-Q188 WeakPolarHBondContact O-CG 3.48Å; R184-Q188 PolarHBondContact O-N 3.01Å |
| 185 | F | 95 | Very high | 93 | Very high | 96 Ų | 96 | 104 Ų | 104 | 42% | 0.421 | 51% | 0.511 | S | S | . | . | H | α-helix | trans | -62.4 | -42.8 | 174.8 | 178.6 | -94.4 | 0 | 0 | 0 | 111.9 | D181 K182 V183 Q188 Q189 | D181-F185 WeakPolarHBondContact O-CB 3.49Å; D181-F185 PolarHBondContact O-N 2.83Å; K182-F185 PolarHBondContact O-N 3.38Å; V183-F185 VanDerWaalsContact C-N 3.31Å; V183-F185 PolarHBondContact O-N 2.93Å; F185-Q188 PolarHBondContact O-N 3.45Å; F185-Q189 HydrophobicContact CD1-CG 4.41Å; F185-Q189 HydrophobicContact CE1-CG 4.05Å; F185-Q189 VanDerWaalsContact CE1-OE1 3.23Å; F185-Q189 HydrophobicContact CZ-CG 4.23Å; F185-Q189 WeakPolarHBondContact O-CG 3.18Å; F185-Q189 PolarHBondContact O-N 3.22Å |
| 186 | L | 94.8 | Very high | 93 | Very high | 76 Ų | 76 | 104.5 Ų | 104.5 | 40% | 0.398 | 51% | 0.514 | S | S | . | . | H | α-helix | trans | -69.2 | -37.4 | 176.8 | -70.6 | 170.1 | 0 | 0 | 0 | 112.5 | K182 V183 Q189 N190 | K182-L186 HydrophobicContact CG-CD1 4.32Å; K182-L186 VanDerWaalsContact O-CG 3.32Å; K182-L186 WeakPolarHBondContact O-CG 3.4Å; K182-L186 PolarHBondContact O-N 3.32Å; V183-L186 CarbonylContact O-C 3.59Å; V183-L186 PolarHBondContact O-N 2.92Å; L186-Q189 PolarHBondContact O-N 2.71Å; L186-N190 WeakPolarHBondContact O-CB 3.31Å; L186-N190 PolarHBondContact O-N 2.92Å |
| 187 | E | 93.1 | Very high | 92.8 | Very high | 109 Ų | 109 | 106.7 Ų | 106.7 | 51% | 0.509 | 52% | 0.519 | S | S | . | . | H | α-helix | trans | -62.7 | -41.3 | 172.5 | -72.8 | 174.6 | 166.3 | 0 | 0 | 111.8 | V183 R184 N190 K191 | V183-E187 HydrophobicContact CG1-CG 4.24Å; V183-E187 WeakPolarHBondContact O-CG 3.22Å; V183-E187 PolarHBondContact O-N 2.86Å; R184-E187 PolarHBondContact O-N 3.4Å; E187-N190 PolarHBondContact O-N 3.27Å; E187-K191 PolarHBondContact O-N 3.39Å |
| 188 | Q | 94.1 | Very high | 92.7 | Very high | 137 Ų | 137 | 107.3 Ų | 107.3 | 64% | 0.64 | 52% | 0.52 | S | S | * | . | H | α-helix | trans | -64.9 | -42.3 | 173.8 | -75.5 | 177.1 | -9.3 | 0 | 0 | 111.7 | R184 F185 K191 L192 | R184-Q188 WeakPolarHBondContact O-CB 3.31Å; R184-Q188 WeakPolarHBondContact O-CG 3.48Å; R184-Q188 PolarHBondContact O-N 3.01Å; F185-Q188 PolarHBondContact O-N 3.45Å; Q188-K191 PolarHBondContact O-N 3.42Å; Q188-L192 WeakPolarHBondContact O-CB 3.33Å; Q188-L192 PolarHBondContact O-N 3.43Å |
| 189 | Q | 95 | Very high | 92.4 | Very high | 87 Ų | 87 | 109.9 Ų | 109.9 | 41% | 0.407 | 52% | 0.523 | S | S | . | . | H | α-helix | trans | -64.4 | -41.1 | 174.4 | -74.7 | -168.2 | -40.6 | 0 | 0 | 112.2 | F185 L186 L192 L193 | F185-Q189 HydrophobicContact CD1-CG 4.41Å; F185-Q189 HydrophobicContact CE1-CG 4.05Å; F185-Q189 VanDerWaalsContact CE1-OE1 3.23Å; F185-Q189 HydrophobicContact CZ-CG 4.23Å; F185-Q189 WeakPolarHBondContact O-CG 3.18Å; F185-Q189 PolarHBondContact O-N 3.22Å; L186-Q189 PolarHBondContact O-N 2.71Å; Q189-L192 WeakPolarHBondContact O-CB 3.23Å; Q189-L192 PolarHBondContact O-N 2.93Å; Q189-L193 VanDerWaalsContact O-CG 3.32Å; Q189-L193 WeakPolarHBondContact O-CG 3.42Å; Q189-L193 PolarHBondContact O-N 2.84Å |
| 190 | N | 94.1 | Very high | 91.9 | Very high | 91 Ų | 91 | 107.2 Ų | 107.2 | 49% | 0.487 | 52% | 0.515 | S | S | . | . | H | α-helix | trans | -63.9 | -44.4 | 176 | -78.7 | -5 | 0 | 0 | 0 | 111.5 | L186 E187 L192 L193 E194 | L186-N190 WeakPolarHBondContact O-CB 3.31Å; L186-N190 PolarHBondContact O-N 2.92Å; E187-N190 PolarHBondContact O-N 3.27Å; N190-L192 VanDerWaalsContact C-N 3.3Å; N190-L192 PolarHBondContact O-N 3.39Å; N190-L193 CarbonylContact O-C 3.58Å; N190-L193 PolarHBondContact O-N 3.44Å; N190-L193 VanDerWaalsContact O-N 3.07Å; N190-E194 WeakPolarHBondContact O-CB 3.43Å; N190-E194 WeakPolarHBondContact O-CG 3.33Å; N190-E194 PolarHBondContact O-N 2.87Å |
| 191 | K | 95.1 | Very high | 91.4 | Very high | 144 Ų | 144 | 108.5 Ų | 108.5 | 63% | 0.626 | 52% | 0.519 | S | S | * | . | H | α-helix | trans | -61.1 | -36.3 | 173.4 | -78.2 | 179.8 | 174.7 | 175.7 | 0 | 113.2 | E187 Q188 T195 | E187-K191 PolarHBondContact O-N 3.39Å; Q188-K191 PolarHBondContact O-N 3.42Å; K191-T195 WeakPolarHBondContact O-CB 3.3Å; K191-T195 WeakPolarHBondContact O-CG2 3.39Å; K191-T195 PolarHBondContact O-N 3.41Å; K191-T195 PolarHBondContact O-OG1 2.86Å |
| 192 | L | 94.8 | Very high | 90.6 | Very high | 121 Ų | 121 | 110.6 Ų | 110.6 | 63% | 0.634 | 53% | 0.526 | S | S | * | . | H | α-helix | trans | -66 | -38.9 | 173.3 | -167.2 | 83.4 | 0 | 0 | 0 | 111.5 | Q188 Q189 N190 T195 K196 | Q188-L192 WeakPolarHBondContact O-CB 3.33Å; Q188-L192 PolarHBondContact O-N 3.43Å; Q189-L192 WeakPolarHBondContact O-CB 3.23Å; Q189-L192 PolarHBondContact O-N 2.93Å; N190-L192 VanDerWaalsContact C-N 3.3Å; N190-L192 PolarHBondContact O-N 3.39Å; L192-T195 WeakPolarHBondContact CA-OG1 3.3Å; L192-T195 PolarHBondContact O-OG1 3.5Å; L192-T195 VanDerWaalsContact O-OG1 3.12Å; L192-K196 WeakPolarHBondContact O-CB 3.5Å; L192-K196 PolarHBondContact O-N 3.48Å |
| 193 | L | 94 | Very high | 89.4 | Confident | 108 Ų | 108 | 111.4 Ų | 111.4 | 57% | 0.565 | 53% | 0.531 | S | S | * | . | H | α-helix | trans | -71.7 | -39.9 | 176.9 | -71 | 170.8 | 0 | 0 | 0 | 112.2 | Q189 N190 K196 W197 | Q189-L193 VanDerWaalsContact O-CG 3.32Å; Q189-L193 WeakPolarHBondContact O-CG 3.42Å; Q189-L193 PolarHBondContact O-N 2.84Å; N190-L193 CarbonylContact O-C 3.58Å; N190-L193 PolarHBondContact O-N 3.44Å; N190-L193 VanDerWaalsContact O-N 3.07Å; L193-K196 PolarHBondContact O-N 2.84Å; L193-W197 WeakPolarHBondContact O-CB 3.28Å; L193-W197 PolarHBondContact O-N 3.47Å |
| 194 | E | 91.9 | Very high | 87.8 | Confident | 118 Ų | 118 | 115.8 Ų | 115.8 | 55% | 0.551 | 54% | 0.544 | S | S | * | . | H | α-helix | trans | -60.9 | -51.9 | 173.6 | -74.8 | 167.3 | -178.7 | 0 | 0 | 111.1 | N190 K196 W197 S198 | N190-E194 WeakPolarHBondContact O-CB 3.43Å; N190-E194 WeakPolarHBondContact O-CG 3.33Å; N190-E194 PolarHBondContact O-N 2.87Å; E194-K196 VanDerWaalsContact C-N 3.34Å; E194-K196 PolarHBondContact O-N 3.38Å; E194-W197 WeakPolarHBondContact O-CB 3.29Å; E194-W197 PolarHBondContact O-N 2.95Å; E194-W197 VanDerWaalsContact O-N 3.14Å; E194-S198 PolarHBondContact O-N 3.42Å; E194-S198 PolarHBondContact O-OG 3.21Å |
| 195 | T | 90.8 | Very high | 86.2 | Confident | 90 Ų | 90 | 113.8 Ų | 113.8 | 55% | 0.552 | 55% | 0.552 | S | S | * | * | H | α-helix | trans | -62.8 | -39.6 | 177.7 | 48.2 | 0 | 0 | 0 | 0 | 112.3 | K191 L192 F199 | K191-T195 WeakPolarHBondContact O-CB 3.3Å; K191-T195 WeakPolarHBondContact O-CG2 3.39Å; K191-T195 PolarHBondContact O-N 3.41Å; K191-T195 PolarHBondContact O-OG1 2.86Å; L192-T195 WeakPolarHBondContact CA-OG1 3.3Å; L192-T195 PolarHBondContact O-OG1 3.5Å; L192-T195 VanDerWaalsContact O-OG1 3.12Å; T195-F199 WeakPolarHBondContact O-CB 3.08Å; T195-F199 PolarHBondContact O-N 3.15Å |
| 196 | K | 91.3 | Very high | 84.5 | Confident | 130 Ų | 130 | 115.8 Ų | 115.8 | 57% | 0.565 | 57% | 0.572 | S | S | * | * | H | α-helix | trans | -66.4 | -36.2 | 173.3 | -173.7 | 174.3 | -178.1 | 177.9 | 0 | 112.6 | L192 L193 E194 L200 | L192-K196 WeakPolarHBondContact O-CB 3.5Å; L192-K196 PolarHBondContact O-N 3.48Å; L193-K196 PolarHBondContact O-N 2.84Å; E194-K196 VanDerWaalsContact C-N 3.34Å; E194-K196 PolarHBondContact O-N 3.38Å; K196-L200 HydrophobicContact CG-CD1 4.09Å; K196-L200 WeakPolarHBondContact O-CB 3.22Å; K196-L200 VanDerWaalsContact O-CG 3.25Å; K196-L200 WeakPolarHBondContact O-CG 3.25Å; K196-L200 PolarHBondContact O-N 2.83Å |
| 197 | W | 86.3 | Confident | 83 | Confident | 160 Ų | 160 | 123.3 Ų | 123.3 | 61% | 0.606 | 60% | 0.595 | S | S | * | * | H | α-helix | trans | -66.6 | -49.6 | 175.5 | 175.1 | -91.1 | 0 | 0 | 0 | 111 | L193 E194 F199 L200 Q201 | L193-W197 WeakPolarHBondContact O-CB 3.28Å; L193-W197 PolarHBondContact O-N 3.47Å; E194-W197 WeakPolarHBondContact O-CB 3.29Å; E194-W197 PolarHBondContact O-N 2.95Å; E194-W197 VanDerWaalsContact O-N 3.14Å; W197-F199 PolarHBondContact O-N 3.38Å; W197-L200 PolarHBondContact O-N 3.43Å; W197-Q201 WeakPolarHBondContact O-CB 3.44Å; W197-Q201 PolarHBondContact O-N 3.15Å |
| 198 | S | 86.1 | Confident | 81.7 | Confident | 58 Ų | 58 | 122.4 Ų | 122.4 | 41% | 0.406 | 60% | 0.601 | S | S | . | * | H | α-helix | trans | -56.4 | -48.4 | 175 | -65.1 | 0 | 0 | 0 | 0 | 111.5 | E194 L200 Q201 E202 | E194-S198 PolarHBondContact O-N 3.42Å; E194-S198 PolarHBondContact O-OG 3.21Å; S198-L200 PolarHBondContact O-N 2.63Å; S198-Q201 PolarHBondContact O-N 3.47Å; S198-Q201 VanDerWaalsContact O-N 3.07Å; S198-E202 WeakPolarHBondContact O-CG 3.4Å; S198-E202 PolarHBondContact O-N 3.39Å |
| 199 | F | 86.4 | Confident | 80.8 | Confident | 119 Ų | 119 | 121.2 Ų | 121.2 | 52% | 0.522 | 60% | 0.599 | S | S | . | * | H | α-helix | trans | -60.1 | -42.6 | 177.3 | -178.5 | -98.6 | 0 | 0 | 0 | 112.9 | T195 W197 Q201 Q203 | T195-F199 WeakPolarHBondContact O-CB 3.08Å; T195-F199 PolarHBondContact O-N 3.15Å; W197-F199 PolarHBondContact O-N 3.38Å; F199-Q201 VanDerWaalsContact C-N 3.31Å; F199-Q201 PolarHBondContact O-N 3.12Å; F199-Q203 VanDerWaalsContact O-CB 3.23Å; F199-Q203 WeakPolarHBondContact O-CB 3.41Å; F199-Q203 PolarHBondContact O-N 2.97Å |
| 200 | L | 82.8 | Confident | 80.3 | Confident | 79 Ų | 79 | 121.7 Ų | 121.7 | 41% | 0.414 | 60% | 0.603 | S | S | . | * | H | α-helix | trans | -69.7 | -26.9 | 175.4 | -74.4 | 170.8 | 0 | 0 | 0 | 113 | K196 W197 S198 K204 | K196-L200 HydrophobicContact CG-CD1 4.09Å; K196-L200 WeakPolarHBondContact O-CB 3.22Å; K196-L200 VanDerWaalsContact O-CG 3.25Å; K196-L200 WeakPolarHBondContact O-CG 3.25Å; K196-L200 PolarHBondContact O-N 2.83Å; W197-L200 PolarHBondContact O-N 3.43Å; S198-L200 PolarHBondContact O-N 2.63Å; L200-K204 WeakPolarHBondContact O-CB 3.47Å; L200-K204 PolarHBondContact O-N 3Å |
| 201 | Q | 79.7 | Confident | 80.1 | Confident | 120 Ų | 120 | 124.2 Ų | 124.2 | 56% | 0.561 | 61% | 0.612 | S | S | * | * | H | α-helix | trans | -77.2 | -40.1 | 176.4 | -173.7 | 163 | -6.8 | 0 | 0 | 111.5 | W197 S198 F199 K204 | W197-Q201 WeakPolarHBondContact O-CB 3.44Å; W197-Q201 PolarHBondContact O-N 3.15Å; S198-Q201 PolarHBondContact O-N 3.47Å; S198-Q201 VanDerWaalsContact O-N 3.07Å; F199-Q201 VanDerWaalsContact C-N 3.31Å; F199-Q201 PolarHBondContact O-N 3.12Å; Q201-K204 WeakPolarHBondContact O-CB 3.24Å; Q201-K204 PolarHBondContact O-N 3.36Å |
| 202 | E | 76.8 | Confident | 79.9 | Confident | 143 Ų | 143 | 121.4 Ų | 121.4 | 67% | 0.668 | 61% | 0.609 | S | S | * | * | H | α-helix | trans | -62.2 | -46.4 | 170 | -71.7 | 165.8 | -165.5 | 0 | 0 | 111.1 | S198 K204 C205 | S198-E202 WeakPolarHBondContact O-CG 3.4Å; S198-E202 PolarHBondContact O-N 3.39Å; E202-K204 PolarHBondContact O-N 3.3Å; E202-C205 PolarHBondContact O-N 2.95Å |
| 203 | Q | 69 | Low | 79.8 | Confident | 123 Ų | 123 | 120.7 Ų | 120.7 | 58% | 0.575 | 61% | 0.605 | S | S | * | * | H | α-helix | trans | -67.2 | -19.1 | 179 | -168.2 | 171.2 | 89.4 | 0 | 0 | 113.6 | F199 C205 | F199-Q203 VanDerWaalsContact O-CB 3.23Å; F199-Q203 WeakPolarHBondContact O-CB 3.41Å; F199-Q203 PolarHBondContact O-N 2.97Å; Q203-C205 PolarHBondContact O-N 3.29Å |
| 204 | K | 60.9 | Low | 79.9 | Confident | 170 Ų | 170 | 121.2 Ų | 121.2 | 74% | 0.739 | 60% | 0.603 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -71 | -5.1 | 177.8 | -105.1 | 179.1 | 178.5 | 177 | 0 | 114.6 | L200 Q201 E202 | L200-K204 WeakPolarHBondContact O-CB 3.47Å; L200-K204 PolarHBondContact O-N 3Å; Q201-K204 WeakPolarHBondContact O-CB 3.24Å; Q201-K204 PolarHBondContact O-N 3.36Å; E202-K204 PolarHBondContact O-N 3.3Å |
| 205 | C | 58.7 | Low | 80.1 | Confident | 110 Ų | 110 | 119.9 Ų | 119.9 | 74% | 0.743 | 60% | 0.597 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -114.1 | 44.2 | -174.3 | -149.3 | 0 | 0 | 0 | 0 | 115.2 | E202 Q203 | E202-C205 PolarHBondContact O-N 2.95Å; Q203-C205 PolarHBondContact O-N 3.29Å |
| 206 | V | 59.7 | Low | 80.3 | Confident | 138 Ų | 138 | 118.9 Ų | 118.9 | 84% | 0.836 | 59% | 0.594 | S | S | * | * | trans | -122.4 | 61.8 | 155.7 | -167.1 | 0 | 0 | 0 | 0 | 109.3 | S208 | V206-S208 PolarHBondContact O-N 3.12Š| ||
| 207 | R | 63.2 | Low | 80.6 | Confident | 234 Ų | 234 | 119.3 Ų | 119.3 | 88% | 0.883 | 59% | 0.592 | S | S | * | * | trans | -72.2 | 110.7 | 167.9 | -165.5 | 175.8 | -169.4 | 165 | 1.2 | 106.8 | N209 | R207-N209 PolarHBondContact O-N 3.06Š| ||
| 208 | S | 65.9 | Low | 81.2 | Confident | 91 Ų | 91 | 114.8 Ų | 114.8 | 64% | 0.636 | 58% | 0.58 | S | S | * | * | trans | -54.5 | 105.4 | 180 | 53.6 | 0 | 0 | 0 | 0 | 110.2 | V206 L210 | V206-S208 PolarHBondContact O-N 3.12Å; S208-L210 PolarHBondContact O-N 3Å | ||
| 209 | N | 74.3 | Confident | 81.7 | Confident | 112 Ų | 112 | 115.2 Ų | 115.2 | 60% | 0.599 | 58% | 0.58 | S | S | * | * | trans | -82.1 | 91.5 | -170.6 | -167 | -6.8 | 0 | 0 | 0 | 110.6 | R207 E211 P212 | R207-N209 PolarHBondContact O-N 3.06Å; N209-E211 VanDerWaalsContact C-N 3.32Å; N209-E211 WeakPolarHBondContact OD1-CB 3.44Å; N209-E211 PolarHBondContact OD1-N 2.61Å; N209-E211 VanDerWaalsContact OD1-N 3.13Å; N209-P212 WeakPolarHBondContact O-CD 3.24Å; N209-P212 WeakPolarHBondContact OD1-CD 3.44Å | ||
| 210 | L | 85.4 | Confident | 82.3 | Confident | 96 Ų | 96 | 112.4 Ų | 112.4 | 50% | 0.503 | 57% | 0.57 | S | S | . | * | trans | -84.9 | -5.5 | 176.6 | -60 | 177.1 | 0 | 0 | 0 | 113 | S208 L213 F214 | S208-L210 PolarHBondContact O-N 3Å; L210-L213 WeakPolarHBondContact O-CB 3.5Å; L210-L213 PolarHBondContact O-N 2.79Å; L210-F214 HydrophobicContact CB-CD2 4.08Å; L210-F214 HydrophobicContact CB-CE2 3.78Å; L210-F214 HydrophobicContact CD1-CE2 4.45Å; L210-F214 VanDerWaalsContact O-CD2 3.26Å; L210-F214 WeakPolarHBondContact O-CD2 3.36Å; L210-F214 PolarHBondContact O-N 2.77Å; L210-F214 VanDerWaalsContact O-N 3.1Å | ||
| 211 | E | 89.6 | Confident | 83 | Confident | 145 Ų | 145 | 112.1 Ų | 112.1 | 68% | 0.678 | 57% | 0.569 | S | S | * | * | H | α-helix | trans | -58.7 | -41.8 | -176.7 | -159.1 | 169 | 176.1 | 0 | 0 | 112.8 | N209 L213 F214 E215 | N209-E211 VanDerWaalsContact C-N 3.32Å; N209-E211 WeakPolarHBondContact OD1-CB 3.44Å; N209-E211 PolarHBondContact OD1-N 2.61Å; N209-E211 VanDerWaalsContact OD1-N 3.13Å; E211-L213 VanDerWaalsContact C-N 3.29Å; E211-L213 PolarHBondContact O-N 2.91Å; E211-F214 PolarHBondContact O-N 2.97Å; E211-E215 PolarHBondContact O-N 3.19Å |
| 212 | P | 91 | Very high | 83.9 | Confident | 84 Ų | 84 | 112.9 Ų | 112.9 | 55% | 0.545 | 57% | 0.567 | S | S | . | * | H | α-helix | trans | -63 | -31.7 | 173.7 | -22.7 | 34.6 | 0 | 0 | 0 | 113.8 | N209 S216 | N209-P212 WeakPolarHBondContact O-CD 3.24Å; N209-P212 WeakPolarHBondContact OD1-CD 3.44Å; P212-S216 VanDerWaalsContact O-CB 3.29Å; P212-S216 WeakPolarHBondContact O-CB 3.41Å; P212-S216 PolarHBondContact O-N 2.73Å; P212-S216 PolarHBondContact O-OG 2.97Å |
| 213 | L | 92.9 | Very high | 84.9 | Confident | 107 Ų | 107 | 113.8 Ų | 113.8 | 56% | 0.56 | 56% | 0.564 | S | S | * | * | H | α-helix | trans | -69.4 | -48.3 | 177.4 | -171.7 | 158.6 | 0 | 0 | 0 | 109.6 | L210 E211 E215 S216 Y217 | L210-L213 WeakPolarHBondContact O-CB 3.5Å; L210-L213 PolarHBondContact O-N 2.79Å; E211-L213 VanDerWaalsContact C-N 3.29Å; E211-L213 PolarHBondContact O-N 2.91Å; L213-E215 PolarHBondContact O-N 2.76Å; L213-S216 PolarHBondContact O-N 3.12Å; L213-S216 PolarHBondContact O-OG 3.25Å; L213-Y217 PolarHBondContact O-N 2.89Å |
| 214 | F | 95 | Very high | 86.3 | Confident | 119 Ų | 119 | 112.3 Ų | 112.3 | 52% | 0.522 | 56% | 0.557 | S | S | . | * | H | α-helix | trans | -62.4 | -42.2 | 176 | -69.5 | -62.1 | 0 | 0 | 0 | 112.3 | L210 E211 S216 Y217 I218 | L210-F214 HydrophobicContact CB-CD2 4.08Å; L210-F214 HydrophobicContact CB-CE2 3.78Å; L210-F214 HydrophobicContact CD1-CE2 4.45Å; L210-F214 VanDerWaalsContact O-CD2 3.26Å; L210-F214 WeakPolarHBondContact O-CD2 3.36Å; L210-F214 PolarHBondContact O-N 2.77Å; L210-F214 VanDerWaalsContact O-N 3.1Å; E211-F214 PolarHBondContact O-N 2.97Å; F214-S216 PolarHBondContact O-N 3.41Å; F214-Y217 PolarHBondContact O-N 2.88Å; F214-I218 WeakPolarHBondContact O-CB 3.31Å; F214-I218 VanDerWaalsContact O-CG1 3.24Å; F214-I218 WeakPolarHBondContact O-CG1 3.34Å; F214-I218 PolarHBondContact O-N 2.89Å |
| 215 | E | 96.2 | Very high | 88 | Confident | 89 Ų | 89 | 109.6 Ų | 109.6 | 42% | 0.416 | 55% | 0.55 | S | S | . | . | H | α-helix | trans | -66.8 | -37.2 | 177.3 | -165 | 58.7 | -147.3 | 0 | 0 | 111.8 | E211 L213 Y217 I218 T219 R222 | E211-E215 PolarHBondContact O-N 3.19Å; L213-E215 PolarHBondContact O-N 2.76Å; E215-Y217 VanDerWaalsContact C-N 3.29Å; E215-Y217 PolarHBondContact O-N 3.5Å; E215-I218 PolarHBondContact O-N 3.32Å; E215-T219 HydrophobicContact CG-CG2 4.41Å; E215-T219 WeakPolarHBondContact O-CB 3.42Å; E215-T219 WeakPolarHBondContact O-CG2 3.35Å; E215-T219 PolarHBondContact O-N 2.85Å; E215-T219 PolarHBondContact O-OG1 3.41Å; E215-R222 IonicContact OE1-NH1 3.66Å; E215-R222 PolarHBondContact OE1-NH1 2.82Å |
| 216 | S | 96.3 | Very high | 89.9 | Confident | 70 Ų | 70 | 110.5 Ų | 110.5 | 49% | 0.49 | 54% | 0.543 | S | S | . | . | H | α-helix | trans | -63 | -35.2 | 172.7 | 77.6 | 0 | 0 | 0 | 0 | 112.7 | P212 L213 F214 T219 N220 | P212-S216 VanDerWaalsContact O-CB 3.29Å; P212-S216 WeakPolarHBondContact O-CB 3.41Å; P212-S216 PolarHBondContact O-N 2.73Å; P212-S216 PolarHBondContact O-OG 2.97Å; L213-S216 PolarHBondContact O-N 3.12Å; L213-S216 PolarHBondContact O-OG 3.25Å; F214-S216 PolarHBondContact O-N 3.41Å; S216-T219 WeakPolarHBondContact CA-OG1 3.35Å; S216-T219 PolarHBondContact O-OG1 3.39Å; S216-T219 VanDerWaalsContact O-OG1 3.07Å; S216-N220 WeakPolarHBondContact O-CB 3.41Å; S216-N220 PolarHBondContact O-N 3.02Å; S216-N220 VanDerWaalsContact O-N 3.11Å |
| 217 | Y | 97.2 | Very high | 91.7 | Very high | 138 Ų | 138 | 106.2 Ų | 106.2 | 54% | 0.541 | 52% | 0.522 | S | S | . | . | H | α-helix | trans | -73.4 | -44.3 | 176.6 | -174.1 | -108.3 | 0 | 0 | 0 | 111.6 | L213 F214 E215 N220 L221 | L213-Y217 PolarHBondContact O-N 2.89Å; F214-Y217 PolarHBondContact O-N 2.88Å; E215-Y217 VanDerWaalsContact C-N 3.29Å; E215-Y217 PolarHBondContact O-N 3.5Å; Y217-N220 PolarHBondContact O-N 2.87Å; Y217-L221 HydrophobicContact CD1-CD1 3.87Å; Y217-L221 HydrophobicContact CD1-CG 4.45Å; Y217-L221 HydrophobicContact CE1-CD1 3.43Å; Y217-L221 VanDerWaalsContact CE1-CD1 3.43Å; Y217-L221 HydrophobicContact CE1-CG 4.15Å; Y217-L221 WeakPolarHBondContact O-CG 3.05Å; Y217-L221 PolarHBondContact O-N 3.4Å |
| 218 | I | 97.6 | Very high | 93.4 | Very high | 65 Ų | 65 | 100.7 Ų | 100.7 | 33% | 0.333 | 51% | 0.51 | S | S | . | . | H | α-helix | trans | -61.7 | -45.5 | 176.4 | -70.1 | 164 | 0 | 0 | 0 | 110.9 | F214 E215 L221 R222 | F214-I218 WeakPolarHBondContact O-CB 3.31Å; F214-I218 VanDerWaalsContact O-CG1 3.24Å; F214-I218 WeakPolarHBondContact O-CG1 3.34Å; F214-I218 PolarHBondContact O-N 2.89Å; E215-I218 PolarHBondContact O-N 3.32Å; I218-L221 PolarHBondContact O-N 2.95Å; I218-R222 VanDerWaalsContact CG2-CZ 3.47Å; I218-R222 WeakPolarHBondContact O-CG 3.24Å; I218-R222 PolarHBondContact O-N 2.86Å |
| 219 | T | 97.8 | Very high | 95 | Very high | 68 Ų | 68 | 100.1 Ų | 100.1 | 42% | 0.417 | 50% | 0.502 | S | S | . | . | H | α-helix | trans | -64.9 | -39.4 | 177.1 | 49.2 | 0 | 0 | 0 | 0 | 112.1 | E215 S216 R222 R223 | E215-T219 HydrophobicContact CG-CG2 4.41Å; E215-T219 WeakPolarHBondContact O-CB 3.42Å; E215-T219 WeakPolarHBondContact O-CG2 3.35Å; E215-T219 PolarHBondContact O-N 2.85Å; E215-T219 PolarHBondContact O-OG1 3.41Å; S216-T219 WeakPolarHBondContact CA-OG1 3.35Å; S216-T219 PolarHBondContact O-OG1 3.39Å; S216-T219 VanDerWaalsContact O-OG1 3.07Å; T219-R222 PolarHBondContact O-N 3.46Å; T219-R223 PolarHBondContact O-N 2.82Å |
| 220 | N | 97.9 | Very high | 96.1 | Very high | 59 Ų | 59 | 98.2 Ų | 98.2 | 32% | 0.316 | 50% | 0.497 | S | S | . | . | H | α-helix | trans | -66 | -37.5 | 173.4 | -174.7 | 48.5 | 0 | 0 | 0 | 112.8 | S216 Y217 R223 Q224 | S216-N220 WeakPolarHBondContact O-CB 3.41Å; S216-N220 PolarHBondContact O-N 3.02Å; S216-N220 VanDerWaalsContact O-N 3.11Å; Y217-N220 PolarHBondContact O-N 2.87Å; N220-R223 PolarHBondContact O-N 2.94Å; N220-R223 PolarHBondContact OD1-NH2 3.25Å; N220-Q224 PolarHBondContact ND2-NE2 3.01Å; N220-Q224 WeakPolarHBondContact O-CG 3.33Å; N220-Q224 PolarHBondContact O-N 2.85Å |
| 221 | L | 97.9 | Very high | 96.7 | Very high | 74 Ų | 74 | 96.8 Ų | 96.8 | 39% | 0.387 | 49% | 0.49 | S | S | . | . | H | α-helix | trans | -66.2 | -41.4 | 173.2 | -74.8 | 178.4 | 0 | 0 | 0 | 112.3 | Y217 I218 Q224 L225 | Y217-L221 HydrophobicContact CD1-CD1 3.87Å; Y217-L221 HydrophobicContact CD1-CG 4.45Å; Y217-L221 HydrophobicContact CE1-CD1 3.43Å; Y217-L221 VanDerWaalsContact CE1-CD1 3.43Å; Y217-L221 HydrophobicContact CE1-CG 4.15Å; Y217-L221 WeakPolarHBondContact O-CG 3.05Å; Y217-L221 PolarHBondContact O-N 3.4Å; I218-L221 PolarHBondContact O-N 2.95Å; L221-Q224 PolarHBondContact O-N 3.2Å; L221-L225 PolarHBondContact O-N 3.49Å |
| 222 | R | 98 | Very high | 97.1 | Very high | 136 Ų | 136 | 96.2 Ų | 96.2 | 51% | 0.513 | 49% | 0.488 | S | S | . | . | H | α-helix | trans | -58.8 | -46.7 | 173.5 | -74.4 | 174.6 | -179.8 | 146.5 | 2.4 | 111.2 | E215 I218 T219 Q224 L225 E226 | E215-R222 IonicContact OE1-NH1 3.66Å; E215-R222 PolarHBondContact OE1-NH1 2.82Å; I218-R222 VanDerWaalsContact CG2-CZ 3.47Å; I218-R222 WeakPolarHBondContact O-CG 3.24Å; I218-R222 PolarHBondContact O-N 2.86Å; T219-R222 PolarHBondContact O-N 3.46Å; R222-Q224 VanDerWaalsContact C-N 3.33Å; R222-Q224 PolarHBondContact O-N 3.03Å; R222-L225 WeakPolarHBondContact O-CB 3.46Å; R222-L225 PolarHBondContact O-N 3.44Å; R222-L225 VanDerWaalsContact O-N 3.13Å; R222-E226 WeakPolarHBondContact O-CG 3.28Å; R222-E226 PolarHBondContact O-N 3.42Å |
| 223 | R | 97.9 | Very high | 97.4 | Very high | 162 Ų | 162 | 95.2 Ų | 95.2 | 61% | 0.611 | 49% | 0.486 | S | S | * | . | H | α-helix | trans | -61.9 | -36.9 | 176.7 | -168.7 | -177 | 67.1 | 96 | 3.6 | 113 | T219 N220 A227 | T219-R223 PolarHBondContact O-N 2.82Å; N220-R223 PolarHBondContact O-N 2.94Å; N220-R223 PolarHBondContact OD1-NH2 3.25Å; R223-A227 WeakPolarHBondContact O-CB 3.35Å; R223-A227 PolarHBondContact O-N 2.93Å |
| 224 | Q | 98.2 | Very high | 97.7 | Very high | 92 Ų | 92 | 95.5 Ų | 95.5 | 43% | 0.43 | 48% | 0.48 | S | S | . | . | H | α-helix | trans | -66.9 | -41.1 | 173.3 | -75 | 174.4 | 54.8 | 0 | 0 | 111.9 | N220 L221 R222 A227 L228 | N220-Q224 PolarHBondContact ND2-NE2 3.01Å; N220-Q224 WeakPolarHBondContact O-CG 3.33Å; N220-Q224 PolarHBondContact O-N 2.85Å; L221-Q224 PolarHBondContact O-N 3.2Å; R222-Q224 VanDerWaalsContact C-N 3.33Å; R222-Q224 PolarHBondContact O-N 3.03Å; Q224-A227 PolarHBondContact O-N 2.79Å; Q224-L228 WeakPolarHBondContact O-CG 3.4Å; Q224-L228 PolarHBondContact O-N 3.14Å |
| 225 | L | 98.3 | Very high | 97.8 | Very high | 112 Ų | 112 | 94.1 Ų | 94.1 | 59% | 0.586 | 48% | 0.478 | S | S | * | . | H | α-helix | trans | -62.9 | -45.3 | 175.3 | -178.7 | 64.6 | 0 | 0 | 0 | 111.4 | L221 R222 A227 L228 V229 | L221-L225 PolarHBondContact O-N 3.49Å; R222-L225 WeakPolarHBondContact O-CB 3.46Å; R222-L225 PolarHBondContact O-N 3.44Å; R222-L225 VanDerWaalsContact O-N 3.13Å; L225-A227 PolarHBondContact O-N 2.93Å; L225-L228 PolarHBondContact O-N 3.07Å; L225-V229 HydrophobicContact CD1-CG2 4.39Å; L225-V229 WeakPolarHBondContact O-CB 3.48Å; L225-V229 VanDerWaalsContact O-CG2 3.29Å; L225-V229 WeakPolarHBondContact O-CG2 3.47Å; L225-V229 PolarHBondContact O-N 3.29Å |
| 226 | E | 98 | Very high | 97.9 | Very high | 130 Ų | 130 | 93.2 Ų | 93.2 | 61% | 0.607 | 47% | 0.474 | S | S | * | . | H | α-helix | trans | -59.4 | -44 | 175.5 | -73.3 | 166.1 | -167 | 0 | 0 | 112 | R222 V229 S230 | R222-E226 WeakPolarHBondContact O-CG 3.28Å; R222-E226 PolarHBondContact O-N 3.42Å; E226-V229 PolarHBondContact O-N 3.41Å; E226-S230 PolarHBondContact O-N 3.32Å |
| 227 | A | 98 | Very high | 97.9 | Very high | 47 Ų | 47 | 92.7 Ų | 92.7 | 39% | 0.388 | 47% | 0.473 | S | S | . | . | H | α-helix | trans | -60 | -49.7 | 174.5 | 0 | 0 | 0 | 0 | 0 | 111.5 | R223 Q224 L225 V229 S230 D231 | R223-A227 WeakPolarHBondContact O-CB 3.35Å; R223-A227 PolarHBondContact O-N 2.93Å; Q224-A227 PolarHBondContact O-N 2.79Å; L225-A227 PolarHBondContact O-N 2.93Å; A227-V229 VanDerWaalsContact C-N 3.33Å; A227-V229 PolarHBondContact O-N 2.89Å; A227-S230 PolarHBondContact O-N 3.41Å; A227-S230 VanDerWaalsContact O-N 3.13Å; A227-S230 PolarHBondContact O-OG 2.96Å; A227-D231 PolarHBondContact O-N 3.45Å |
| 228 | L | 98.3 | Very high | 98 | Very high | 119 Ų | 119 | 90 Ų | 90 | 62% | 0.623 | 47% | 0.466 | S | S | * | . | H | α-helix | trans | -62 | -37 | 177.9 | -72.1 | 172 | 0 | 0 | 0 | 113 | Q224 L225 D231 Q232 | Q224-L228 WeakPolarHBondContact O-CG 3.4Å; Q224-L228 PolarHBondContact O-N 3.14Å; L225-L228 PolarHBondContact O-N 3.07Å; L228-D231 PolarHBondContact O-N 3.15Å; L228-Q232 VanDerWaalsContact O-CB 3.31Å; L228-Q232 WeakPolarHBondContact O-CB 3.38Å; L228-Q232 PolarHBondContact O-N 2.79Å |
| 229 | V | 98.4 | Very high | 97.9 | Very high | 78 Ų | 78 | 93.4 Ų | 93.4 | 47% | 0.473 | 47% | 0.474 | S | S | . | . | H | α-helix | trans | -66.6 | -39.6 | 174.3 | 168.5 | 0 | 0 | 0 | 0 | 110.9 | L225 E226 A227 Q232 A233 | L225-V229 HydrophobicContact CD1-CG2 4.39Å; L225-V229 WeakPolarHBondContact O-CB 3.48Å; L225-V229 VanDerWaalsContact O-CG2 3.29Å; L225-V229 WeakPolarHBondContact O-CG2 3.47Å; L225-V229 PolarHBondContact O-N 3.29Å; E226-V229 PolarHBondContact O-N 3.41Å; A227-V229 VanDerWaalsContact C-N 3.33Å; A227-V229 PolarHBondContact O-N 2.89Å; V229-Q232 PolarHBondContact O-N 2.93Å; V229-A233 WeakPolarHBondContact O-CB 3.46Å; V229-A233 PolarHBondContact O-N 3.45Å |
| 230 | S | 97.9 | Very high | 97.9 | Very high | 72 Ų | 72 | 93.6 Ų | 93.6 | 50% | 0.503 | 47% | 0.473 | S | S | . | . | H | α-helix | trans | -66.5 | -40.7 | 175.7 | 77.1 | 0 | 0 | 0 | 0 | 112.4 | E226 A227 A233 R234 | E226-S230 PolarHBondContact O-N 3.32Å; A227-S230 PolarHBondContact O-N 3.41Å; A227-S230 VanDerWaalsContact O-N 3.13Å; A227-S230 PolarHBondContact O-OG 2.96Å; S230-A233 PolarHBondContact O-N 3.21Å; S230-R234 WeakPolarHBondContact O-CB 3.49Å; S230-R234 PolarHBondContact O-N 2.9Å |
| 231 | D | 98.2 | Very high | 97.8 | Very high | 67 Ų | 67 | 96.4 Ų | 96.4 | 36% | 0.358 | 48% | 0.484 | S | S | . | . | H | α-helix | trans | -67.4 | -38.8 | 173.9 | -92.8 | -41.3 | 0 | 0 | 0 | 111.9 | A227 L228 A233 R234 L235 | A227-D231 PolarHBondContact O-N 3.45Å; L228-D231 PolarHBondContact O-N 3.15Å; D231-A233 VanDerWaalsContact C-N 3.33Å; D231-A233 PolarHBondContact O-N 2.88Å; D231-R234 PolarHBondContact O-N 2.86Å; D231-R234 IonicContact OD1-CZ 2.79Å; D231-R234 IonicContact OD1-NE 3.18Å; D231-R234 PolarHBondContact OD1-NE 3.47Å; D231-R234 VanDerWaalsContact OD1-NE 3.1Å; D231-R234 IonicContact OD1-NH2 3.26Å; D231-R234 PolarHBondContact OD1-NH2 3.31Å; D231-L235 WeakPolarHBondContact O-CB 3.34Å; D231-L235 VanDerWaalsContact O-CG 3.26Å; D231-L235 WeakPolarHBondContact O-CG 3.37Å; D231-L235 PolarHBondContact O-N 3.22Å |
| 232 | Q | 98.2 | Very high | 97.8 | Very high | 132 Ų | 132 | 98.4 Ų | 98.4 | 62% | 0.617 | 49% | 0.494 | S | S | * | . | H | α-helix | trans | -59.8 | -44.2 | 172.9 | -177.1 | -176.9 | 0.9 | 0 | 0 | 111.1 | L228 V229 Q236 | L228-Q232 VanDerWaalsContact O-CB 3.31Å; L228-Q232 WeakPolarHBondContact O-CB 3.38Å; L228-Q232 PolarHBondContact O-N 2.79Å; V229-Q232 PolarHBondContact O-N 2.93Å; Q232-Q236 WeakPolarHBondContact O-CB 3.44Å; Q232-Q236 PolarHBondContact O-N 3.38Å |
| 233 | A | 97 | Very high | 97.8 | Very high | 63 Ų | 63 | 96.5 Ų | 96.5 | 52% | 0.521 | 49% | 0.491 | S | S | . | . | H | α-helix | trans | -64.5 | -41.9 | 176.9 | 0 | 0 | 0 | 0 | 0 | 112.1 | V229 S230 D231 Q236 A237 | V229-A233 WeakPolarHBondContact O-CB 3.46Å; V229-A233 PolarHBondContact O-N 3.45Å; S230-A233 PolarHBondContact O-N 3.21Å; D231-A233 VanDerWaalsContact C-N 3.33Å; D231-A233 PolarHBondContact O-N 2.88Å; A233-Q236 PolarHBondContact O-N 3.27Å; A233-A237 PolarHBondContact O-N 3.32Å |
| 234 | R | 98.4 | Very high | 97.7 | Very high | 113 Ų | 113 | 93.8 Ų | 93.8 | 43% | 0.426 | 49% | 0.489 | S | S | . | . | H | α-helix | trans | -62.2 | -51.4 | 175.2 | -177.7 | -176.7 | 59.9 | 74.1 | 0.3 | 111.9 | S230 D231 Q236 A237 E238 | S230-R234 WeakPolarHBondContact O-CB 3.49Å; S230-R234 PolarHBondContact O-N 2.9Å; D231-R234 PolarHBondContact O-N 2.86Å; D231-R234 IonicContact OD1-CZ 2.79Å; D231-R234 IonicContact OD1-NE 3.18Å; D231-R234 PolarHBondContact OD1-NE 3.47Å; D231-R234 VanDerWaalsContact OD1-NE 3.1Å; D231-R234 IonicContact OD1-NH2 3.26Å; D231-R234 PolarHBondContact OD1-NH2 3.31Å; R234-Q236 VanDerWaalsContact C-N 3.27Å; R234-Q236 PolarHBondContact O-N 3Å; R234-A237 WeakPolarHBondContact O-CB 3.4Å; R234-A237 PolarHBondContact O-N 2.85Å; R234-A237 VanDerWaalsContact O-N 3.11Å; R234-E238 WeakPolarHBondContact CG-OE1 3.27Å; R234-E238 IonicContact CZ-OE1 3.49Å; R234-E238 VanDerWaalsContact NH1-CD 3.33Å; R234-E238 IonicContact NH1-OE1 3.57Å; R234-E238 PolarHBondContact NH1-OE1 3.48Å; R234-E238 IonicContact NH1-OE2 3.73Å; R234-E238 PolarHBondContact NH1-OE2 2.99Å; R234-E238 WeakPolarHBondContact O-CG 3.43Å; R234-E238 PolarHBondContact O-N 2.97Å |
| 235 | L | 98 | Very high | 97.7 | Very high | 91 Ų | 91 | 92.2 Ų | 92.2 | 48% | 0.476 | 49% | 0.485 | S | S | . | . | H | α-helix | trans | -63.8 | -31.7 | 177.9 | -69.5 | 170.7 | 0 | 0 | 0 | 112.4 | D231 R239 | D231-L235 WeakPolarHBondContact O-CB 3.34Å; D231-L235 VanDerWaalsContact O-CG 3.26Å; D231-L235 WeakPolarHBondContact O-CG 3.37Å; D231-L235 PolarHBondContact O-N 3.22Å; L235-R239 WeakPolarHBondContact O-CB 3.2Å; L235-R239 PolarHBondContact O-N 3.29Å |
| 236 | Q | 97.9 | Very high | 97.7 | Very high | 70 Ų | 70 | 92.2 Ų | 92.2 | 33% | 0.327 | 49% | 0.485 | S | S | . | . | H | α-helix | trans | -66.8 | -41.9 | 172.4 | -179.3 | 65.5 | 53.4 | 0 | 0 | 111.4 | Q232 A233 R234 R239 N240 | Q232-Q236 WeakPolarHBondContact O-CB 3.44Å; Q232-Q236 PolarHBondContact O-N 3.38Å; A233-Q236 PolarHBondContact O-N 3.27Å; R234-Q236 VanDerWaalsContact C-N 3.27Å; R234-Q236 PolarHBondContact O-N 3Å; Q236-R239 VanDerWaalsContact CD-NH1 3.31Å; Q236-R239 PolarHBondContact O-N 3Å; Q236-N240 PolarHBondContact NE2-OD1 3.15Å; Q236-N240 PolarHBondContact O-N 3.48Å; Q236-N240 PolarHBondContact O-OD1 2.74Å; Q236-N240 VanDerWaalsContact O-OD1 3.13Å |
| 237 | A | 97.1 | Very high | 97.6 | Very high | 58 Ų | 58 | 90.7 Ų | 90.7 | 48% | 0.479 | 48% | 0.478 | S | S | . | . | H | α-helix | trans | -66.5 | -43.1 | 175.2 | 0 | 0 | 0 | 0 | 0 | 112 | A233 R234 R239 N240 H241 | A233-A237 PolarHBondContact O-N 3.32Å; R234-A237 WeakPolarHBondContact O-CB 3.4Å; R234-A237 PolarHBondContact O-N 2.85Å; R234-A237 VanDerWaalsContact O-N 3.11Å; A237-R239 PolarHBondContact O-N 2.88Å; A237-N240 PolarHBondContact O-N 3.47Å; A237-H241 WeakPolarHBondContact O-CB 3.33Å; A237-H241 PolarHBondContact O-N 2.88Å |
| 238 | E | 98.1 | Very high | 97.6 | Very high | 83 Ų | 83 | 90 Ų | 90 | 39% | 0.388 | 48% | 0.475 | S | S | . | . | H | α-helix | trans | -60.1 | -43.5 | 174.1 | -73.5 | 168.7 | -162.2 | 0 | 0 | 111.7 | R234 H241 L242 | R234-E238 WeakPolarHBondContact CG-OE1 3.27Å; R234-E238 IonicContact CZ-OE1 3.49Å; R234-E238 VanDerWaalsContact NH1-CD 3.33Å; R234-E238 IonicContact NH1-OE1 3.57Å; R234-E238 PolarHBondContact NH1-OE1 3.48Å; R234-E238 IonicContact NH1-OE2 3.73Å; R234-E238 PolarHBondContact NH1-OE2 2.99Å; R234-E238 WeakPolarHBondContact O-CG 3.43Å; R234-E238 PolarHBondContact O-N 2.97Å; E238-H241 PolarHBondContact O-N 2.89Å; E238-L242 WeakPolarHBondContact O-CB 3.36Å; E238-L242 WeakPolarHBondContact O-CG 3.46Å; E238-L242 PolarHBondContact O-N 3.19Å |
| 239 | R | 97.1 | Very high | 97.5 | Very high | 136 Ų | 136 | 90.6 Ų | 90.6 | 51% | 0.513 | 47% | 0.473 | S | S | . | . | H | α-helix | trans | -62 | -47.1 | 175 | -167.6 | -153.2 | -52 | 135.1 | 17.9 | 111.8 | L235 Q236 A237 H241 L242 Q243 | L235-R239 WeakPolarHBondContact O-CB 3.2Å; L235-R239 PolarHBondContact O-N 3.29Å; Q236-R239 VanDerWaalsContact CD-NH1 3.31Å; Q236-R239 PolarHBondContact O-N 3Å; A237-R239 PolarHBondContact O-N 2.88Å; R239-H241 VanDerWaalsContact C-N 3.34Å; R239-H241 PolarHBondContact O-N 3.48Å; R239-L242 PolarHBondContact O-N 2.75Å; R239-Q243 WeakPolarHBondContact O-CB 3.46Å; R239-Q243 PolarHBondContact O-N 3.39Å |
| 240 | N | 96.6 | Very high | 97.5 | Very high | 72 Ų | 72 | 92.5 Ų | 92.5 | 39% | 0.385 | 48% | 0.475 | S | S | . | . | H | α-helix | trans | -59.6 | -46.7 | 178.8 | -69.5 | 4.1 | 0 | 0 | 0 | 110.4 | Q236 A237 L242 Q243 D244 | Q236-N240 PolarHBondContact NE2-OD1 3.15Å; Q236-N240 PolarHBondContact O-N 3.48Å; Q236-N240 PolarHBondContact O-OD1 2.74Å; Q236-N240 VanDerWaalsContact O-OD1 3.13Å; A237-N240 PolarHBondContact O-N 3.47Å; N240-L242 PolarHBondContact O-N 3.15Å; N240-Q243 WeakPolarHBondContact O-CB 3.42Å; N240-Q243 PolarHBondContact O-N 2.84Å; N240-Q243 VanDerWaalsContact O-N 3.12Å; N240-D244 VanDerWaalsContact O-CG 3.29Å; N240-D244 PolarHBondContact O-N 3.01Å |
| 241 | H | 97.4 | Very high | 97.4 | Very high | 117 Ų | 117 | 95 Ų | 95 | 54% | 0.542 | 48% | 0.476 | S | S | . | . | H | α-helix | trans | -60.2 | -44.2 | 177.3 | 177.5 | 53.9 | 0 | 0 | 0 | 112.8 | A237 E238 R239 Q243 D244 V245 | A237-H241 WeakPolarHBondContact O-CB 3.33Å; A237-H241 PolarHBondContact O-N 2.88Å; E238-H241 PolarHBondContact O-N 2.89Å; R239-H241 VanDerWaalsContact C-N 3.34Å; R239-H241 PolarHBondContact O-N 3.48Å; H241-Q243 VanDerWaalsContact C-N 3.29Å; H241-Q243 PolarHBondContact O-N 3.35Å; H241-D244 PolarHBondContact O-N 3.39Å; H241-V245 WeakPolarHBondContact O-CG2 3.47Å; H241-V245 PolarHBondContact O-N 2.88Å |
| 242 | L | 97.4 | Very high | 97.4 | Very high | 116 Ų | 116 | 98 Ų | 98 | 61% | 0.607 | 49% | 0.486 | S | S | * | . | H | α-helix | trans | -65.5 | -33.2 | 175.6 | -71.6 | 173.4 | 0 | 0 | 0 | 112.3 | E238 R239 N240 L246 | E238-L242 WeakPolarHBondContact O-CB 3.36Å; E238-L242 WeakPolarHBondContact O-CG 3.46Å; E238-L242 PolarHBondContact O-N 3.19Å; R239-L242 PolarHBondContact O-N 2.75Å; N240-L242 PolarHBondContact O-N 3.15Å; L242-L246 WeakPolarHBondContact O-CB 3.38Å; L242-L246 PolarHBondContact O-N 2.9Å |
| 243 | Q | 97.1 | Very high | 97.3 | Very high | 97 Ų | 97 | 99.5 Ų | 99.5 | 45% | 0.453 | 49% | 0.488 | S | S | . | . | H | α-helix | trans | -67 | -46.8 | 173.3 | -179.4 | 172.1 | -14.6 | 0 | 0 | 111.3 | R239 N240 H241 V245 L246 E247 | R239-Q243 WeakPolarHBondContact O-CB 3.46Å; R239-Q243 PolarHBondContact O-N 3.39Å; N240-Q243 WeakPolarHBondContact O-CB 3.42Å; N240-Q243 PolarHBondContact O-N 2.84Å; N240-Q243 VanDerWaalsContact O-N 3.12Å; H241-Q243 VanDerWaalsContact C-N 3.29Å; H241-Q243 PolarHBondContact O-N 3.35Å; Q243-V245 VanDerWaalsContact C-N 3.28Å; Q243-V245 PolarHBondContact O-N 3.07Å; Q243-L246 PolarHBondContact O-N 2.98Å; Q243-L246 VanDerWaalsContact O-N 3.14Å; Q243-E247 HydrophobicContact CG-CG 4.39Å; Q243-E247 WeakPolarHBondContact CG-OE1 3.48Å; Q243-E247 PolarHBondContact NE2-OE1 3.39Å; Q243-E247 WeakPolarHBondContact O-CB 3.42Å; Q243-E247 WeakPolarHBondContact O-CG 3.29Å; Q243-E247 PolarHBondContact O-N 3.46Å |
| 244 | D | 96.9 | Very high | 97.3 | Very high | 105 Ų | 105 | 101.2 Ų | 101.2 | 56% | 0.561 | 49% | 0.485 | S | S | * | . | H | α-helix | trans | -57.5 | -41.8 | 175.8 | -62.7 | -28.6 | 0 | 0 | 0 | 111.5 | N240 H241 G248 | N240-D244 VanDerWaalsContact O-CG 3.29Å; N240-D244 PolarHBondContact O-N 3.01Å; H241-D244 PolarHBondContact O-N 3.39Å; D244-G248 PolarHBondContact O-N 2.96Å |
| 245 | V | 97.6 | Very high | 97.1 | Very high | 58 Ų | 58 | 100.2 Ų | 100.2 | 35% | 0.352 | 49% | 0.485 | S | S | . | . | H | α-helix | trans | -65.9 | -42.8 | 176.3 | 169.8 | 0 | 0 | 0 | 0 | 111.5 | H241 Q243 G248 F249 | H241-V245 WeakPolarHBondContact O-CG2 3.47Å; H241-V245 PolarHBondContact O-N 2.88Å; Q243-V245 VanDerWaalsContact C-N 3.28Å; Q243-V245 PolarHBondContact O-N 3.07Å; V245-G248 PolarHBondContact O-N 3.04Å; V245-F249 HydrophobicContact CG1-CD2 3.77Å; V245-F249 HydrophobicContact CG1-CE2 3.5Å; V245-F249 WeakPolarHBondContact O-CD2 3.34Å; V245-F249 PolarHBondContact O-N 3.18Å |
| 246 | L | 97.4 | Very high | 97.1 | Very high | 112 Ų | 112 | 102 Ų | 102 | 59% | 0.586 | 49% | 0.491 | S | S | * | . | H | α-helix | trans | -64.5 | -44.8 | 176.9 | -175.9 | 156.5 | 0 | 0 | 0 | 111.5 | L242 Q243 G248 F249 K250 | L242-L246 WeakPolarHBondContact O-CB 3.38Å; L242-L246 PolarHBondContact O-N 2.9Å; Q243-L246 PolarHBondContact O-N 2.98Å; Q243-L246 VanDerWaalsContact O-N 3.14Å; L246-G248 VanDerWaalsContact C-N 3.3Å; L246-G248 PolarHBondContact O-N 2.87Å; L246-F249 PolarHBondContact O-N 3.3Å; L246-K250 WeakPolarHBondContact O-CB 3.49Å; L246-K250 PolarHBondContact O-N 3.3Å |
| 247 | E | 97.1 | Very high | 97.1 | Very high | 99 Ų | 99 | 101.9 Ų | 101.9 | 46% | 0.463 | 50% | 0.495 | S | S | . | . | H | α-helix | trans | -62.8 | -38.3 | 175.3 | -71.4 | -178.6 | -160.2 | 0 | 0 | 111.1 | Q243 K250 K251 | Q243-E247 HydrophobicContact CG-CG 4.39Å; Q243-E247 WeakPolarHBondContact CG-OE1 3.48Å; Q243-E247 PolarHBondContact NE2-OE1 3.39Å; Q243-E247 WeakPolarHBondContact O-CB 3.42Å; Q243-E247 WeakPolarHBondContact O-CG 3.29Å; Q243-E247 PolarHBondContact O-N 3.46Å; E247-K250 PolarHBondContact O-N 3.01Å; E247-K251 WeakPolarHBondContact O-CB 3.41Å; E247-K251 PolarHBondContact O-N 2.86Å |
| 248 | G | 96.8 | Very high | 97 | Very high | 31 Ų | 31 | 103.1 Ų | 103.1 | 32% | 0.32 | 50% | 0.496 | S | S | . | . | H | α-helix | trans | -61.4 | -41.4 | 171.1 | 0 | 0 | 0 | 0 | 0 | 113.9 | D244 V245 L246 K252 | D244-G248 PolarHBondContact O-N 2.96Å; V245-G248 PolarHBondContact O-N 3.04Å; L246-G248 VanDerWaalsContact C-N 3.3Å; L246-G248 PolarHBondContact O-N 2.87Å; G248-K252 WeakPolarHBondContact O-CG 3.24Å; G248-K252 PolarHBondContact O-N 3.41Å |
| 249 | F | 97 | Very high | 96.9 | Very high | 132 Ų | 132 | 102.8 Ų | 102.8 | 58% | 0.579 | 50% | 0.503 | S | S | * | . | H | α-helix | trans | -70.2 | -40.6 | 174 | -78.1 | -59.7 | 0 | 0 | 0 | 112.6 | V245 L246 K251 K252 Y253 | V245-F249 HydrophobicContact CG1-CD2 3.77Å; V245-F249 HydrophobicContact CG1-CE2 3.5Å; V245-F249 WeakPolarHBondContact O-CD2 3.34Å; V245-F249 PolarHBondContact O-N 3.18Å; L246-F249 PolarHBondContact O-N 3.3Å; F249-K251 VanDerWaalsContact C-N 3.34Å; F249-K251 PolarHBondContact O-N 3.46Å; F249-K252 PolarHBondContact O-N 3.33Å; F249-Y253 PolarHBondContact O-N 2.92Å |
| 250 | K | 97.7 | Very high | 96.9 | Very high | 119 Ų | 119 | 103 Ų | 103 | 52% | 0.517 | 50% | 0.503 | S | S | . | . | H | α-helix | trans | -58.6 | -46.5 | 175.2 | 179.4 | -177.3 | 166.8 | -173.9 | 0 | 110.9 | L246 E247 K252 Y253 E254 | L246-K250 WeakPolarHBondContact O-CB 3.49Å; L246-K250 PolarHBondContact O-N 3.3Å; E247-K250 PolarHBondContact O-N 3.01Å; K250-K252 PolarHBondContact O-N 2.69Å; K250-Y253 WeakPolarHBondContact O-CB 3.25Å; K250-Y253 PolarHBondContact O-N 2.94Å; K250-E254 WeakPolarHBondContact CE-OE1 3.23Å; K250-E254 IonicContact NZ-OE1 2.62Å; K250-E254 WeakPolarHBondContact O-CG 3.41Å; K250-E254 PolarHBondContact O-N 3.46Å |
| 251 | K | 96.4 | Very high | 96.8 | Very high | 123 Ų | 123 | 101.5 Ų | 101.5 | 54% | 0.535 | 50% | 0.501 | S | S | . | . | H | α-helix | trans | -59.5 | -45.9 | 176.7 | -174.8 | 173.5 | -173.6 | -80.2 | 0 | 112.1 | E247 F249 Y253 E254 E255 | E247-K251 WeakPolarHBondContact O-CB 3.41Å; E247-K251 PolarHBondContact O-N 2.86Å; F249-K251 VanDerWaalsContact C-N 3.34Å; F249-K251 PolarHBondContact O-N 3.46Å; K251-Y253 VanDerWaalsContact C-N 3.31Å; K251-Y253 PolarHBondContact O-N 3.46Å; K251-E254 PolarHBondContact O-N 2.99Å; K251-E255 IonicContact NZ-OE1 3.02Å; K251-E255 PolarHBondContact NZ-OE1 2.96Å; K251-E255 WeakPolarHBondContact O-CB 3.28Å; K251-E255 VanDerWaalsContact O-CG 3.31Å; K251-E255 WeakPolarHBondContact O-CG 3.43Å; K251-E255 PolarHBondContact O-N 3.32Å |
| 252 | K | 97.8 | Very high | 96.6 | Very high | 130 Ų | 130 | 99.9 Ų | 99.9 | 57% | 0.565 | 50% | 0.496 | S | S | * | . | H | α-helix | trans | -61.2 | -38.4 | 175.5 | -72.5 | 172.1 | -178.1 | 177.9 | 0 | 112.5 | G248 F249 K250 E256 | G248-K252 WeakPolarHBondContact O-CG 3.24Å; G248-K252 PolarHBondContact O-N 3.41Å; F249-K252 PolarHBondContact O-N 3.33Å; K250-K252 PolarHBondContact O-N 2.69Å; K252-E256 WeakPolarHBondContact O-CB 3.4Å; K252-E256 PolarHBondContact O-N 2.92Å |
| 253 | Y | 97.1 | Very high | 96.5 | Very high | 164 Ų | 164 | 97 Ų | 97 | 64% | 0.643 | 49% | 0.489 | S | S | * | . | H | α-helix | trans | -66.6 | -42.9 | 175.6 | 175.1 | -94.8 | 0 | 0 | 0 | 111.9 | F249 K250 K251 E256 V257 | F249-Y253 PolarHBondContact O-N 2.92Å; K250-Y253 WeakPolarHBondContact O-CB 3.25Å; K250-Y253 PolarHBondContact O-N 2.94Å; K251-Y253 VanDerWaalsContact C-N 3.31Å; K251-Y253 PolarHBondContact O-N 3.46Å; Y253-E256 PolarHBondContact O-N 2.84Å; Y253-V257 HydrophobicContact CD1-CG2 4.28Å; Y253-V257 HydrophobicContact CE1-CG2 3.82Å; Y253-V257 HydrophobicContact CE2-CG2 4.13Å; Y253-V257 WeakPolarHBondContact O-CB 3.48Å; Y253-V257 VanDerWaalsContact O-CG2 3.29Å; Y253-V257 WeakPolarHBondContact O-CG2 3.42Å; Y253-V257 PolarHBondContact O-N 3.35Å |
| 254 | E | 96.4 | Very high | 96.4 | Very high | 100 Ų | 100 | 96.5 Ų | 96.5 | 47% | 0.467 | 49% | 0.486 | S | S | . | . | H | α-helix | trans | -62.9 | -41.6 | 174.8 | -71.1 | 171.3 | 176 | 0 | 0 | 111.7 | K250 K251 V257 V258 | K250-E254 WeakPolarHBondContact CE-OE1 3.23Å; K250-E254 IonicContact NZ-OE1 2.62Å; K250-E254 WeakPolarHBondContact O-CG 3.41Å; K250-E254 PolarHBondContact O-N 3.46Å; K251-E254 PolarHBondContact O-N 2.99Å; E254-V257 PolarHBondContact O-N 3.43Å; E254-V258 WeakPolarHBondContact O-CG2 3.49Å; E254-V258 PolarHBondContact O-N 3.41Å; E254-V258 VanDerWaalsContact O-N 3.16Å |
| 255 | E | 95.4 | Very high | 96.4 | Very high | 92 Ų | 92 | 96.6 Ų | 96.6 | 43% | 0.43 | 49% | 0.487 | S | S | . | . | H | α-helix | trans | -60.8 | -47.9 | 172.8 | -73.4 | 167.7 | 174.5 | 0 | 0 | 111.8 | K251 V257 V258 C259 | K251-E255 IonicContact NZ-OE1 3.02Å; K251-E255 PolarHBondContact NZ-OE1 2.96Å; K251-E255 WeakPolarHBondContact O-CB 3.28Å; K251-E255 VanDerWaalsContact O-CG 3.31Å; K251-E255 WeakPolarHBondContact O-CG 3.43Å; K251-E255 PolarHBondContact O-N 3.32Å; E255-V257 PolarHBondContact O-N 3.14Å; E255-V258 PolarHBondContact O-N 2.94Å; E255-C259 PolarHBondContact O-N 3.13Å |
| 256 | E | 97.1 | Very high | 96.4 | Very high | 127 Ų | 127 | 100.5 Ų | 100.5 | 59% | 0.593 | 50% | 0.501 | S | S | * | . | H | α-helix | trans | -63.4 | -40.3 | 178.8 | -173.6 | 61.4 | -149.5 | 0 | 0 | 112.1 | K252 Y253 V258 C259 R260 | K252-E256 WeakPolarHBondContact O-CB 3.4Å; K252-E256 PolarHBondContact O-N 2.92Å; Y253-E256 PolarHBondContact O-N 2.84Å; E256-V258 VanDerWaalsContact C-N 3.32Å; E256-V258 PolarHBondContact O-N 2.81Å; E256-C259 PolarHBondContact O-N 2.91Å; E256-R260 VanDerWaalsContact O-CB 3.32Å; E256-R260 WeakPolarHBondContact O-CB 3.34Å; E256-R260 PolarHBondContact O-N 3.15Å |
| 257 | V | 96.9 | Very high | 96.4 | Very high | 69 Ų | 69 | 101.8 Ų | 101.8 | 42% | 0.418 | 50% | 0.503 | S | S | . | . | H | α-helix | trans | -61.1 | -41.2 | 175.2 | 167.1 | 0 | 0 | 0 | 0 | 111.4 | Y253 E254 E255 A261 | Y253-V257 HydrophobicContact CD1-CG2 4.28Å; Y253-V257 HydrophobicContact CE1-CG2 3.82Å; Y253-V257 HydrophobicContact CE2-CG2 4.13Å; Y253-V257 WeakPolarHBondContact O-CB 3.48Å; Y253-V257 VanDerWaalsContact O-CG2 3.29Å; Y253-V257 WeakPolarHBondContact O-CG2 3.42Å; Y253-V257 PolarHBondContact O-N 3.35Å; E254-V257 PolarHBondContact O-N 3.43Å; E255-V257 PolarHBondContact O-N 3.14Å; V257-A261 WeakPolarHBondContact O-CB 3.38Å; V257-A261 PolarHBondContact O-N 3.23Å |
| 258 | V | 95.4 | Very high | 96.4 | Very high | 83 Ų | 83 | 100.6 Ų | 100.6 | 50% | 0.503 | 50% | 0.502 | S | S | . | . | H | α-helix | trans | -68.7 | -43.9 | 176 | 172.4 | 0 | 0 | 0 | 0 | 111.3 | E254 E255 E256 R260 A261 N262 | E254-V258 WeakPolarHBondContact O-CG2 3.49Å; E254-V258 PolarHBondContact O-N 3.41Å; E254-V258 VanDerWaalsContact O-N 3.16Å; E255-V258 PolarHBondContact O-N 2.94Å; E256-V258 VanDerWaalsContact C-N 3.32Å; E256-V258 PolarHBondContact O-N 2.81Å; V258-R260 VanDerWaalsContact C-N 3.35Å; V258-R260 PolarHBondContact O-N 2.85Å; V258-A261 PolarHBondContact O-N 2.91Å; V258-N262 VanDerWaalsContact O-CG 3.27Å; V258-N262 PolarHBondContact O-N 3.48Å; V258-N262 PolarHBondContact O-ND2 3.33Å |
| 259 | C | 96.7 | Very high | 96.4 | Very high | 77 Ų | 77 | 101.2 Ų | 101.2 | 52% | 0.52 | 50% | 0.504 | S | S | . | . | H | α-helix | trans | -59.5 | -43.6 | 174.8 | -82.5 | 0 | 0 | 0 | 0 | 112.1 | E255 E256 N262 A263 | E255-C259 PolarHBondContact O-N 3.13Å; E256-C259 PolarHBondContact O-N 2.91Å; C259-N262 PolarHBondContact O-N 3.39Å; C259-A263 WeakPolarHBondContact O-CB 3.48Å; C259-A263 PolarHBondContact O-N 2.96Å |
| 260 | R | 96.8 | Very high | 96.5 | Very high | 141 Ų | 141 | 99.9 Ų | 99.9 | 53% | 0.532 | 50% | 0.502 | S | S | . | . | H | α-helix | trans | -61.7 | -45.8 | 176.4 | -159.5 | -171.5 | 94.4 | 73.3 | 11.2 | 111.6 | E256 V258 N262 A263 E264 | E256-R260 VanDerWaalsContact O-CB 3.32Å; E256-R260 WeakPolarHBondContact O-CB 3.34Å; E256-R260 PolarHBondContact O-N 3.15Å; V258-R260 VanDerWaalsContact C-N 3.35Å; V258-R260 PolarHBondContact O-N 2.85Å; R260-N262 VanDerWaalsContact C-N 3.34Å; R260-N262 PolarHBondContact O-N 3.22Å; R260-A263 PolarHBondContact O-N 2.94Å; R260-E264 VanDerWaalsContact CZ-CD 3.42Å; R260-E264 IonicContact CZ-OE1 2.66Å; R260-E264 IonicContact CZ-OE2 2.73Å; R260-E264 VanDerWaalsContact NH1-CD 3.31Å; R260-E264 IonicContact NH1-OE1 3.1Å; R260-E264 PolarHBondContact NH1-OE1 2.67Å; R260-E264 IonicContact NH1-OE2 2.82Å; R260-E264 IonicContact NH2-OE1 2.73Å; R260-E264 PolarHBondContact NH2-OE1 3.35Å; R260-E264 IonicContact NH2-OE2 3.85Å; R260-E264 PolarHBondContact NH2-OE2 3.5Å; R260-E264 WeakPolarHBondContact O-CG 3.4Å; R260-E264 PolarHBondContact O-N 3.47Å |
| 261 | A | 94.6 | Very high | 96.5 | Very high | 40 Ų | 40 | 100 Ų | 100 | 33% | 0.331 | 50% | 0.503 | S | S | . | . | H | α-helix | trans | -63.3 | -39 | 177.3 | 0 | 0 | 0 | 0 | 0 | 112.3 | V257 V258 E264 N265 | V257-A261 WeakPolarHBondContact O-CB 3.38Å; V257-A261 PolarHBondContact O-N 3.23Å; V258-A261 PolarHBondContact O-N 2.91Å; A261-E264 PolarHBondContact O-N 3.35Å; A261-N265 WeakPolarHBondContact O-CB 3.4Å; A261-N265 VanDerWaalsContact O-CG 3.23Å; A261-N265 PolarHBondContact O-N 3.49Å; A261-N265 PolarHBondContact O-ND2 2.97Å |
| 262 | N | 93.2 | Very high | 96.6 | Very high | 82 Ų | 82 | 100.7 Ų | 100.7 | 44% | 0.439 | 51% | 0.506 | S | S | . | . | H | α-helix | trans | -64.6 | -46.6 | 174.8 | -69.9 | -17.7 | 0 | 0 | 0 | 111.6 | V258 C259 R260 E264 N265 E266 | V258-N262 VanDerWaalsContact O-CG 3.27Å; V258-N262 PolarHBondContact O-N 3.48Å; V258-N262 PolarHBondContact O-ND2 3.33Å; C259-N262 PolarHBondContact O-N 3.39Å; R260-N262 VanDerWaalsContact C-N 3.34Å; R260-N262 PolarHBondContact O-N 3.22Å; N262-E264 VanDerWaalsContact C-N 3.33Å; N262-E264 PolarHBondContact O-N 2.94Å; N262-N265 WeakPolarHBondContact O-CB 3.5Å; N262-N265 PolarHBondContact O-N 3.01Å; N262-N265 VanDerWaalsContact O-N 3.16Å; N262-E266 WeakPolarHBondContact O-CG 3.38Å; N262-E266 PolarHBondContact O-N 3.47Å |
| 263 | A | 94.2 | Very high | 96.6 | Very high | 55 Ų | 55 | 99.5 Ų | 99.5 | 46% | 0.455 | 51% | 0.506 | S | S | . | . | H | α-helix | trans | -62.7 | -36.9 | 176.9 | 0 | 0 | 0 | 0 | 0 | 112.7 | C259 R260 E266 F267 | C259-A263 WeakPolarHBondContact O-CB 3.48Å; C259-A263 PolarHBondContact O-N 2.96Å; R260-A263 PolarHBondContact O-N 2.94Å; A263-E266 PolarHBondContact O-N 3.29Å; A263-F267 WeakPolarHBondContact O-CB 3.49Å; A263-F267 PolarHBondContact O-N 3.04Å |
| 264 | E | 96 | Very high | 96.7 | Very high | 87 Ų | 87 | 95.8 Ų | 95.8 | 41% | 0.407 | 50% | 0.5 | S | S | . | . | H | α-helix | trans | -65.7 | -40.7 | 172.5 | -76 | -177.2 | 143.9 | 0 | 0 | 112.3 | R260 A261 N262 F267 V268 | R260-E264 VanDerWaalsContact CZ-CD 3.42Å; R260-E264 IonicContact CZ-OE1 2.66Å; R260-E264 IonicContact CZ-OE2 2.73Å; R260-E264 VanDerWaalsContact NH1-CD 3.31Å; R260-E264 IonicContact NH1-OE1 3.1Å; R260-E264 PolarHBondContact NH1-OE1 2.67Å; R260-E264 IonicContact NH1-OE2 2.82Å; R260-E264 IonicContact NH2-OE1 2.73Å; R260-E264 PolarHBondContact NH2-OE1 3.35Å; R260-E264 IonicContact NH2-OE2 3.85Å; R260-E264 PolarHBondContact NH2-OE2 3.5Å; R260-E264 WeakPolarHBondContact O-CG 3.4Å; R260-E264 PolarHBondContact O-N 3.47Å; A261-E264 PolarHBondContact O-N 3.35Å; N262-E264 VanDerWaalsContact C-N 3.33Å; N262-E264 PolarHBondContact O-N 2.94Å; E264-F267 PolarHBondContact O-N 3.41Å; E264-V268 WeakPolarHBondContact O-CG2 3.33Å; E264-V268 PolarHBondContact O-N 3.2Å |
| 265 | N | 96.4 | Very high | 96.8 | Very high | 107 Ų | 107 | 95.2 Ų | 95.2 | 57% | 0.572 | 50% | 0.5 | S | S | * | . | H | α-helix | trans | -64.4 | -42.8 | 175.3 | -72.9 | -38.6 | 0 | 0 | 0 | 111.8 | A261 N262 V268 A269 | A261-N265 WeakPolarHBondContact O-CB 3.4Å; A261-N265 VanDerWaalsContact O-CG 3.23Å; A261-N265 PolarHBondContact O-N 3.49Å; A261-N265 PolarHBondContact O-ND2 2.97Å; N262-N265 WeakPolarHBondContact O-CB 3.5Å; N262-N265 PolarHBondContact O-N 3.01Å; N262-N265 VanDerWaalsContact O-N 3.16Å; N265-V268 PolarHBondContact O-N 2.85Å; N265-A269 PolarHBondContact O-N 3.05Å |
| 266 | E | 97.4 | Very high | 96.9 | Very high | 140 Ų | 140 | 93.1 Ų | 93.1 | 65% | 0.654 | 50% | 0.498 | S | S | * | . | H | α-helix | trans | -62.7 | -43 | 174.3 | -73.8 | 177.1 | -172.8 | 0 | 0 | 111.7 | N262 A263 V268 A269 L270 | N262-E266 WeakPolarHBondContact O-CG 3.38Å; N262-E266 PolarHBondContact O-N 3.47Å; A263-E266 PolarHBondContact O-N 3.29Å; E266-V268 PolarHBondContact O-N 2.85Å; E266-A269 PolarHBondContact O-N 3.44Å; E266-L270 WeakPolarHBondContact O-CB 3.35Å; E266-L270 PolarHBondContact O-N 3.15Å |
| 267 | F | 97.6 | Very high | 97 | Very high | 140 Ų | 140 | 89.8 Ų | 89.8 | 61% | 0.614 | 49% | 0.493 | S | S | * | . | H | α-helix | trans | -61.8 | -41.5 | 174.9 | 177.6 | -99.2 | 0 | 0 | 0 | 112.3 | A263 E264 A269 L270 K271 | A263-F267 WeakPolarHBondContact O-CB 3.49Å; A263-F267 PolarHBondContact O-N 3.04Å; E264-F267 PolarHBondContact O-N 3.41Å; F267-A269 VanDerWaalsContact C-N 3.34Å; F267-L270 PolarHBondContact O-N 3.28Å; F267-K271 WeakPolarHBondContact O-CB 3.3Å; F267-K271 PolarHBondContact O-N 2.79Å |
| 268 | V | 98.4 | Very high | 97 | Very high | 73 Ų | 73 | 92.8 Ų | 92.8 | 44% | 0.442 | 50% | 0.5 | S | S | . | . | H | α-helix | trans | -66.9 | -34.7 | 175.4 | 169.3 | 0 | 0 | 0 | 0 | 111.9 | E264 N265 E266 K272 | E264-V268 WeakPolarHBondContact O-CG2 3.33Å; E264-V268 PolarHBondContact O-N 3.2Å; N265-V268 PolarHBondContact O-N 2.85Å; E266-V268 PolarHBondContact O-N 2.85Å; V268-K272 WeakPolarHBondContact O-CG 3.24Å; V268-K272 PolarHBondContact O-N 2.87Å |
| 269 | A | 96.5 | Very high | 97.2 | Very high | 44 Ų | 44 | 93.8 Ų | 93.8 | 36% | 0.364 | 50% | 0.501 | S | S | . | . | H | α-helix | trans | -66.9 | -51.9 | 173 | 0 | 0 | 0 | 0 | 0 | 111.1 | N265 E266 F267 K271 K272 D273 | N265-A269 PolarHBondContact O-N 3.05Å; E266-A269 PolarHBondContact O-N 3.44Å; F267-A269 VanDerWaalsContact C-N 3.34Å; A269-K271 PolarHBondContact O-N 3.34Å; A269-K272 WeakPolarHBondContact O-CA 3.47Å; A269-K272 WeakPolarHBondContact O-CB 3.25Å; A269-K272 PolarHBondContact O-N 2.93Å; A269-D273 PolarHBondContact O-N 3.32Å |
| 270 | L | 97.8 | Very high | 97.3 | Very high | 105 Ų | 105 | 94.9 Ų | 94.9 | 55% | 0.55 | 50% | 0.501 | S | S | . | . | H | α-helix | trans | -57.3 | -37.6 | 177.8 | -176.5 | 65.1 | 0 | 0 | 0 | 112 | E266 F267 D273 V274 | E266-L270 WeakPolarHBondContact O-CB 3.35Å; E266-L270 PolarHBondContact O-N 3.15Å; F267-L270 PolarHBondContact O-N 3.28Å; L270-D273 PolarHBondContact O-N 3.06Å; L270-V274 WeakPolarHBondContact O-CG2 3.38Å; L270-V274 PolarHBondContact O-N 2.69Å |
| 271 | K | 98.4 | Very high | 97.3 | Very high | 121 Ų | 121 | 93.2 Ų | 93.2 | 53% | 0.526 | 50% | 0.498 | S | S | . | . | H | α-helix | trans | -61.5 | -44.1 | 173.9 | -175.7 | 176 | 177.9 | 179.7 | 0 | 112.1 | F267 A269 D273 V274 D275 | F267-K271 WeakPolarHBondContact O-CB 3.3Å; F267-K271 PolarHBondContact O-N 2.79Å; A269-K271 PolarHBondContact O-N 3.34Å; K271-D273 VanDerWaalsContact C-N 3.31Å; K271-D273 PolarHBondContact O-N 2.94Å; K271-V274 PolarHBondContact O-N 3.47Å; K271-D275 WeakPolarHBondContact O-CB 3.43Å; K271-D275 VanDerWaalsContact O-CG 3.26Å; K271-D275 PolarHBondContact O-N 3Å |
| 272 | K | 98.5 | Very high | 97.5 | Very high | 137 Ų | 137 | 93.1 Ų | 93.1 | 60% | 0.596 | 50% | 0.495 | S | S | * | . | H | α-helix | trans | -63.1 | -38.4 | 175.8 | -68.3 | 168.5 | -177.6 | 175.8 | 0 | 111.8 | V268 A269 D275 A276 | V268-K272 WeakPolarHBondContact O-CG 3.24Å; V268-K272 PolarHBondContact O-N 2.87Å; A269-K272 WeakPolarHBondContact O-CA 3.47Å; A269-K272 WeakPolarHBondContact O-CB 3.25Å; A269-K272 PolarHBondContact O-N 2.93Å; K272-D275 PolarHBondContact O-N 3.42Å; K272-A276 VanDerWaalsContact O-CB 3.28Å; K272-A276 WeakPolarHBondContact O-CB 3.48Å; K272-A276 PolarHBondContact O-N 2.92Å |
| 273 | D | 97.8 | Very high | 97.8 | Very high | 106 Ų | 106 | 93.4 Ų | 93.4 | 57% | 0.567 | 50% | 0.496 | S | S | * | . | H | α-helix | trans | -67.1 | -38.6 | 177.3 | -63.9 | -22.7 | 0 | 0 | 0 | 111.5 | A269 L270 K271 A277 | A269-D273 PolarHBondContact O-N 3.32Å; L270-D273 PolarHBondContact O-N 3.06Å; K271-D273 VanDerWaalsContact C-N 3.31Å; K271-D273 PolarHBondContact O-N 2.94Å; D273-A277 VanDerWaalsContact O-CB 3.27Å; D273-A277 WeakPolarHBondContact O-CB 3.32Å; D273-A277 PolarHBondContact O-N 2.73Å |
| 274 | V | 98.6 | Very high | 98 | Very high | 86 Ų | 86 | 96.3 Ų | 96.3 | 52% | 0.521 | 50% | 0.504 | S | S | . | . | H | α-helix | trans | -65.2 | -46.1 | 172.3 | 169.3 | 0 | 0 | 0 | 0 | 111.5 | L270 K271 A276 A277 F278 | L270-V274 WeakPolarHBondContact O-CG2 3.38Å; L270-V274 PolarHBondContact O-N 2.69Å; K271-V274 PolarHBondContact O-N 3.47Å; V274-A276 VanDerWaalsContact C-N 3.34Å; V274-A276 PolarHBondContact O-N 2.9Å; V274-A277 PolarHBondContact O-N 2.95Å; V274-F278 WeakPolarHBondContact O-CB 3.48Å; V274-F278 PolarHBondContact O-N 3.16Å |
| 275 | D | 98.6 | Very high | 98.1 | Very high | 87 Ų | 87 | 96.7 Ų | 96.7 | 47% | 0.465 | 51% | 0.505 | S | S | . | . | H | α-helix | trans | -61.6 | -42.4 | 177.2 | -69 | -25.6 | 0 | 0 | 0 | 110.6 | K271 K272 F278 M279 | K271-D275 WeakPolarHBondContact O-CB 3.43Å; K271-D275 VanDerWaalsContact O-CG 3.26Å; K271-D275 PolarHBondContact O-N 3Å; K272-D275 PolarHBondContact O-N 3.42Å; D275-F278 PolarHBondContact O-N 3.48Å; D275-M279 WeakPolarHBondContact O-CG 3.49Å; D275-M279 PolarHBondContact O-N 3.49Å |
| 276 | A | 98.1 | Very high | 98.2 | Very high | 48 Ų | 48 | 94 Ų | 94 | 40% | 0.397 | 50% | 0.498 | S | S | . | . | H | α-helix | trans | -66.1 | -41.7 | 175.7 | 0 | 0 | 0 | 0 | 0 | 112.7 | K272 V274 F278 M279 N280 | K272-A276 VanDerWaalsContact O-CB 3.28Å; K272-A276 WeakPolarHBondContact O-CB 3.48Å; K272-A276 PolarHBondContact O-N 2.92Å; V274-A276 VanDerWaalsContact C-N 3.34Å; V274-A276 PolarHBondContact O-N 2.9Å; A276-F278 VanDerWaalsContact C-N 3.31Å; A276-F278 PolarHBondContact O-N 2.98Å; A276-M279 PolarHBondContact O-N 2.99Å; A276-N280 WeakPolarHBondContact O-CB 3.47Å; A276-N280 VanDerWaalsContact O-CG 3.27Å; A276-N280 PolarHBondContact O-N 3.46Å; A276-N280 PolarHBondContact O-ND2 2.75Å |
| 277 | A | 98.2 | Very high | 98.2 | Very high | 57 Ų | 57 | 91.5 Ų | 91.5 | 47% | 0.471 | 49% | 0.489 | S | S | . | . | H | α-helix | trans | -63.7 | -36.8 | 174.3 | 0 | 0 | 0 | 0 | 0 | 112 | D273 V274 K281 | D273-A277 VanDerWaalsContact O-CB 3.27Å; D273-A277 WeakPolarHBondContact O-CB 3.32Å; D273-A277 PolarHBondContact O-N 2.73Å; V274-A277 PolarHBondContact O-N 2.95Å; A277-K281 WeakPolarHBondContact O-CB 3.25Å; A277-K281 PolarHBondContact O-N 3.46Å |
| 278 | F | 98.6 | Very high | 98.3 | Very high | 133 Ų | 133 | 89.1 Ų | 89.1 | 58% | 0.583 | 49% | 0.486 | S | S | * | . | H | α-helix | trans | -66 | -44.7 | 174.8 | -176 | -91.1 | 0 | 0 | 0 | 112.1 | V274 D275 A276 K281 S282 | V274-F278 WeakPolarHBondContact O-CB 3.48Å; V274-F278 PolarHBondContact O-N 3.16Å; D275-F278 PolarHBondContact O-N 3.48Å; A276-F278 VanDerWaalsContact C-N 3.31Å; A276-F278 PolarHBondContact O-N 2.98Å; F278-K281 WeakPolarHBondContact O-CB 3.48Å; F278-K281 PolarHBondContact O-N 2.94Å; F278-S282 PolarHBondContact O-N 2.89Å |
| 279 | M | 98.4 | Very high | 98.3 | Very high | 104 Ų | 104 | 90.3 Ų | 90.3 | 51% | 0.512 | 49% | 0.49 | S | S | . | . | H | α-helix | trans | -60 | -51.5 | 174.9 | -69.2 | -56.6 | -54.1 | 0 | 0 | 111.4 | D275 A276 K281 S282 D283 | D275-M279 WeakPolarHBondContact O-CG 3.49Å; D275-M279 PolarHBondContact O-N 3.49Å; A276-M279 PolarHBondContact O-N 2.99Å; M279-K281 PolarHBondContact O-N 3.39Å; M279-S282 PolarHBondContact O-N 3.35Å; M279-S282 PolarHBondContact O-OG 3.09Å; M279-D283 PolarHBondContact O-N 3.01Å |
| 280 | N | 98.3 | Very high | 98.4 | Very high | 99 Ų | 99 | 91.8 Ų | 91.8 | 53% | 0.529 | 49% | 0.494 | S | S | . | . | H | α-helix | trans | -56.1 | -39.1 | 176 | -71.6 | -25.8 | 0 | 0 | 0 | 112.4 | A276 L284 | A276-N280 WeakPolarHBondContact O-CB 3.47Å; A276-N280 VanDerWaalsContact O-CG 3.27Å; A276-N280 PolarHBondContact O-N 3.46Å; A276-N280 PolarHBondContact O-ND2 2.75Å; N280-L284 WeakPolarHBondContact O-CB 3.48Å; N280-L284 VanDerWaalsContact O-CG 3.28Å; N280-L284 WeakPolarHBondContact O-CG 3.4Å; N280-L284 PolarHBondContact O-N 3.15Å |
| 281 | K | 98.6 | Very high | 98.4 | Very high | 106 Ų | 106 | 91.3 Ų | 91.3 | 46% | 0.461 | 49% | 0.492 | S | S | . | . | H | α-helix | trans | -62.8 | -47.5 | 174.5 | -171.6 | -154.3 | 169.8 | -127.2 | 0 | 110.9 | A277 F278 M279 D283 L284 E285 | A277-K281 WeakPolarHBondContact O-CB 3.25Å; A277-K281 PolarHBondContact O-N 3.46Å; F278-K281 WeakPolarHBondContact O-CB 3.48Å; F278-K281 PolarHBondContact O-N 2.94Å; M279-K281 PolarHBondContact O-N 3.39Å; K281-D283 VanDerWaalsContact C-N 3.33Å; K281-D283 PolarHBondContact O-N 3.33Å; K281-L284 PolarHBondContact O-N 3.07Å; K281-E285 VanDerWaalsContact CE-CD 3.45Å; K281-E285 WeakPolarHBondContact CE-OE1 3.47Å; K281-E285 WeakPolarHBondContact CE-OE2 3.49Å; K281-E285 IonicContact NZ-OE1 2.89Å; K281-E285 PolarHBondContact NZ-OE1 3.16Å; K281-E285 IonicContact NZ-OE2 3.23Å; K281-E285 PolarHBondContact NZ-OE2 3.48Å; K281-E285 WeakPolarHBondContact O-CG 3.25Å; K281-E285 PolarHBondContact O-N 3.32Å |
| 282 | S | 98.6 | Very high | 98.4 | Very high | 39 Ų | 39 | 88.7 Ų | 88.7 | 27% | 0.273 | 49% | 0.486 | S | S | . | . | H | α-helix | trans | -64.3 | -36 | 179.8 | 65.5 | 0 | 0 | 0 | 0 | 113 | F278 M279 E285 A286 | F278-S282 PolarHBondContact O-N 2.89Å; M279-S282 PolarHBondContact O-N 3.35Å; M279-S282 PolarHBondContact O-OG 3.09Å; S282-E285 PolarHBondContact O-N 2.91Å; S282-A286 WeakPolarHBondContact O-CB 3.43Å; S282-A286 PolarHBondContact O-N 3.49Å |
| 283 | D | 98.3 | Very high | 98.4 | Very high | 87 Ų | 87 | 88.5 Ų | 88.5 | 47% | 0.465 | 49% | 0.487 | S | S | . | . | H | α-helix | trans | -67.2 | -39.4 | 174 | -67.9 | -29.1 | 0 | 0 | 0 | 111.2 | M279 K281 A286 N287 | M279-D283 PolarHBondContact O-N 3.01Å; K281-D283 VanDerWaalsContact C-N 3.33Å; K281-D283 PolarHBondContact O-N 3.33Å; D283-A286 PolarHBondContact O-N 2.93Å; D283-N287 PolarHBondContact O-N 3.36Å; D283-N287 PolarHBondContact O-ND2 2.9Å |
| 284 | L | 98.2 | Very high | 98.4 | Very high | 117 Ų | 117 | 88.8 Ų | 88.8 | 61% | 0.613 | 49% | 0.485 | S | S | * | . | H | α-helix | trans | -67.8 | -39.5 | 174.3 | -72.7 | 170.9 | 0 | 0 | 0 | 112.4 | N280 K281 N287 V288 | N280-L284 WeakPolarHBondContact O-CB 3.48Å; N280-L284 VanDerWaalsContact O-CG 3.28Å; N280-L284 WeakPolarHBondContact O-CG 3.4Å; N280-L284 PolarHBondContact O-N 3.15Å; K281-L284 PolarHBondContact O-N 3.07Å; L284-N287 PolarHBondContact O-N 2.79Å; L284-V288 WeakPolarHBondContact O-CG2 3.32Å; L284-V288 PolarHBondContact O-N 2.9Å |
| 285 | E | 98.4 | Very high | 98.4 | Very high | 94 Ų | 94 | 88.9 Ų | 88.9 | 44% | 0.439 | 48% | 0.482 | S | S | . | . | H | α-helix | trans | -60.9 | -45.9 | 173.5 | -74.3 | 177.3 | 140.9 | 0 | 0 | 110.7 | K281 S282 N287 V288 D289 | K281-E285 VanDerWaalsContact CE-CD 3.45Å; K281-E285 WeakPolarHBondContact CE-OE1 3.47Å; K281-E285 WeakPolarHBondContact CE-OE2 3.49Å; K281-E285 IonicContact NZ-OE1 2.89Å; K281-E285 PolarHBondContact NZ-OE1 3.16Å; K281-E285 IonicContact NZ-OE2 3.23Å; K281-E285 PolarHBondContact NZ-OE2 3.48Å; K281-E285 WeakPolarHBondContact O-CG 3.25Å; K281-E285 PolarHBondContact O-N 3.32Å; S282-E285 PolarHBondContact O-N 2.91Å; E285-N287 VanDerWaalsContact C-N 3.34Å; E285-N287 PolarHBondContact O-N 2.88Å; E285-V288 PolarHBondContact O-N 3.43Å; E285-V288 VanDerWaalsContact O-N 3.15Å; E285-D289 PolarHBondContact O-N 3.23Å |
| 286 | A | 98.5 | Very high | 98.4 | Very high | 50 Ų | 50 | 88.4 Ų | 88.4 | 41% | 0.413 | 48% | 0.48 | S | S | . | . | H | α-helix | trans | -61.7 | -37.9 | 174.9 | 0 | 0 | 0 | 0 | 0 | 113.2 | S282 D283 D289 T290 | S282-A286 WeakPolarHBondContact O-CB 3.43Å; S282-A286 PolarHBondContact O-N 3.49Å; D283-A286 PolarHBondContact O-N 2.93Å; A286-D289 PolarHBondContact O-N 3.04Å; A286-T290 WeakPolarHBondContact O-CG2 3.43Å; A286-T290 PolarHBondContact O-N 3.42Å; A286-T290 PolarHBondContact O-OG1 2.82Å |
| 287 | N | 98.4 | Very high | 98.4 | Very high | 89 Ų | 89 | 92 Ų | 92 | 48% | 0.476 | 49% | 0.486 | S | S | . | . | H | α-helix | trans | -69.1 | -32 | 174.9 | -75.3 | -54 | 0 | 0 | 0 | 112.9 | D283 L284 E285 T290 L291 | D283-N287 PolarHBondContact O-N 3.36Å; D283-N287 PolarHBondContact O-ND2 2.9Å; L284-N287 PolarHBondContact O-N 2.79Å; E285-N287 VanDerWaalsContact C-N 3.34Å; E285-N287 PolarHBondContact O-N 2.88Å; N287-T290 WeakPolarHBondContact CA-OG1 3.48Å; N287-T290 PolarHBondContact O-OG1 2.95Å; N287-T290 VanDerWaalsContact O-OG1 3.06Å; N287-L291 WeakPolarHBondContact O-CB 3.35Å; N287-L291 WeakPolarHBondContact O-CD1 3.38Å; N287-L291 VanDerWaalsContact O-CG 3.24Å; N287-L291 WeakPolarHBondContact O-CG 3.47Å; N287-L291 PolarHBondContact O-N 3.33Å; N287-L291 VanDerWaalsContact O-N 3.12Å |
| 288 | V | 98.6 | Very high | 98.4 | Very high | 89 Ų | 89 | 92.2 Ų | 92.2 | 54% | 0.539 | 48% | 0.479 | S | S | . | . | H | α-helix | trans | -68.2 | -41.3 | 172 | 168.6 | 0 | 0 | 0 | 0 | 110.5 | L284 E285 T292 | L284-V288 WeakPolarHBondContact O-CG2 3.32Å; L284-V288 PolarHBondContact O-N 2.9Å; E285-V288 PolarHBondContact O-N 3.43Å; E285-V288 VanDerWaalsContact O-N 3.15Å; V288-T292 WeakPolarHBondContact O-CB 3.45Å; V288-T292 PolarHBondContact O-N 3.03Å; V288-T292 PolarHBondContact O-OG1 2.86Å |
| 289 | D | 98.4 | Very high | 98.4 | Very high | 98 Ų | 98 | 91.6 Ų | 91.6 | 52% | 0.524 | 48% | 0.476 | S | S | . | . | H | α-helix | trans | -64.9 | -41.3 | 177.4 | -75.3 | -17.2 | 0 | 0 | 0 | 112.4 | E285 A286 T292 Q293 | E285-D289 PolarHBondContact O-N 3.23Å; A286-D289 PolarHBondContact O-N 3.04Å; D289-T292 PolarHBondContact O-N 3.46Å; D289-Q293 VanDerWaalsContact O-CG 3.3Å; D289-Q293 WeakPolarHBondContact O-CG 3.36Å; D289-Q293 PolarHBondContact O-N 3.45Å; D289-Q293 PolarHBondContact O-NE2 3.02Å |
| 290 | T | 98.4 | Very high | 98.4 | Very high | 75 Ų | 75 | 90 Ų | 90 | 46% | 0.46 | 47% | 0.473 | S | S | . | . | H | α-helix | trans | -67.8 | -44.3 | 177 | 53.9 | 0 | 0 | 0 | 0 | 112.2 | A286 N287 T292 Q293 E294 | A286-T290 WeakPolarHBondContact O-CG2 3.43Å; A286-T290 PolarHBondContact O-N 3.42Å; A286-T290 PolarHBondContact O-OG1 2.82Å; N287-T290 WeakPolarHBondContact CA-OG1 3.48Å; N287-T290 PolarHBondContact O-OG1 2.95Å; N287-T290 VanDerWaalsContact O-OG1 3.06Å; T290-T292 VanDerWaalsContact C-N 3.27Å; T290-T292 PolarHBondContact O-N 2.97Å; T290-Q293 PolarHBondContact O-N 3.25Å; T290-E294 PolarHBondContact O-N 3.23Å |
| 291 | L | 98.4 | Very high | 98.4 | Very high | 96 Ų | 96 | 88.7 Ų | 88.7 | 50% | 0.503 | 47% | 0.465 | S | S | . | . | H | α-helix | trans | -62.3 | -35.4 | 174.4 | -72.9 | 170.8 | 0 | 0 | 0 | 111.9 | N287 E294 I295 | N287-L291 WeakPolarHBondContact O-CB 3.35Å; N287-L291 WeakPolarHBondContact O-CD1 3.38Å; N287-L291 VanDerWaalsContact O-CG 3.24Å; N287-L291 WeakPolarHBondContact O-CG 3.47Å; N287-L291 PolarHBondContact O-N 3.33Å; N287-L291 VanDerWaalsContact O-N 3.12Å; L291-E294 PolarHBondContact O-N 3.01Å; L291-I295 WeakPolarHBondContact O-CB 3.36Å; L291-I295 WeakPolarHBondContact O-CD1 3.46Å; L291-I295 WeakPolarHBondContact O-CG1 3.48Å; L291-I295 PolarHBondContact O-N 2.93Å |
| 292 | T | 98.4 | Very high | 98.3 | Very high | 65 Ų | 65 | 89.7 Ų | 89.7 | 40% | 0.399 | 47% | 0.467 | S | S | . | . | H | α-helix | trans | -65.8 | -43.5 | 175.2 | -58.4 | 0 | 0 | 0 | 0 | 111.1 | V288 D289 T290 I295 D296 | V288-T292 WeakPolarHBondContact O-CB 3.45Å; V288-T292 PolarHBondContact O-N 3.03Å; V288-T292 PolarHBondContact O-OG1 2.86Å; D289-T292 PolarHBondContact O-N 3.46Å; T290-T292 VanDerWaalsContact C-N 3.27Å; T290-T292 PolarHBondContact O-N 2.97Å; T292-I295 PolarHBondContact O-N 3.37Å; T292-D296 PolarHBondContact O-N 3.46Å |
| 293 | Q | 98.4 | Very high | 98.2 | Very high | 133 Ų | 133 | 92.9 Ų | 92.9 | 62% | 0.621 | 48% | 0.479 | S | S | * | . | H | α-helix | trans | -62.7 | -40.2 | 174.7 | -71.1 | 165.9 | 49.4 | 0 | 0 | 112.4 | D289 T290 D296 F297 | D289-Q293 VanDerWaalsContact O-CG 3.3Å; D289-Q293 WeakPolarHBondContact O-CG 3.36Å; D289-Q293 PolarHBondContact O-N 3.45Å; D289-Q293 PolarHBondContact O-NE2 3.02Å; T290-Q293 PolarHBondContact O-N 3.25Å; Q293-D296 PolarHBondContact O-N 3.14Å; Q293-F297 WeakPolarHBondContact O-CB 3.44Å; Q293-F297 PolarHBondContact O-N 3.28Å |
| 294 | E | 98.3 | Very high | 98.2 | Very high | 112 Ų | 112 | 93.8 Ų | 93.8 | 52% | 0.523 | 48% | 0.48 | S | S | . | . | H | α-helix | trans | -65.2 | -44.5 | 175.6 | -175.4 | 176 | -170.9 | 0 | 0 | 111.8 | T290 L291 D296 F297 L298 | T290-E294 PolarHBondContact O-N 3.23Å; L291-E294 PolarHBondContact O-N 3.01Å; E294-D296 VanDerWaalsContact C-N 3.33Å; E294-D296 PolarHBondContact O-N 2.86Å; E294-F297 PolarHBondContact O-N 2.93Å; E294-L298 HydrophobicContact CG-CD1 4.23Å; E294-L298 WeakPolarHBondContact O-CB 3.46Å; E294-L298 WeakPolarHBondContact O-CG 3.41Å; E294-L298 PolarHBondContact O-N 3.48Å |
| 295 | I | 98.1 | Very high | 98.1 | Very high | 89 Ų | 89 | 92.9 Ų | 92.9 | 46% | 0.456 | 47% | 0.473 | S | S | . | . | H | α-helix | trans | -58.7 | -44.3 | 174.9 | -75.4 | 166.5 | 0 | 0 | 0 | 111.1 | L291 T292 L298 K299 | L291-I295 WeakPolarHBondContact O-CB 3.36Å; L291-I295 WeakPolarHBondContact O-CD1 3.46Å; L291-I295 WeakPolarHBondContact O-CG1 3.48Å; L291-I295 PolarHBondContact O-N 2.93Å; T292-I295 PolarHBondContact O-N 3.37Å; I295-L298 PolarHBondContact O-N 3.29Å; I295-K299 HydrophobicContact CG2-CD 4.41Å; I295-K299 VanDerWaalsContact CG2-CE 3.42Å; I295-K299 VanDerWaalsContact O-CG 3.31Å; I295-K299 WeakPolarHBondContact O-CG 3.33Å; I295-K299 PolarHBondContact O-N 2.88Å |
| 296 | D | 98.4 | Very high | 97.9 | Very high | 77 Ų | 77 | 93 Ų | 93 | 41% | 0.412 | 48% | 0.475 | S | S | . | . | H | α-helix | trans | -72.4 | -36.5 | -179.9 | -74.3 | -17.4 | 0 | 0 | 0 | 112.3 | T292 Q293 E294 K299 T300 | T292-D296 PolarHBondContact O-N 3.46Å; Q293-D296 PolarHBondContact O-N 3.14Å; E294-D296 VanDerWaalsContact C-N 3.33Å; E294-D296 PolarHBondContact O-N 2.86Å; D296-K299 PolarHBondContact O-N 2.99Å; D296-K299 IonicContact OD1-NZ 2.77Å; D296-K299 PolarHBondContact OD1-NZ 3.49Å; D296-T300 WeakPolarHBondContact O-CG2 3.37Å; D296-T300 PolarHBondContact O-N 3.33Å; D296-T300 PolarHBondContact O-OG1 2.95Å |
| 297 | F | 98.5 | Very high | 97.7 | Very high | 123 Ų | 123 | 95.2 Ų | 95.2 | 54% | 0.539 | 48% | 0.477 | S | S | . | . | H | α-helix | trans | -57.4 | -51.4 | 169 | 171.2 | -103 | 0 | 0 | 0 | 111.4 | Q293 E294 K299 T300 L301 | Q293-F297 WeakPolarHBondContact O-CB 3.44Å; Q293-F297 PolarHBondContact O-N 3.28Å; E294-F297 PolarHBondContact O-N 2.93Å; F297-K299 VanDerWaalsContact C-N 3.34Å; F297-K299 PolarHBondContact O-N 3.3Å; F297-T300 PolarHBondContact O-N 2.94Å; F297-T300 VanDerWaalsContact O-N 3.08Å; F297-T300 PolarHBondContact O-OG1 3.3Å; F297-L301 HydrophobicContact CE1-CD1 3.89Å; F297-L301 HydrophobicContact CZ-CD1 3.73Å; F297-L301 PolarHBondContact O-N 3.48Å |
| 298 | L | 98.4 | Very high | 97.5 | Very high | 61 Ų | 61 | 96.7 Ų | 96.7 | 32% | 0.319 | 49% | 0.485 | S | S | . | . | H | α-helix | trans | -60.5 | -40.5 | 179.2 | -71.8 | 171.2 | 0 | 0 | 0 | 112.3 | E294 I295 T300 L301 Y302 | E294-L298 HydrophobicContact CG-CD1 4.23Å; E294-L298 WeakPolarHBondContact O-CB 3.46Å; E294-L298 WeakPolarHBondContact O-CG 3.41Å; E294-L298 PolarHBondContact O-N 3.48Å; I295-L298 PolarHBondContact O-N 3.29Å; L298-T300 PolarHBondContact O-N 3.38Å; L298-L301 PolarHBondContact O-N 3.01Å; L298-Y302 HydrophobicContact CB-CE2 4.21Å; L298-Y302 HydrophobicContact CD2-CE2 4.49Å; L298-Y302 WeakPolarHBondContact O-CD2 3.46Å; L298-Y302 PolarHBondContact O-N 3.27Å |
| 299 | K | 97.9 | Very high | 97.2 | Very high | 120 Ų | 120 | 96.8 Ų | 96.8 | 52% | 0.522 | 48% | 0.481 | S | S | . | . | H | α-helix | trans | -57.9 | -46.3 | 172.3 | -72.2 | 169.5 | -164.1 | 156.8 | 0 | 111.8 | I295 D296 F297 M303 | I295-K299 HydrophobicContact CG2-CD 4.41Å; I295-K299 VanDerWaalsContact CG2-CE 3.42Å; I295-K299 VanDerWaalsContact O-CG 3.31Å; I295-K299 WeakPolarHBondContact O-CG 3.33Å; I295-K299 PolarHBondContact O-N 2.88Å; D296-K299 PolarHBondContact O-N 2.99Å; D296-K299 IonicContact OD1-NZ 2.77Å; D296-K299 PolarHBondContact OD1-NZ 3.49Å; F297-K299 VanDerWaalsContact C-N 3.34Å; F297-K299 PolarHBondContact O-N 3.3Å; K299-M303 WeakPolarHBondContact O-CB 3.45Å; K299-M303 PolarHBondContact O-N 2.89Å; K299-M303 VanDerWaalsContact O-N 3.08Å |
| 300 | T | 97.9 | Very high | 96.8 | Very high | 72 Ų | 72 | 98 Ų | 98 | 44% | 0.442 | 48% | 0.484 | S | S | . | . | H | α-helix | trans | -66.4 | -42.3 | 178.9 | 56.8 | 0 | 0 | 0 | 0 | 112.1 | D296 F297 L298 M303 E304 | D296-T300 WeakPolarHBondContact O-CG2 3.37Å; D296-T300 PolarHBondContact O-N 3.33Å; D296-T300 PolarHBondContact O-OG1 2.95Å; F297-T300 PolarHBondContact O-N 2.94Å; F297-T300 VanDerWaalsContact O-N 3.08Å; F297-T300 PolarHBondContact O-OG1 3.3Å; L298-T300 PolarHBondContact O-N 3.38Å; T300-M303 PolarHBondContact O-N 2.84Å; T300-E304 WeakPolarHBondContact O-CG 3.21Å; T300-E304 PolarHBondContact O-N 3.2Å |
| 301 | L | 98.1 | Very high | 96.3 | Very high | 70 Ų | 70 | 97 Ų | 97 | 37% | 0.366 | 48% | 0.48 | S | S | . | . | H | α-helix | trans | -60 | -49.5 | 178.1 | -176.5 | 152.1 | 0 | 0 | 0 | 111.6 | F297 L298 M303 E304 E305 | F297-L301 HydrophobicContact CE1-CD1 3.89Å; F297-L301 HydrophobicContact CZ-CD1 3.73Å; F297-L301 PolarHBondContact O-N 3.48Å; L298-L301 PolarHBondContact O-N 3.01Å; L301-M303 VanDerWaalsContact C-N 3.3Å; L301-M303 PolarHBondContact O-N 3.21Å; L301-E304 PolarHBondContact O-N 3.26Å; L301-E305 WeakPolarHBondContact O-CB 3.47Å; L301-E305 PolarHBondContact O-N 2.92Å |
| 302 | Y | 97.5 | Very high | 95.7 | Very high | 128 Ų | 128 | 97.3 Ų | 97.3 | 50% | 0.502 | 48% | 0.479 | S | S | . | . | H | α-helix | trans | -66.5 | -31.7 | 178.1 | -65 | -45.3 | 0 | 0 | 0 | 112.7 | L298 I306 | L298-Y302 HydrophobicContact CB-CE2 4.21Å; L298-Y302 HydrophobicContact CD2-CE2 4.49Å; L298-Y302 WeakPolarHBondContact O-CD2 3.46Å; L298-Y302 PolarHBondContact O-N 3.27Å; Y302-I306 WeakPolarHBondContact O-CB 3.33Å; Y302-I306 WeakPolarHBondContact O-CD1 3.47Å; Y302-I306 WeakPolarHBondContact O-CG1 3.31Å; Y302-I306 PolarHBondContact O-N 3.42Å |
| 303 | M | 97.3 | Very high | 94.8 | Very high | 105 Ų | 105 | 100.4 Ų | 100.4 | 52% | 0.517 | 49% | 0.491 | S | S | . | . | H | α-helix | trans | -67.1 | -39.9 | 175.1 | -175.3 | 178.7 | 68.7 | 0 | 0 | 112.2 | K299 T300 L301 Q307 | K299-M303 WeakPolarHBondContact O-CB 3.45Å; K299-M303 PolarHBondContact O-N 2.89Å; K299-M303 VanDerWaalsContact O-N 3.08Å; T300-M303 PolarHBondContact O-N 2.84Å; L301-M303 VanDerWaalsContact C-N 3.3Å; L301-M303 PolarHBondContact O-N 3.21Å; M303-Q307 WeakPolarHBondContact O-CG 3.4Å; M303-Q307 PolarHBondContact O-N 3.48Å; M303-Q307 PolarHBondContact O-NE2 2.64Å |
| 304 | E | 96.6 | Very high | 93.7 | Very high | 107 Ų | 107 | 97.9 Ų | 97.9 | 50% | 0.5 | 49% | 0.489 | S | S | . | . | H | α-helix | trans | -71.4 | -41 | 174.2 | -67.9 | -57.3 | 129.4 | 0 | 0 | 111.9 | T300 L301 I306 Q307 L308 | T300-E304 WeakPolarHBondContact O-CG 3.21Å; T300-E304 PolarHBondContact O-N 3.2Å; L301-E304 PolarHBondContact O-N 3.26Å; E304-I306 VanDerWaalsContact C-N 3.35Å; E304-I306 PolarHBondContact O-N 3.19Å; E304-Q307 WeakPolarHBondContact O-CB 3.43Å; E304-Q307 PolarHBondContact O-N 2.89Å; E304-Q307 VanDerWaalsContact O-N 3.17Å; E304-Q307 PolarHBondContact OE1-NE2 3.26Å; E304-Q307 VanDerWaalsContact OE1-NE2 3.15Å; E304-L308 WeakPolarHBondContact O-CB 3.38Å; E304-L308 PolarHBondContact O-N 3.43Å |
| 305 | E | 96.4 | Very high | 92.2 | Very high | 98 Ų | 98 | 98.5 Ų | 98.5 | 46% | 0.458 | 49% | 0.491 | S | S | . | . | H | α-helix | trans | -61.1 | -42.3 | 176.2 | -175.3 | 174.1 | -155.9 | 0 | 0 | 111.7 | L301 Q307 L308 L309 | L301-E305 WeakPolarHBondContact O-CB 3.47Å; L301-E305 PolarHBondContact O-N 2.92Å; E305-Q307 PolarHBondContact O-N 2.91Å; E305-L308 PolarHBondContact O-N 2.84Å; E305-L309 HydrophobicContact CG-CD1 4.11Å; E305-L309 HydrophobicContact CG-CG 4.5Å; E305-L309 WeakPolarHBondContact O-CB 3.29Å; E305-L309 VanDerWaalsContact O-CG 3.29Å; E305-L309 WeakPolarHBondContact O-CG 3.5Å; E305-L309 PolarHBondContact O-N 2.92Å |
| 306 | I | 94.9 | Very high | 90.3 | Very high | 95 Ų | 95 | 98.2 Ų | 98.2 | 49% | 0.487 | 49% | 0.494 | S | S | . | . | H | α-helix | trans | -61.9 | -41.9 | 174.3 | -72.1 | 165.7 | 0 | 0 | 0 | 111.3 | Y302 E304 Q310 | Y302-I306 WeakPolarHBondContact O-CB 3.33Å; Y302-I306 WeakPolarHBondContact O-CD1 3.47Å; Y302-I306 WeakPolarHBondContact O-CG1 3.31Å; Y302-I306 PolarHBondContact O-N 3.42Å; E304-I306 VanDerWaalsContact C-N 3.35Å; E304-I306 PolarHBondContact O-N 3.19Å; I306-Q310 WeakPolarHBondContact O-CB 3.35Å; I306-Q310 VanDerWaalsContact O-CG 3.24Å; I306-Q310 WeakPolarHBondContact O-CG 3.4Å; I306-Q310 PolarHBondContact O-N 3.01Å |
| 307 | Q | 94.6 | Very high | 87.7 | Confident | 97 Ų | 97 | 99.3 Ų | 99.3 | 45% | 0.453 | 51% | 0.507 | S | S | . | . | H | α-helix | trans | -64.5 | -44.1 | 176.2 | -75.5 | 174.9 | 76.8 | 0 | 0 | 111.8 | M303 E304 E305 Q310 S311 | M303-Q307 WeakPolarHBondContact O-CG 3.4Å; M303-Q307 PolarHBondContact O-N 3.48Å; M303-Q307 PolarHBondContact O-NE2 2.64Å; E304-Q307 WeakPolarHBondContact O-CB 3.43Å; E304-Q307 PolarHBondContact O-N 2.89Å; E304-Q307 VanDerWaalsContact O-N 3.17Å; E304-Q307 PolarHBondContact OE1-NE2 3.26Å; E304-Q307 VanDerWaalsContact OE1-NE2 3.15Å; E305-Q307 PolarHBondContact O-N 2.91Å; Q307-Q310 PolarHBondContact O-N 2.84Å; Q307-S311 PolarHBondContact O-N 3.07Å |
| 308 | L | 94 | Very high | 85.4 | Confident | 121 Ų | 121 | 98.2 Ų | 98.2 | 63% | 0.634 | 51% | 0.511 | S | S | * | . | H | α-helix | trans | -65.3 | -42 | 179.2 | -171.4 | 148.4 | 0 | 0 | 0 | 111.7 | E304 E305 S311 H312 | E304-L308 WeakPolarHBondContact O-CB 3.38Å; E304-L308 PolarHBondContact O-N 3.43Å; E305-L308 PolarHBondContact O-N 2.84Å; L308-S311 PolarHBondContact O-N 3.05Å; L308-H312 WeakPolarHBondContact O-CB 3.41Å; L308-H312 PolarHBondContact O-N 2.98Å |
| 309 | L | 92.8 | Very high | 83.1 | Confident | 90 Ų | 90 | 103.1 Ų | 103.1 | 47% | 0.471 | 54% | 0.536 | S | S | . | . | H | α-helix | trans | -63.7 | -39.2 | 174 | -72.1 | 172.1 | 0 | 0 | 0 | 112 | E305 H312 I313 | E305-L309 HydrophobicContact CG-CD1 4.11Å; E305-L309 HydrophobicContact CG-CG 4.5Å; E305-L309 WeakPolarHBondContact O-CB 3.29Å; E305-L309 VanDerWaalsContact O-CG 3.29Å; E305-L309 WeakPolarHBondContact O-CG 3.5Å; E305-L309 PolarHBondContact O-N 2.92Å; L309-H312 PolarHBondContact O-N 3.22Å; L309-I313 WeakPolarHBondContact O-CB 3.42Å; L309-I313 WeakPolarHBondContact O-CD1 3.37Å; L309-I313 VanDerWaalsContact O-CG1 3.23Å; L309-I313 WeakPolarHBondContact O-CG1 3.48Å; L309-I313 PolarHBondContact O-N 3.34Å |
| 310 | Q | 89.1 | Confident | 80.5 | Confident | 125 Ų | 125 | 102 Ų | 102 | 58% | 0.584 | 54% | 0.539 | S | S | * | . | H | α-helix | trans | -63.4 | -43.3 | 173.4 | -74.6 | 173.2 | 10.7 | 0 | 0 | 111.8 | I306 Q307 S314 | I306-Q310 WeakPolarHBondContact O-CB 3.35Å; I306-Q310 VanDerWaalsContact O-CG 3.24Å; I306-Q310 WeakPolarHBondContact O-CG 3.4Å; I306-Q310 PolarHBondContact O-N 3.01Å; Q307-Q310 PolarHBondContact O-N 2.84Å; Q310-S314 PolarHBondContact O-N 2.88Å; Q310-S314 VanDerWaalsContact O-N 3.15Å |
| 311 | S | 87.9 | Confident | 78.2 | Confident | 52 Ų | 52 | 108 Ų | 108 | 36% | 0.364 | 56% | 0.558 | S | S | . | * | H | α-helix | trans | -59.4 | -50 | 173.6 | -156.8 | 0 | 0 | 0 | 0 | 110.8 | Q307 L308 I313 S314 E315 | Q307-S311 PolarHBondContact O-N 3.07Å; L308-S311 PolarHBondContact O-N 3.05Å; S311-I313 PolarHBondContact O-N 3.13Å; S311-S314 CarbonylContact O-C 3.57Å; S311-S314 WeakPolarHBondContact O-CA 3.47Å; S311-S314 WeakPolarHBondContact O-CB 3.33Å; S311-S314 PolarHBondContact O-N 3.1Å; S311-S314 PolarHBondContact O-OG 2.91Å; S311-E315 WeakPolarHBondContact O-CG 3.48Å; S311-E315 PolarHBondContact O-N 3.35Å; S311-E315 PolarHBondContact OG-OE1 2.77Å |
| 312 | H | 86.6 | Confident | 75.9 | Confident | 104 Ų | 104 | 111 Ų | 111 | 48% | 0.481 | 57% | 0.573 | S | S | . | * | H | α-helix | trans | -65.6 | -35.7 | -176.1 | -165.8 | 56 | 0 | 0 | 0 | 113.2 | L308 L309 S314 E315 T316 | L308-H312 WeakPolarHBondContact O-CB 3.41Å; L308-H312 PolarHBondContact O-N 2.98Å; L309-H312 PolarHBondContact O-N 3.22Å; H312-S314 VanDerWaalsContact C-N 3.3Å; H312-S314 PolarHBondContact O-N 3.09Å; H312-E315 PolarHBondContact O-N 2.77Å; H312-T316 PolarHBondContact CE1-OG1 3.32Å; H312-T316 PolarHBondContact ND1-OG1 3.43Å; H312-T316 WeakPolarHBondContact O-CB 3.48Å; H312-T316 PolarHBondContact O-N 2.89Å; H312-T316 PolarHBondContact O-OG1 3.26Å |
| 313 | I | 80 | Confident | 73.3 | Confident | 129 Ų | 129 | 112.7 Ų | 112.7 | 66% | 0.662 | 59% | 0.59 | S | S | * | * | H | α-helix | trans | -63.6 | -36.6 | 171.1 | -70.6 | 165.5 | 0 | 0 | 0 | 111.1 | L309 S311 | L309-I313 WeakPolarHBondContact O-CB 3.42Å; L309-I313 WeakPolarHBondContact O-CD1 3.37Å; L309-I313 VanDerWaalsContact O-CG1 3.23Å; L309-I313 WeakPolarHBondContact O-CG1 3.48Å; L309-I313 PolarHBondContact O-N 3.34Å; S311-I313 PolarHBondContact O-N 3.13Å |
| 314 | S | 74.2 | Confident | 71.1 | Confident | 81 Ų | 81 | 114.3 Ų | 114.3 | 57% | 0.566 | 60% | 0.601 | S | S | * | * | H | α-helix | trans | -75.6 | -31.8 | 176.9 | 75.5 | 0 | 0 | 0 | 0 | 113.8 | Q310 S311 H312 | Q310-S314 PolarHBondContact O-N 2.88Å; Q310-S314 VanDerWaalsContact O-N 3.15Å; S311-S314 CarbonylContact O-C 3.57Å; S311-S314 WeakPolarHBondContact O-CA 3.47Å; S311-S314 WeakPolarHBondContact O-CB 3.33Å; S311-S314 PolarHBondContact O-N 3.1Å; S311-S314 PolarHBondContact O-OG 2.91Å; H312-S314 VanDerWaalsContact C-N 3.3Å; H312-S314 PolarHBondContact O-N 3.09Å |
| 315 | E | 67.4 | Low | 68.8 | Low | 125 Ų | 125 | 114.9 Ų | 114.9 | 58% | 0.584 | 62% | 0.617 | S | S | * | * | H | α-helix | trans | -78.8 | -34.9 | 177.4 | -72.6 | 168 | -161.7 | 0 | 0 | 112.8 | S311 H312 S317 | S311-E315 WeakPolarHBondContact O-CG 3.48Å; S311-E315 PolarHBondContact O-N 3.35Å; S311-E315 PolarHBondContact OG-OE1 2.77Å; H312-E315 PolarHBondContact O-N 2.77Å; E315-S317 VanDerWaalsContact C-N 3.28Å; E315-S317 PolarHBondContact O-N 2.95Å |
| 316 | T | 58.5 | Low | 66.9 | Low | 83 Ų | 83 | 120.6 Ų | 120.6 | 51% | 0.509 | 63% | 0.634 | S | S | . | * | trans | -88.5 | 10.6 | -172.3 | -46.8 | 0 | 0 | 0 | 0 | 112.9 | H312 V318 | H312-T316 PolarHBondContact CE1-OG1 3.32Å; H312-T316 PolarHBondContact ND1-OG1 3.43Å; H312-T316 WeakPolarHBondContact O-CB 3.48Å; H312-T316 PolarHBondContact O-N 2.89Å; H312-T316 PolarHBondContact O-OG1 3.26Å; T316-V318 PolarHBondContact O-N 3.45Å | ||
| 317 | S | 43.2 | Very low | 65.6 | Low | 99 Ų | 99 | 124.7 Ų | 124.7 | 69% | 0.692 | 66% | 0.657 | S | S | * | * | trans | -75.9 | 42.5 | 176.9 | 79.7 | 0 | 0 | 0 | 0 | 113.4 | E315 | E315-S317 VanDerWaalsContact C-N 3.28Å; E315-S317 PolarHBondContact O-N 2.95Å | ||
| 318 | V | 49 | Very low | 64.1 | Low | 101 Ų | 101 | 125 Ų | 125 | 61% | 0.612 | 66% | 0.661 | S | S | * | * | trans | -111.9 | 113.3 | -177.1 | -171 | 0 | 0 | 0 | 0 | 109.8 | T316 V320 | T316-V318 PolarHBondContact O-N 3.45Å; V318-V320 HydrophobicContact CB-CG2 4.24Å; V318-V320 HydrophobicContact CG1-CG2 3.6Å; V318-V320 PolarHBondContact O-N 3.03Å | ||
| 319 | I | 50.9 | Low | 63 | Low | 164 Ų | 164 | 124.6 Ų | 124.6 | 84% | 0.841 | 66% | 0.66 | S | S | * | * | trans | -75.8 | 90.5 | 173.4 | -58.3 | 172.2 | 0 | 0 | 0 | 108.4 | ||||
| 320 | V | 43 | Very low | 62.2 | Low | 97 Ų | 97 | 125.6 Ų | 125.6 | 59% | 0.588 | 67% | 0.665 | S | S | * | * | trans | -92.4 | 112.1 | 175.8 | -175.7 | 0 | 0 | 0 | 0 | 110.2 | V318 M322 | V318-V320 HydrophobicContact CB-CG2 4.24Å; V318-V320 HydrophobicContact CG1-CG2 3.6Å; V318-V320 PolarHBondContact O-N 3.03Å; V320-M322 HydrophobicContact CG1-CB 4.44Å; V320-M322 HydrophobicContact CG1-CG 3.63Å | ||
| 321 | K | 49.3 | Very low | 61.9 | Low | 196 Ų | 196 | 125.9 Ų | 125.9 | 85% | 0.852 | 67% | 0.671 | S | S | * | * | trans | -86.6 | 125.7 | 157.1 | -68.1 | -177.3 | 178.7 | -179 | 0 | 107.8 | ||||
| 322 | M | 50.9 | Low | 61.8 | Low | 135 Ų | 135 | 125 Ų | 125 | 67% | 0.665 | 67% | 0.669 | S | S | * | * | trans | -123.2 | 109.9 | -179.8 | -99.3 | -87.3 | -179.4 | 0 | 0 | 109.1 | V320 N324 | V320-M322 HydrophobicContact CG1-CB 4.44Å; V320-M322 HydrophobicContact CG1-CG 3.63Å; M322-N324 PolarHBondContact SD-ND2 3.14Å | ||
| 323 | D | 43.7 | Very low | 61.7 | Low | 163 Ų | 163 | 123.3 Ų | 123.3 | 87% | 0.872 | 66% | 0.663 | S | S | * | * | trans | -99.8 | 104.1 | 165.2 | -75.9 | -40.8 | 0 | 0 | 0 | 108.3 | ||||
| 324 | N | 50 | Low | 62 | Low | 138 Ų | 138 | 120.9 Ų | 120.9 | 74% | 0.738 | 65% | 0.65 | S | S | * | * | trans | -101.9 | 87.3 | 178.1 | -84.6 | -61.9 | 0 | 0 | 0 | 110.5 | M322 R326 | M322-N324 PolarHBondContact SD-ND2 3.14Å; N324-R326 PolarHBondContact O-N 3.36Å | ||
| 325 | S | 48 | Very low | 62.7 | Low | 120 Ų | 120 | 119.8 Ų | 119.8 | 84% | 0.839 | 65% | 0.647 | S | S | * | * | trans | -90 | 91.6 | 171.2 | 59.3 | 0 | 0 | 0 | 0 | 111 | ||||
| 326 | R | 57.6 | Low | 63.8 | Low | 217 Ų | 217 | 119.3 Ų | 119.3 | 82% | 0.819 | 65% | 0.645 | S | S | * | * | trans | -121.3 | 134.6 | 156.4 | -82.9 | -178.6 | 158.9 | 169.2 | -5.9 | 107.3 | N324 L328 | N324-R326 PolarHBondContact O-N 3.36Å; R326-L328 PolarHBondContact O-N 2.96Å | ||
| 327 | D | 65.9 | Low | 65.4 | Low | 182 Ų | 182 | 118.3 Ų | 118.3 | 97% | 0.973 | 64% | 0.638 | S | S | * | * | trans | -62.7 | 109.3 | 167.8 | -87.2 | -39.2 | 0 | 0 | 0 | 108.2 | ||||
| 328 | L | 63.4 | Low | 67.7 | Low | 103 Ų | 103 | 119.5 Ų | 119.5 | 54% | 0.539 | 63% | 0.631 | S | S | . | * | trans | -105.3 | 146.6 | 175.2 | -74.1 | 164.1 | 0 | 0 | 0 | 106.7 | R326 L330 I333 | R326-L328 PolarHBondContact O-N 2.96Å; L328-L330 HydrophobicContact CB-CD2 4.15Å; L328-L330 PolarHBondContact O-N 3.34Å; L328-I333 HydrophobicContact CB-CD1 3.85Å; L328-I333 HydrophobicContact CD2-CD1 3.97Å; L328-I333 HydrophobicContact CG-CD1 4.36Å | ||
| 329 | D | 71 | Confident | 69.8 | Low | 112 Ų | 112 | 117.2 Ų | 117.2 | 60% | 0.599 | 62% | 0.623 | S | S | * | * | trans | -67.9 | 86.9 | 166.9 | 176.2 | 9.2 | 0 | 0 | 0 | 108.5 | D331 G332 I333 | D329-D331 VanDerWaalsContact C-N 3.27Å; D329-D331 PolarHBondContact O-N 2.91Å; D329-D331 PolarHBondContact OD1-N 3.46Å; D329-G332 PolarHBondContact O-N 2.88Å; D329-G332 PolarHBondContact OD1-N 2.96Å; D329-I333 WeakPolarHBondContact O-CB 3.32Å; D329-I333 WeakPolarHBondContact O-CD1 3.43Å; D329-I333 VanDerWaalsContact O-CG1 3.25Å; D329-I333 WeakPolarHBondContact O-CG1 3.43Å; D329-I333 PolarHBondContact O-N 2.83Å | ||
| 330 | L | 75.8 | Confident | 71.8 | Confident | 111 Ų | 111 | 114.6 Ų | 114.6 | 58% | 0.581 | 61% | 0.607 | S | S | * | * | H | α-helix | trans | -62.3 | -37.1 | -175.1 | -64.5 | -179.4 | 0 | 0 | 0 | 110.9 | L328 I334 | L328-L330 HydrophobicContact CB-CD2 4.15Å; L328-L330 PolarHBondContact O-N 3.34Å; L330-I334 HydrophobicContact CB-CD1 4.37Å; L330-I334 WeakPolarHBondContact O-CB 3.49Å; L330-I334 VanDerWaalsContact O-CD1 3.26Å; L330-I334 WeakPolarHBondContact O-CD1 3.49Å; L330-I334 WeakPolarHBondContact O-CG1 3.44Å; L330-I334 PolarHBondContact O-N 3.25Å |
| 331 | D | 82.9 | Confident | 74.3 | Confident | 132 Ų | 132 | 118.2 Ų | 118.2 | 71% | 0.706 | 61% | 0.611 | S | S | * | * | H | α-helix | trans | -72.9 | -42.7 | -177.8 | -71.7 | -36.6 | 0 | 0 | 0 | 111.6 | D329 I334 A335 | D329-D331 VanDerWaalsContact C-N 3.27Å; D329-D331 PolarHBondContact O-N 2.91Å; D329-D331 PolarHBondContact OD1-N 3.46Å; D331-I334 PolarHBondContact O-N 3.42Å; D331-A335 WeakPolarHBondContact O-CB 3.19Å; D331-A335 PolarHBondContact O-N 3.15Å |
| 332 | G | 86.6 | Confident | 76.4 | Confident | 32 Ų | 32 | 115.6 Ų | 115.6 | 33% | 0.33 | 60% | 0.602 | S | S | . | * | H | α-helix | trans | -60.5 | -47.2 | 172.6 | 0 | 0 | 0 | 0 | 0 | 112.5 | D329 A335 E336 | D329-G332 PolarHBondContact O-N 2.88Å; D329-G332 PolarHBondContact OD1-N 2.96Å; G332-A335 PolarHBondContact O-N 3.3Å; G332-E336 PolarHBondContact O-N 2.94Å |
| 333 | I | 83.9 | Confident | 78.5 | Confident | 69 Ų | 69 | 112 Ų | 112 | 35% | 0.354 | 58% | 0.584 | S | S | . | * | H | α-helix | trans | -67.5 | -40.7 | 178.4 | -66.9 | 164.6 | 0 | 0 | 0 | 111.2 | L328 D329 A335 E336 V337 | L328-I333 HydrophobicContact CB-CD1 3.85Å; L328-I333 HydrophobicContact CD2-CD1 3.97Å; L328-I333 HydrophobicContact CG-CD1 4.36Å; D329-I333 WeakPolarHBondContact O-CB 3.32Å; D329-I333 WeakPolarHBondContact O-CD1 3.43Å; D329-I333 VanDerWaalsContact O-CG1 3.25Å; D329-I333 WeakPolarHBondContact O-CG1 3.43Å; D329-I333 PolarHBondContact O-N 2.83Å; I333-A335 VanDerWaalsContact C-N 3.31Å; I333-A335 PolarHBondContact O-N 3.36Å; I333-E336 PolarHBondContact O-N 3.47Å; I333-V337 HydrophobicContact CG2-CG2 4.06Å; I333-V337 VanDerWaalsContact O-CB 3.23Å; I333-V337 WeakPolarHBondContact O-CB 3.48Å; I333-V337 WeakPolarHBondContact O-CG2 3.35Å; I333-V337 PolarHBondContact O-N 3.48Å |
| 334 | I | 86.4 | Confident | 80.9 | Confident | 78 Ų | 78 | 107.9 Ų | 107.9 | 40% | 0.4 | 56% | 0.564 | S | S | . | * | H | α-helix | trans | -63.9 | -37.9 | 175.9 | -74.3 | 164.6 | 0 | 0 | 0 | 110.6 | L330 D331 K338 | L330-I334 HydrophobicContact CB-CD1 4.37Å; L330-I334 WeakPolarHBondContact O-CB 3.49Å; L330-I334 VanDerWaalsContact O-CD1 3.26Å; L330-I334 WeakPolarHBondContact O-CD1 3.49Å; L330-I334 WeakPolarHBondContact O-CG1 3.44Å; L330-I334 PolarHBondContact O-N 3.25Å; D331-I334 PolarHBondContact O-N 3.42Å; I334-K338 HydrophobicContact CG2-CD 3.97Å; I334-K338 VanDerWaalsContact CG2-CE 3.48Å; I334-K338 VanDerWaalsContact O-CB 3.31Å; I334-K338 WeakPolarHBondContact O-CB 3.4Å; I334-K338 WeakPolarHBondContact O-CD 2.88Å; I334-K338 WeakPolarHBondContact O-CG 3.41Å; I334-K338 PolarHBondContact O-N 2.89Å |
| 335 | A | 90 | Very high | 83 | Confident | 59 Ų | 59 | 103.4 Ų | 103.4 | 49% | 0.488 | 55% | 0.546 | S | S | . | . | H | α-helix | trans | -67 | -45.9 | 175.4 | 0 | 0 | 0 | 0 | 0 | 112 | D331 G332 I333 K338 A339 | D331-A335 WeakPolarHBondContact O-CB 3.19Å; D331-A335 PolarHBondContact O-N 3.15Å; G332-A335 PolarHBondContact O-N 3.3Å; I333-A335 VanDerWaalsContact C-N 3.31Å; I333-A335 PolarHBondContact O-N 3.36Å; A335-K338 PolarHBondContact O-N 3.39Å; A335-A339 WeakPolarHBondContact O-CB 3.38Å; A335-A339 PolarHBondContact O-N 3.13Å |
| 336 | E | 90.2 | Very high | 85.3 | Confident | 115 Ų | 115 | 104 Ų | 104 | 54% | 0.537 | 53% | 0.53 | S | S | . | . | H | α-helix | trans | -63.2 | -47.1 | 176.3 | -174 | 179.4 | 179.5 | 0 | 0 | 111.6 | G332 I333 K338 A339 Q340 | G332-E336 PolarHBondContact O-N 2.94Å; I333-E336 PolarHBondContact O-N 3.47Å; E336-K338 VanDerWaalsContact C-N 3.34Å; E336-K338 PolarHBondContact O-N 2.99Å; E336-A339 PolarHBondContact O-N 3.49Å; E336-A339 VanDerWaalsContact O-N 3.16Å; E336-Q340 HydrophobicContact CG-CG 4.44Å; E336-Q340 WeakPolarHBondContact O-CG 3.49Å; E336-Q340 PolarHBondContact O-N 3.02Å; E336-Q340 PolarHBondContact OE1-NE2 2.89Å; E336-Q340 VanDerWaalsContact OE1-NE2 3.12Å |
| 337 | V | 92.1 | Very high | 87.1 | Confident | 62 Ų | 62 | 99.2 Ų | 99.2 | 38% | 0.376 | 51% | 0.512 | S | S | . | . | H | α-helix | trans | -60.5 | -42.5 | 177.6 | 168.2 | 0 | 0 | 0 | 0 | 110.8 | I333 Q340 Y341 | I333-V337 HydrophobicContact CG2-CG2 4.06Å; I333-V337 VanDerWaalsContact O-CB 3.23Å; I333-V337 WeakPolarHBondContact O-CB 3.48Å; I333-V337 WeakPolarHBondContact O-CG2 3.35Å; I333-V337 PolarHBondContact O-N 3.48Å; V337-Q340 PolarHBondContact O-N 3.45Å; V337-Y341 HydrophobicContact CG1-CD2 3.65Å; V337-Y341 HydrophobicContact CG1-CE2 3.66Å; V337-Y341 VanDerWaalsContact O-CD2 3.26Å; V337-Y341 WeakPolarHBondContact O-CD2 3.48Å; V337-Y341 PolarHBondContact O-N 3.38Å |
| 338 | K | 91.6 | Very high | 88.5 | Confident | 123 Ų | 123 | 94.2 Ų | 94.2 | 54% | 0.535 | 49% | 0.491 | S | S | . | . | H | α-helix | trans | -59.7 | -48 | 173.1 | -78.6 | 168 | -179.2 | 169.2 | 0 | 111.7 | I334 A335 E336 Q340 Y341 E342 | I334-K338 HydrophobicContact CG2-CD 3.97Å; I334-K338 VanDerWaalsContact CG2-CE 3.48Å; I334-K338 VanDerWaalsContact O-CB 3.31Å; I334-K338 WeakPolarHBondContact O-CB 3.4Å; I334-K338 WeakPolarHBondContact O-CD 2.88Å; I334-K338 WeakPolarHBondContact O-CG 3.41Å; I334-K338 PolarHBondContact O-N 2.89Å; A335-K338 PolarHBondContact O-N 3.39Å; E336-K338 VanDerWaalsContact C-N 3.34Å; E336-K338 PolarHBondContact O-N 2.99Å; K338-Q340 VanDerWaalsContact C-N 3.33Å; K338-Q340 PolarHBondContact O-N 3.31Å; K338-Y341 PolarHBondContact O-N 2.71Å; K338-E342 WeakPolarHBondContact O-CG 3.42Å; K338-E342 PolarHBondContact O-N 3.23Å |
| 339 | A | 93.3 | Very high | 90 | Very high | 54 Ų | 54 | 97 Ų | 97 | 45% | 0.446 | 50% | 0.495 | S | S | . | . | H | α-helix | trans | -61.6 | -39.9 | 178.2 | 0 | 0 | 0 | 0 | 0 | 112.2 | A335 E336 E342 E343 | A335-A339 WeakPolarHBondContact O-CB 3.38Å; A335-A339 PolarHBondContact O-N 3.13Å; E336-A339 PolarHBondContact O-N 3.49Å; E336-A339 VanDerWaalsContact O-N 3.16Å; A339-E342 PolarHBondContact O-N 3.05Å; A339-E343 VanDerWaalsContact O-CB 3.25Å; A339-E343 WeakPolarHBondContact O-CB 3.42Å; A339-E343 PolarHBondContact O-N 3.1Å |
| 340 | Q | 92.6 | Very high | 91.2 | Very high | 109 Ų | 109 | 93.7 Ų | 93.7 | 51% | 0.509 | 48% | 0.483 | S | S | . | . | H | α-helix | trans | -64.8 | -42.2 | 173.8 | -70.6 | -173.7 | 13 | 0 | 0 | 112 | E336 V337 K338 E343 V344 | E336-Q340 HydrophobicContact CG-CG 4.44Å; E336-Q340 WeakPolarHBondContact O-CG 3.49Å; E336-Q340 PolarHBondContact O-N 3.02Å; E336-Q340 PolarHBondContact OE1-NE2 2.89Å; E336-Q340 VanDerWaalsContact OE1-NE2 3.12Å; V337-Q340 PolarHBondContact O-N 3.45Å; K338-Q340 VanDerWaalsContact C-N 3.33Å; K338-Q340 PolarHBondContact O-N 3.31Å; Q340-E343 PolarHBondContact O-N 2.9Å; Q340-V344 VanDerWaalsContact O-CB 3.31Å; Q340-V344 WeakPolarHBondContact O-CB 3.33Å; Q340-V344 WeakPolarHBondContact O-CG2 3.39Å; Q340-V344 PolarHBondContact O-N 3.49Å |
| 341 | Y | 94.2 | Very high | 92.2 | Very high | 173 Ų | 173 | 93.5 Ų | 93.5 | 68% | 0.678 | 48% | 0.482 | S | S | * | . | H | α-helix | trans | -64.8 | -41.8 | 174.9 | -90.7 | -70.8 | 0 | 0 | 0 | 112.7 | V337 K338 V344 A345 | V337-Y341 HydrophobicContact CG1-CD2 3.65Å; V337-Y341 HydrophobicContact CG1-CE2 3.66Å; V337-Y341 VanDerWaalsContact O-CD2 3.26Å; V337-Y341 WeakPolarHBondContact O-CD2 3.48Å; V337-Y341 PolarHBondContact O-N 3.38Å; K338-Y341 PolarHBondContact O-N 2.71Å; Y341-V344 PolarHBondContact O-N 3.11Å; Y341-A345 VanDerWaalsContact O-CB 3.23Å; Y341-A345 WeakPolarHBondContact O-CB 3.42Å; Y341-A345 PolarHBondContact O-N 3.48Å |
| 342 | E | 94.3 | Very high | 92.8 | Very high | 141 Ų | 141 | 89.1 Ų | 89.1 | 66% | 0.659 | 47% | 0.465 | S | S | * | . | H | α-helix | trans | -63.5 | -44 | 176.3 | -75.2 | 177.6 | -170.5 | 0 | 0 | 111.4 | K338 A339 A345 R346 | K338-E342 WeakPolarHBondContact O-CG 3.42Å; K338-E342 PolarHBondContact O-N 3.23Å; A339-E342 PolarHBondContact O-N 3.05Å; E342-A345 PolarHBondContact O-N 3.43Å; E342-R346 VanDerWaalsContact O-CB 3.29Å; E342-R346 WeakPolarHBondContact O-CB 3.49Å; E342-R346 PolarHBondContact O-N 3.12Å |
| 343 | E | 95.2 | Very high | 93.2 | Very high | 59 Ų | 59 | 93.8 Ų | 93.8 | 28% | 0.276 | 48% | 0.478 | S | S | . | . | H | α-helix | trans | -68.7 | -38.6 | 177.2 | 170.7 | 59.2 | -166.2 | 0 | 0 | 112.7 | A339 Q340 R346 R347 | A339-E343 VanDerWaalsContact O-CB 3.25Å; A339-E343 WeakPolarHBondContact O-CB 3.42Å; A339-E343 PolarHBondContact O-N 3.1Å; Q340-E343 PolarHBondContact O-N 2.9Å; E343-R346 PolarHBondContact O-N 2.92Å; E343-R346 IonicContact OE1-CZ 3.36Å; E343-R346 IonicContact OE1-NH2 2.79Å; E343-R346 PolarHBondContact OE1-NH2 3Å; E343-R346 IonicContact OE2-CZ 3.77Å; E343-R346 IonicContact OE2-NE 2.71Å; E343-R346 PolarHBondContact OE2-NE 3.32Å; E343-R346 IonicContact OE2-NH2 2.61Å; E343-R346 PolarHBondContact OE2-NH2 2.89Å; E343-R347 WeakPolarHBondContact O-CB 3.4Å; E343-R347 PolarHBondContact O-N 3.48Å; E343-R347 IonicContact OE1-CZ 2.65Å; E343-R347 IonicContact OE1-NE 2.63Å; E343-R347 PolarHBondContact OE1-NE 3Å; E343-R347 IonicContact OE1-NH2 3.46Å; E343-R347 PolarHBondContact OE1-NH2 3.39Å |
| 344 | V | 94 | Very high | 93.8 | Very high | 77 Ų | 77 | 93 Ų | 93 | 47% | 0.467 | 48% | 0.482 | S | S | . | . | H | α-helix | trans | -65.9 | -42 | 172.7 | 167 | 0 | 0 | 0 | 0 | 111 | Q340 Y341 R346 R347 S348 | Q340-V344 VanDerWaalsContact O-CB 3.31Å; Q340-V344 WeakPolarHBondContact O-CB 3.33Å; Q340-V344 WeakPolarHBondContact O-CG2 3.39Å; Q340-V344 PolarHBondContact O-N 3.49Å; Y341-V344 PolarHBondContact O-N 3.11Å; V344-R346 VanDerWaalsContact C-N 3.33Å; V344-R346 PolarHBondContact O-N 3.36Å; V344-R347 PolarHBondContact O-N 2.94Å; V344-S348 VanDerWaalsContact O-CB 3.3Å; V344-S348 WeakPolarHBondContact O-CB 3.24Å; V344-S348 PolarHBondContact O-N 2.88Å |
| 345 | A | 94.1 | Very high | 94.3 | Very high | 43 Ų | 43 | 96.3 Ų | 96.3 | 36% | 0.355 | 49% | 0.489 | S | S | . | . | H | α-helix | trans | -66.9 | -34.4 | 175.1 | 0 | 0 | 0 | 0 | 0 | 112.2 | Y341 E342 R349 | Y341-A345 VanDerWaalsContact O-CB 3.23Å; Y341-A345 WeakPolarHBondContact O-CB 3.42Å; Y341-A345 PolarHBondContact O-N 3.48Å; E342-A345 PolarHBondContact O-N 3.43Å; A345-R349 PolarHBondContact O-N 3.41Å; A345-R349 VanDerWaalsContact O-N 3.12Å |
| 346 | R | 95.8 | Very high | 94.6 | Very high | 133 Ų | 133 | 101.1 Ų | 101.1 | 50% | 0.502 | 50% | 0.496 | S | S | . | . | H | α-helix | trans | -67.1 | -47.5 | 173.8 | -170.1 | -167.4 | 66.9 | 73.9 | 3.1 | 111.2 | E342 E343 V344 R349 A350 | E342-R346 VanDerWaalsContact O-CB 3.29Å; E342-R346 WeakPolarHBondContact O-CB 3.49Å; E342-R346 PolarHBondContact O-N 3.12Å; E343-R346 PolarHBondContact O-N 2.92Å; E343-R346 IonicContact OE1-CZ 3.36Å; E343-R346 IonicContact OE1-NH2 2.79Å; E343-R346 PolarHBondContact OE1-NH2 3Å; E343-R346 IonicContact OE2-CZ 3.77Å; E343-R346 IonicContact OE2-NE 2.71Å; E343-R346 PolarHBondContact OE2-NE 3.32Å; E343-R346 IonicContact OE2-NH2 2.61Å; E343-R346 PolarHBondContact OE2-NH2 2.89Å; V344-R346 VanDerWaalsContact C-N 3.33Å; V344-R346 PolarHBondContact O-N 3.36Å; R346-R349 PolarHBondContact O-N 2.93Å; R346-A350 PolarHBondContact O-N 3.23Å |
| 347 | R | 95.6 | Very high | 94.9 | Very high | 117 Ų | 117 | 100.5 Ų | 100.5 | 44% | 0.442 | 49% | 0.493 | S | S | . | . | H | α-helix | trans | -60.1 | -49.4 | 173.8 | -84.3 | -173.4 | -108.1 | 125.4 | -13.5 | 111.7 | E343 V344 R349 A350 D351 | E343-R347 WeakPolarHBondContact O-CB 3.4Å; E343-R347 PolarHBondContact O-N 3.48Å; E343-R347 IonicContact OE1-CZ 2.65Å; E343-R347 IonicContact OE1-NE 2.63Å; E343-R347 PolarHBondContact OE1-NE 3Å; E343-R347 IonicContact OE1-NH2 3.46Å; E343-R347 PolarHBondContact OE1-NH2 3.39Å; V344-R347 PolarHBondContact O-N 2.94Å; R347-R349 VanDerWaalsContact C-N 3.26Å; R347-R349 PolarHBondContact O-N 2.8Å; R347-A350 CarbonylContact O-C 3.54Å; R347-A350 WeakPolarHBondContact O-CA 3.38Å; R347-A350 PolarHBondContact O-N 3.03Å; R347-D351 WeakPolarHBondContact O-CB 3.48Å; R347-D351 PolarHBondContact O-N 3.1Å |
| 348 | S | 95.6 | Very high | 95.2 | Very high | 77 Ų | 77 | 100.8 Ų | 100.8 | 54% | 0.538 | 50% | 0.495 | S | S | . | . | H | α-helix | trans | -58.1 | -34.6 | 178.6 | 178.7 | 0 | 0 | 0 | 0 | 113.5 | V344 A352 | V344-S348 VanDerWaalsContact O-CB 3.3Å; V344-S348 WeakPolarHBondContact O-CB 3.24Å; V344-S348 PolarHBondContact O-N 2.88Å; S348-A352 VanDerWaalsContact O-CB 3.28Å; S348-A352 WeakPolarHBondContact O-CB 3.43Å; S348-A352 PolarHBondContact O-N 2.92Å; S348-A352 VanDerWaalsContact O-N 3.15Å |
| 349 | R | 95.6 | Very high | 95.4 | Very high | 162 Ų | 162 | 98.9 Ų | 98.9 | 61% | 0.611 | 49% | 0.487 | S | S | * | . | H | α-helix | trans | -67.7 | -49.7 | 169.3 | -74.7 | -166.1 | -165.9 | 92 | -2.6 | 112.3 | A345 R346 R347 D351 A352 E353 | A345-R349 PolarHBondContact O-N 3.41Å; A345-R349 VanDerWaalsContact O-N 3.12Å; R346-R349 PolarHBondContact O-N 2.93Å; R347-R349 VanDerWaalsContact C-N 3.26Å; R347-R349 PolarHBondContact O-N 2.8Å; R349-D351 VanDerWaalsContact C-N 3.32Å; R349-D351 PolarHBondContact O-N 3.43Å; R349-A352 PolarHBondContact O-N 2.9Å; R349-E353 WeakPolarHBondContact O-CB 3.12Å; R349-E353 WeakPolarHBondContact O-CG 3.45Å; R349-E353 PolarHBondContact O-N 3.38Å |
| 350 | A | 95.8 | Very high | 95.6 | Very high | 42 Ų | 42 | 102.7 Ų | 102.7 | 35% | 0.347 | 49% | 0.491 | S | S | . | . | H | α-helix | trans | -60.5 | -40.7 | -179.3 | 0 | 0 | 0 | 0 | 0 | 112.3 | R346 R347 E353 A354 | R346-A350 PolarHBondContact O-N 3.23Å; R347-A350 CarbonylContact O-C 3.54Å; R347-A350 WeakPolarHBondContact O-CA 3.38Å; R347-A350 PolarHBondContact O-N 3.03Å; A350-E353 PolarHBondContact O-N 2.9Å; A350-A354 VanDerWaalsContact O-CB 3.24Å; A350-A354 WeakPolarHBondContact O-CB 3.45Å; A350-A354 PolarHBondContact O-N 3.46Å |
| 351 | D | 95.6 | Very high | 95.8 | Very high | 106 Ų | 106 | 101.9 Ų | 101.9 | 57% | 0.567 | 49% | 0.487 | S | S | * | . | H | α-helix | trans | -66.5 | -40.5 | 176.9 | -61.2 | -27.9 | 0 | 0 | 0 | 111 | R347 R349 W355 | R347-D351 WeakPolarHBondContact O-CB 3.48Å; R347-D351 PolarHBondContact O-N 3.1Å; R349-D351 VanDerWaalsContact C-N 3.32Å; R349-D351 PolarHBondContact O-N 3.43Å; D351-W355 VanDerWaalsContact O-CB 3.24Å; D351-W355 WeakPolarHBondContact O-CB 3.26Å; D351-W355 PolarHBondContact O-N 3.39Å |
| 352 | A | 95.6 | Very high | 95.9 | Very high | 41 Ų | 41 | 98 Ų | 98 | 34% | 0.339 | 48% | 0.475 | S | S | . | . | H | α-helix | trans | -67.5 | -44.4 | 174.8 | 0 | 0 | 0 | 0 | 0 | 112.2 | S348 R349 W355 Y356 | S348-A352 VanDerWaalsContact O-CB 3.28Å; S348-A352 WeakPolarHBondContact O-CB 3.43Å; S348-A352 PolarHBondContact O-N 2.92Å; S348-A352 VanDerWaalsContact O-N 3.15Å; R349-A352 PolarHBondContact O-N 2.9Å; A352-W355 PolarHBondContact O-N 3.25Å; A352-Y356 WeakPolarHBondContact O-CD2 3.43Å; A352-Y356 PolarHBondContact O-N 3.45Å |
| 353 | E | 96.1 | Very high | 95.9 | Very high | 129 Ų | 129 | 97.2 Ų | 97.2 | 60% | 0.603 | 47% | 0.473 | S | S | * | . | H | α-helix | trans | -61.6 | -45.3 | 176.1 | -74.8 | 169.1 | -165.1 | 0 | 0 | 111.2 | R349 A350 Y356 Q357 | R349-E353 WeakPolarHBondContact O-CB 3.12Å; R349-E353 WeakPolarHBondContact O-CG 3.45Å; R349-E353 PolarHBondContact O-N 3.38Å; A350-E353 PolarHBondContact O-N 2.9Å; E353-Y356 PolarHBondContact O-N 3.13Å; E353-Q357 WeakPolarHBondContact O-CB 3.42Å; E353-Q357 PolarHBondContact O-N 3.28Å |
| 354 | A | 96 | Very high | 96 | Very high | 53 Ų | 53 | 100.1 Ų | 100.1 | 44% | 0.438 | 49% | 0.486 | S | S | . | . | H | α-helix | trans | -61.5 | -44.4 | 174 | 0 | 0 | 0 | 0 | 0 | 111.8 | A350 Y356 Q357 T358 | A350-A354 VanDerWaalsContact O-CB 3.24Å; A350-A354 WeakPolarHBondContact O-CB 3.45Å; A350-A354 PolarHBondContact O-N 3.46Å; A354-Y356 PolarHBondContact O-N 2.95Å; A354-Q357 PolarHBondContact O-N 2.99Å; A354-T358 PolarHBondContact O-N 3.47Å; A354-T358 PolarHBondContact O-OG1 2.92Å |
| 355 | W | 96.6 | Very high | 96.1 | Very high | 148 Ų | 148 | 100.4 Ų | 100.4 | 56% | 0.561 | 49% | 0.488 | S | S | * | . | H | α-helix | trans | -61.7 | -44.2 | 177.1 | -174.4 | 92.1 | 0 | 0 | 0 | 112.3 | D351 A352 K359 | D351-W355 VanDerWaalsContact O-CB 3.24Å; D351-W355 WeakPolarHBondContact O-CB 3.26Å; D351-W355 PolarHBondContact O-N 3.39Å; A352-W355 PolarHBondContact O-N 3.25Å; W355-K359 HydrophobicContact CD2-CG 4.08Å; W355-K359 HydrophobicContact CE3-CG 4.19Å; W355-K359 HydrophobicContact CH2-CG 4.08Å; W355-K359 HydrophobicContact CZ2-CD 4.32Å; W355-K359 HydrophobicContact CZ2-CG 3.97Å; W355-K359 HydrophobicContact CZ3-CG 4.19Å; W355-K359 WeakPolarHBondContact O-CB 3.17Å; W355-K359 VanDerWaalsContact O-CG 3.31Å; W355-K359 WeakPolarHBondContact O-CG 3.39Å; W355-K359 PolarHBondContact O-N 3.08Å |
| 356 | Y | 96.9 | Very high | 96.2 | Very high | 159 Ų | 159 | 101.2 Ų | 101.2 | 62% | 0.624 | 49% | 0.488 | S | S | * | . | H | α-helix | trans | -64.7 | -39.6 | 174.8 | -77.5 | -60.5 | 0 | 0 | 0 | 112.1 | A352 E353 A354 K359 Y360 | A352-Y356 WeakPolarHBondContact O-CD2 3.43Å; A352-Y356 PolarHBondContact O-N 3.45Å; E353-Y356 PolarHBondContact O-N 3.13Å; A354-Y356 PolarHBondContact O-N 2.95Å; Y356-K359 PolarHBondContact O-N 2.88Å; Y356-Y360 WeakPolarHBondContact O-CB 3.34Å; Y356-Y360 PolarHBondContact O-N 3.33Å |
| 357 | Q | 97 | Very high | 96.2 | Very high | 102 Ų | 102 | 97.2 Ų | 97.2 | 48% | 0.477 | 48% | 0.484 | S | S | . | . | H | α-helix | trans | -62.8 | -49.3 | 176.7 | -175.5 | 62.3 | 25.6 | 0 | 0 | 111.2 | E353 A354 K359 Y360 E361 | E353-Q357 WeakPolarHBondContact O-CB 3.42Å; E353-Q357 PolarHBondContact O-N 3.28Å; A354-Q357 PolarHBondContact O-N 2.99Å; Q357-K359 VanDerWaalsContact C-N 3.34Å; Q357-K359 PolarHBondContact O-N 3.06Å; Q357-Y360 PolarHBondContact O-N 2.73Å; Q357-E361 PolarHBondContact NE2-OE1 2.95Å; Q357-E361 WeakPolarHBondContact O-CG 3.49Å; Q357-E361 PolarHBondContact O-N 3.32Å |
| 358 | T | 97.2 | Very high | 96.2 | Very high | 69 Ų | 69 | 93.1 Ų | 93.1 | 42% | 0.423 | 48% | 0.478 | S | S | . | . | H | α-helix | trans | -59.5 | -43.4 | 175.5 | -58.2 | 0 | 0 | 0 | 0 | 111.7 | A354 Y360 E361 E362 | A354-T358 PolarHBondContact O-N 3.47Å; A354-T358 PolarHBondContact O-OG1 2.92Å; T358-Y360 VanDerWaalsContact C-N 3.33Å; T358-Y360 PolarHBondContact O-N 2.84Å; T358-E361 PolarHBondContact O-N 3.47Å; T358-E362 HydrophobicContact CG2-CG 4.45Å; T358-E362 WeakPolarHBondContact O-CB 3.38Å; T358-E362 WeakPolarHBondContact O-CG 3.44Å; T358-E362 PolarHBondContact O-N 3.33Å |
| 359 | K | 97 | Very high | 96.2 | Very high | 82 Ų | 82 | 94.5 Ų | 94.5 | 36% | 0.357 | 48% | 0.476 | S | S | . | . | H | α-helix | trans | -66.9 | -33.4 | 178.1 | -72.7 | -73.6 | 163.2 | -121.7 | 0 | 113.1 | W355 Y356 Q357 E362 M363 | W355-K359 HydrophobicContact CD2-CG 4.08Å; W355-K359 HydrophobicContact CE3-CG 4.19Å; W355-K359 HydrophobicContact CH2-CG 4.08Å; W355-K359 HydrophobicContact CZ2-CD 4.32Å; W355-K359 HydrophobicContact CZ2-CG 3.97Å; W355-K359 HydrophobicContact CZ3-CG 4.19Å; W355-K359 WeakPolarHBondContact O-CB 3.17Å; W355-K359 VanDerWaalsContact O-CG 3.31Å; W355-K359 WeakPolarHBondContact O-CG 3.39Å; W355-K359 PolarHBondContact O-N 3.08Å; Y356-K359 PolarHBondContact O-N 2.88Å; Q357-K359 VanDerWaalsContact C-N 3.34Å; Q357-K359 PolarHBondContact O-N 3.06Å; K359-E362 IonicContact NZ-OE1 3.39Å; K359-E362 PolarHBondContact NZ-OE1 2.66Å; K359-E362 IonicContact NZ-OE2 3.84Å; K359-E362 PolarHBondContact NZ-OE2 3.13Å; K359-M363 WeakPolarHBondContact O-CB 3.39Å; K359-M363 PolarHBondContact O-N 2.98Å; K359-M363 VanDerWaalsContact O-N 3.12Å |
| 360 | Y | 96.4 | Very high | 96.3 | Very high | 135 Ų | 135 | 92.5 Ų | 92.5 | 53% | 0.529 | 47% | 0.474 | S | S | . | . | H | α-helix | trans | -67.7 | -44.6 | 172.9 | -177.7 | -93.1 | 0 | 0 | 0 | 111.5 | Y356 Q357 T358 M363 Q364 | Y356-Y360 WeakPolarHBondContact O-CB 3.34Å; Y356-Y360 PolarHBondContact O-N 3.33Å; Q357-Y360 PolarHBondContact O-N 2.73Å; T358-Y360 VanDerWaalsContact C-N 3.33Å; T358-Y360 PolarHBondContact O-N 2.84Å; Y360-M363 PolarHBondContact O-N 3.41Å; Y360-Q364 WeakPolarHBondContact O-CB 3.38Å; Y360-Q364 PolarHBondContact O-N 2.81Å |
| 361 | E | 96.7 | Very high | 96.3 | Very high | 91 Ų | 91 | 94.4 Ų | 94.4 | 43% | 0.425 | 48% | 0.483 | S | S | . | . | H | α-helix | trans | -64.1 | -45 | 177 | -72.6 | 171.3 | -172.9 | 0 | 0 | 112.2 | Q357 T358 M363 Q364 V365 | Q357-E361 PolarHBondContact NE2-OE1 2.95Å; Q357-E361 WeakPolarHBondContact O-CG 3.49Å; Q357-E361 PolarHBondContact O-N 3.32Å; T358-E361 PolarHBondContact O-N 3.47Å; E361-M363 VanDerWaalsContact C-N 3.33Å; E361-M363 PolarHBondContact O-N 2.9Å; E361-Q364 PolarHBondContact O-N 2.91Å; E361-V365 WeakPolarHBondContact O-CB 3.47Å; E361-V365 WeakPolarHBondContact O-CG2 3.49Å; E361-V365 PolarHBondContact O-N 2.71Å |
| 362 | E | 96.1 | Very high | 96.4 | Very high | 92 Ų | 92 | 93.6 Ų | 93.6 | 43% | 0.43 | 48% | 0.479 | S | S | . | . | H | α-helix | trans | -55.8 | -46.1 | 172.5 | -76.9 | 175.2 | -159.2 | 0 | 0 | 111.8 | T358 K359 V365 T366 | T358-E362 HydrophobicContact CG2-CG 4.45Å; T358-E362 WeakPolarHBondContact O-CB 3.38Å; T358-E362 WeakPolarHBondContact O-CG 3.44Å; T358-E362 PolarHBondContact O-N 3.33Å; K359-E362 IonicContact NZ-OE1 3.39Å; K359-E362 PolarHBondContact NZ-OE1 2.66Å; K359-E362 IonicContact NZ-OE2 3.84Å; K359-E362 PolarHBondContact NZ-OE2 3.13Å; E362-V365 PolarHBondContact O-N 2.97Å; E362-T366 WeakPolarHBondContact O-CB 3.46Å; E362-T366 WeakPolarHBondContact O-CG2 3.31Å; E362-T366 PolarHBondContact O-N 2.99Å; E362-T366 PolarHBondContact O-OG1 3.37Å |
| 363 | M | 95.4 | Very high | 96.5 | Very high | 125 Ų | 125 | 96.1 Ų | 96.1 | 62% | 0.616 | 49% | 0.487 | S | S | * | . | H | α-helix | trans | -68.3 | -35.6 | 178.8 | -173.8 | 159.5 | 54.2 | 0 | 0 | 112.1 | K359 Y360 E361 T366 A367 | K359-M363 WeakPolarHBondContact O-CB 3.39Å; K359-M363 PolarHBondContact O-N 2.98Å; K359-M363 VanDerWaalsContact O-N 3.12Å; Y360-M363 PolarHBondContact O-N 3.41Å; E361-M363 VanDerWaalsContact C-N 3.33Å; E361-M363 PolarHBondContact O-N 2.9Å; M363-T366 WeakPolarHBondContact CA-OG1 3.49Å; M363-T366 PolarHBondContact O-OG1 2.86Å; M363-A367 WeakPolarHBondContact O-CB 3.42Å; M363-A367 PolarHBondContact O-N 3Å |
| 364 | Q | 95.9 | Very high | 96.5 | Very high | 119 Ų | 119 | 95.9 Ų | 95.9 | 56% | 0.556 | 49% | 0.489 | S | S | * | . | H | α-helix | trans | -67.2 | -43.4 | 174.8 | -172 | 176.4 | 12.7 | 0 | 0 | 111.8 | Y360 E361 G368 | Y360-Q364 WeakPolarHBondContact O-CB 3.38Å; Y360-Q364 PolarHBondContact O-N 2.81Å; E361-Q364 PolarHBondContact O-N 2.91Å; Q364-G368 PolarHBondContact O-N 3.3Å |
| 365 | V | 96.9 | Very high | 96.6 | Very high | 84 Ų | 84 | 101 Ų | 101 | 51% | 0.509 | 50% | 0.497 | S | S | . | . | H | α-helix | trans | -66.2 | -46.5 | 178.4 | 169.6 | 0 | 0 | 0 | 0 | 111 | E361 E362 G368 Q369 | E361-V365 WeakPolarHBondContact O-CB 3.47Å; E361-V365 WeakPolarHBondContact O-CG2 3.49Å; E361-V365 PolarHBondContact O-N 2.71Å; E362-V365 PolarHBondContact O-N 2.97Å; V365-G368 PolarHBondContact O-N 3.36Å; V365-Q369 HydrophobicContact CG1-CG 4.48Å; V365-Q369 WeakPolarHBondContact O-CG 3.48Å; V365-Q369 PolarHBondContact O-N 2.89Å |
| 366 | T | 95.6 | Very high | 96.6 | Very high | 59 Ų | 59 | 98.3 Ų | 98.3 | 36% | 0.362 | 49% | 0.493 | S | S | . | . | H | α-helix | trans | -64.8 | -40.7 | 177.5 | 48.3 | 0 | 0 | 0 | 0 | 112.3 | E362 M363 G368 Q369 H370 | E362-T366 WeakPolarHBondContact O-CB 3.46Å; E362-T366 WeakPolarHBondContact O-CG2 3.31Å; E362-T366 PolarHBondContact O-N 2.99Å; E362-T366 PolarHBondContact O-OG1 3.37Å; M363-T366 WeakPolarHBondContact CA-OG1 3.49Å; M363-T366 PolarHBondContact O-OG1 2.86Å; T366-G368 VanDerWaalsContact C-N 3.31Å; T366-G368 PolarHBondContact O-N 3.25Å; T366-Q369 PolarHBondContact O-N 3Å; T366-H370 PolarHBondContact O-CD2 3.08Å; T366-H370 PolarHBondContact O-N 3.07Å |
| 367 | A | 95.6 | Very high | 96.6 | Very high | 50 Ų | 50 | 93.8 Ų | 93.8 | 41% | 0.413 | 48% | 0.483 | S | S | . | . | H | α-helix | trans | -61.3 | -37.7 | 172 | 0 | 0 | 0 | 0 | 0 | 112.7 | M363 C371 | M363-A367 WeakPolarHBondContact O-CB 3.42Å; M363-A367 PolarHBondContact O-N 3Å; A367-C371 PolarHBondContact O-N 2.93Å; A367-C371 PolarHBondContact O-SG 3.01Å |
| 368 | G | 96.6 | Very high | 96.7 | Very high | 31 Ų | 31 | 97.5 Ų | 97.5 | 32% | 0.32 | 49% | 0.492 | S | S | . | . | H | α-helix | trans | -61.7 | -51.9 | 171.7 | 0 | 0 | 0 | 0 | 0 | 112.2 | Q364 V365 T366 H370 C371 D372 | Q364-G368 PolarHBondContact O-N 3.3Å; V365-G368 PolarHBondContact O-N 3.36Å; T366-G368 VanDerWaalsContact C-N 3.31Å; T366-G368 PolarHBondContact O-N 3.25Å; G368-H370 VanDerWaalsContact C-N 3.32Å; G368-H370 PolarHBondContact O-N 3.26Å; G368-C371 WeakPolarHBondContact O-CB 3.27Å; G368-C371 PolarHBondContact O-N 3.46Å; G368-C371 VanDerWaalsContact O-N 3.07Å; G368-D372 PolarHBondContact O-N 3.34Å |
| 369 | Q | 96.5 | Very high | 96.6 | Very high | 105 Ų | 105 | 97.5 Ų | 97.5 | 49% | 0.491 | 49% | 0.49 | S | S | . | . | H | α-helix | trans | -57.6 | -41.6 | 176.9 | -70.5 | 171.6 | -0.9 | 0 | 0 | 112.3 | V365 T366 D372 N373 | V365-Q369 HydrophobicContact CG1-CG 4.48Å; V365-Q369 WeakPolarHBondContact O-CG 3.48Å; V365-Q369 PolarHBondContact O-N 2.89Å; T366-Q369 PolarHBondContact O-N 3Å; Q369-D372 PolarHBondContact O-N 3.32Å; Q369-N373 WeakPolarHBondContact O-CB 3.32Å; Q369-N373 PolarHBondContact O-N 2.98Å; Q369-N373 PolarHBondContact O-ND2 2.9Å; Q369-N373 VanDerWaalsContact O-ND2 3.15Å |
| 370 | H | 96.2 | Very high | 96.6 | Very high | 121 Ų | 121 | 99.1 Ų | 99.1 | 56% | 0.56 | 50% | 0.499 | S | S | * | . | H | α-helix | trans | -64.2 | -41.8 | 174.5 | -69 | -47.5 | 0 | 0 | 0 | 112.2 | T366 G368 N373 L374 | T366-H370 PolarHBondContact O-CD2 3.08Å; T366-H370 PolarHBondContact O-N 3.07Å; G368-H370 VanDerWaalsContact C-N 3.32Å; G368-H370 PolarHBondContact O-N 3.26Å; H370-N373 PolarHBondContact O-N 2.96Å; H370-L374 WeakPolarHBondContact O-CB 3.45Å; H370-L374 VanDerWaalsContact O-CG 3.29Å; H370-L374 WeakPolarHBondContact O-CG 3.34Å; H370-L374 PolarHBondContact O-N 3.44Å |
| 371 | C | 96.6 | Very high | 96.7 | Very high | 82 Ų | 82 | 97.6 Ų | 97.6 | 55% | 0.554 | 50% | 0.498 | S | S | * | . | H | α-helix | trans | -60.8 | -44.3 | 173.7 | -69.7 | 0 | 0 | 0 | 0 | 112.4 | A367 G368 L374 R375 | A367-C371 PolarHBondContact O-N 2.93Å; A367-C371 PolarHBondContact O-SG 3.01Å; G368-C371 WeakPolarHBondContact O-CB 3.27Å; G368-C371 PolarHBondContact O-N 3.46Å; G368-C371 VanDerWaalsContact O-N 3.07Å; C371-L374 PolarHBondContact O-N 2.69Å; C371-R375 WeakPolarHBondContact O-CB 3.32Å; C371-R375 PolarHBondContact O-N 3.34Å |
| 372 | D | 96.8 | Very high | 96.7 | Very high | 88 Ų | 88 | 96.2 Ų | 96.2 | 47% | 0.471 | 49% | 0.494 | S | S | . | . | H | α-helix | trans | -68.8 | -39.4 | 179.4 | -75.4 | -33.9 | 0 | 0 | 0 | 112.1 | G368 Q369 L374 R375 N376 | G368-D372 PolarHBondContact O-N 3.34Å; Q369-D372 PolarHBondContact O-N 3.32Å; D372-L374 PolarHBondContact O-N 3.45Å; D372-R375 CarbonylContact O-C 3.56Å; D372-R375 WeakPolarHBondContact O-CB 3.31Å; D372-R375 PolarHBondContact O-N 3.02Å; D372-R375 VanDerWaalsContact O-N 3.13Å; D372-N376 WeakPolarHBondContact O-CB 3.46Å; D372-N376 PolarHBondContact O-N 2.96Å; D372-N376 PolarHBondContact O-ND2 2.85Å |
| 373 | N | 97.3 | Very high | 96.8 | Very high | 95 Ų | 95 | 97.9 Ų | 97.9 | 51% | 0.508 | 50% | 0.502 | S | S | . | . | H | α-helix | trans | -62.1 | -41 | 173.3 | -73.4 | -28 | 0 | 0 | 0 | 112.2 | Q369 H370 R375 N376 T377 | Q369-N373 WeakPolarHBondContact O-CB 3.32Å; Q369-N373 PolarHBondContact O-N 2.98Å; Q369-N373 PolarHBondContact O-ND2 2.9Å; Q369-N373 VanDerWaalsContact O-ND2 3.15Å; H370-N373 PolarHBondContact O-N 2.96Å; N373-R375 VanDerWaalsContact C-N 3.31Å; N373-R375 PolarHBondContact O-N 2.89Å; N373-N376 PolarHBondContact O-N 3.47Å; N373-T377 WeakPolarHBondContact O-CG2 3.45Å; N373-T377 PolarHBondContact O-N 3.28Å; N373-T377 PolarHBondContact O-OG1 3.11Å |
| 374 | L | 97.3 | Very high | 96.9 | Very high | 123 Ų | 123 | 96.1 Ų | 96.1 | 64% | 0.644 | 50% | 0.495 | S | S | * | . | H | α-helix | trans | -65.9 | -32.9 | 173 | -71.4 | 172 | 0 | 0 | 0 | 112.5 | H370 C371 D372 T377 R378 | H370-L374 WeakPolarHBondContact O-CB 3.45Å; H370-L374 VanDerWaalsContact O-CG 3.29Å; H370-L374 WeakPolarHBondContact O-CG 3.34Å; H370-L374 PolarHBondContact O-N 3.44Å; C371-L374 PolarHBondContact O-N 2.69Å; D372-L374 PolarHBondContact O-N 3.45Å; L374-T377 WeakPolarHBondContact CA-OG1 3.44Å; L374-T377 PolarHBondContact O-OG1 3.04Å; L374-R378 VanDerWaalsContact O-CB 3.23Å; L374-R378 WeakPolarHBondContact O-CB 3.35Å; L374-R378 PolarHBondContact O-N 3.13Å; L374-R378 VanDerWaalsContact O-N 3.14Å |
| 375 | R | 97.6 | Very high | 97 | Very high | 160 Ų | 160 | 93.4 Ų | 93.4 | 60% | 0.604 | 49% | 0.486 | S | S | * | . | H | α-helix | trans | -71.1 | -41.3 | 174.3 | -172.4 | 179.2 | -178.4 | -177.4 | -0.8 | 112 | C371 D372 N373 R378 N379 | C371-R375 WeakPolarHBondContact O-CB 3.32Å; C371-R375 PolarHBondContact O-N 3.34Å; D372-R375 CarbonylContact O-C 3.56Å; D372-R375 WeakPolarHBondContact O-CB 3.31Å; D372-R375 PolarHBondContact O-N 3.02Å; D372-R375 VanDerWaalsContact O-N 3.13Å; N373-R375 VanDerWaalsContact C-N 3.31Å; N373-R375 PolarHBondContact O-N 2.89Å; R375-R378 PolarHBondContact O-N 2.94Å; R375-N379 PolarHBondContact O-N 3.47Å; R375-N379 PolarHBondContact O-ND2 3.26Å |
| 376 | N | 97.3 | Very high | 97 | Very high | 92 Ų | 92 | 96.3 Ų | 96.3 | 49% | 0.492 | 49% | 0.488 | S | S | . | . | H | α-helix | trans | -66.8 | -50.3 | 179.8 | -69.6 | -20.1 | 0 | 0 | 0 | 111.3 | D372 N373 R378 N379 E380 | D372-N376 WeakPolarHBondContact O-CB 3.46Å; D372-N376 PolarHBondContact O-N 2.96Å; D372-N376 PolarHBondContact O-ND2 2.85Å; N373-N376 PolarHBondContact O-N 3.47Å; N376-R378 VanDerWaalsContact C-N 3.3Å; N376-R378 PolarHBondContact O-N 3.39Å; N376-N379 WeakPolarHBondContact O-CA 3.5Å; N376-N379 WeakPolarHBondContact O-CB 3.37Å; N376-N379 PolarHBondContact O-N 3.41Å; N376-E380 PolarHBondContact O-N 3.28Å |
| 377 | T | 96.6 | Very high | 97.1 | Very high | 65 Ų | 65 | 96.8 Ų | 96.8 | 40% | 0.399 | 49% | 0.488 | S | S | . | . | H | α-helix | trans | -58.7 | -39.5 | 173.8 | 49.8 | 0 | 0 | 0 | 0 | 112.1 | N373 L374 N379 E380 I381 | N373-T377 WeakPolarHBondContact O-CG2 3.45Å; N373-T377 PolarHBondContact O-N 3.28Å; N373-T377 PolarHBondContact O-OG1 3.11Å; L374-T377 WeakPolarHBondContact CA-OG1 3.44Å; L374-T377 PolarHBondContact O-OG1 3.04Å; T377-N379 VanDerWaalsContact C-N 3.35Å; T377-N379 PolarHBondContact O-N 2.89Å; T377-E380 PolarHBondContact O-N 3.48Å; T377-I381 WeakPolarHBondContact O-CB 3.36Å; T377-I381 WeakPolarHBondContact O-CD1 3.43Å; T377-I381 VanDerWaalsContact O-CG1 3.24Å; T377-I381 WeakPolarHBondContact O-CG1 3.42Å; T377-I381 PolarHBondContact O-N 3.24Å |
| 378 | R | 98.1 | Very high | 97.2 | Very high | 179 Ų | 179 | 98.6 Ų | 98.6 | 68% | 0.675 | 49% | 0.49 | S | S | * | . | H | α-helix | trans | -61.8 | -39.1 | 171.8 | 179.4 | 175.9 | 179.2 | 164 | 1.4 | 112.7 | L374 R375 N376 N382 | L374-R378 VanDerWaalsContact O-CB 3.23Å; L374-R378 WeakPolarHBondContact O-CB 3.35Å; L374-R378 PolarHBondContact O-N 3.13Å; L374-R378 VanDerWaalsContact O-N 3.14Å; R375-R378 PolarHBondContact O-N 2.94Å; N376-R378 VanDerWaalsContact C-N 3.3Å; N376-R378 PolarHBondContact O-N 3.39Å; R378-N382 VanDerWaalsContact O-CG 3.29Å; R378-N382 PolarHBondContact O-N 3.37Å; R378-N382 VanDerWaalsContact O-N 3.15Å; R378-N382 PolarHBondContact O-ND2 2.86Å |
| 379 | N | 96.7 | Very high | 97.2 | Very high | 70 Ų | 70 | 103 Ų | 103 | 37% | 0.374 | 50% | 0.502 | S | S | . | . | H | α-helix | trans | -66.4 | -46 | 177 | -69.2 | -23.3 | 0 | 0 | 0 | 111.2 | R375 N376 T377 I381 N382 E383 | R375-N379 PolarHBondContact O-N 3.47Å; R375-N379 PolarHBondContact O-ND2 3.26Å; N376-N379 WeakPolarHBondContact O-CA 3.5Å; N376-N379 WeakPolarHBondContact O-CB 3.37Å; N376-N379 PolarHBondContact O-N 3.41Å; T377-N379 VanDerWaalsContact C-N 3.35Å; T377-N379 PolarHBondContact O-N 2.89Å; N379-I381 PolarHBondContact O-N 3.48Å; N379-N382 WeakPolarHBondContact O-CA 3.29Å; N379-N382 WeakPolarHBondContact O-CB 3.14Å; N379-N382 PolarHBondContact O-N 2.94Å; N379-E383 PolarHBondContact O-N 3.36Å |
| 380 | E | 97.4 | Very high | 97.2 | Very high | 115 Ų | 115 | 105.1 Ų | 105.1 | 54% | 0.537 | 51% | 0.506 | S | S | . | . | H | α-helix | trans | -57.8 | -47 | 175.5 | -175.6 | 179.6 | -169.6 | 0 | 0 | 111.8 | N376 T377 N382 E383 L384 | N376-E380 PolarHBondContact O-N 3.28Å; T377-E380 PolarHBondContact O-N 3.48Å; E380-N382 VanDerWaalsContact C-N 3.26Å; E380-N382 PolarHBondContact O-N 2.98Å; E380-E383 PolarHBondContact O-N 3.3Å; E380-L384 HydrophobicContact CG-CD1 4.13Å; E380-L384 HydrophobicContact CG-CG 4.44Å; E380-L384 WeakPolarHBondContact O-CB 3.29Å; E380-L384 WeakPolarHBondContact O-CG 3.45Å; E380-L384 PolarHBondContact O-N 2.93Å |
| 381 | I | 97.3 | Very high | 97.2 | Very high | 103 Ų | 103 | 103.3 Ų | 103.3 | 53% | 0.528 | 50% | 0.5 | S | S | . | . | H | α-helix | trans | -56.4 | -40.5 | 173.9 | -70.4 | 164 | 0 | 0 | 0 | 111.4 | T377 N379 T385 | T377-I381 WeakPolarHBondContact O-CB 3.36Å; T377-I381 WeakPolarHBondContact O-CD1 3.43Å; T377-I381 VanDerWaalsContact O-CG1 3.24Å; T377-I381 WeakPolarHBondContact O-CG1 3.42Å; T377-I381 PolarHBondContact O-N 3.24Å; N379-I381 PolarHBondContact O-N 3.48Å; I381-T385 VanDerWaalsContact O-CB 3.25Å; I381-T385 WeakPolarHBondContact O-CB 3.38Å; I381-T385 PolarHBondContact O-N 3.4Å; I381-T385 PolarHBondContact O-OG1 3.18Å |
| 382 | N | 97.5 | Very high | 97.2 | Very high | 62 Ų | 62 | 105.8 Ų | 105.8 | 33% | 0.332 | 50% | 0.501 | S | S | . | . | H | α-helix | trans | -69 | -35.2 | 176.5 | -70.2 | -49.6 | 0 | 0 | 0 | 112.6 | R378 N379 E380 R386 | R378-N382 VanDerWaalsContact O-CG 3.29Å; R378-N382 PolarHBondContact O-N 3.37Å; R378-N382 VanDerWaalsContact O-N 3.15Å; R378-N382 PolarHBondContact O-ND2 2.86Å; N379-N382 WeakPolarHBondContact O-CA 3.29Å; N379-N382 WeakPolarHBondContact O-CB 3.14Å; N379-N382 PolarHBondContact O-N 2.94Å; E380-N382 VanDerWaalsContact C-N 3.26Å; E380-N382 PolarHBondContact O-N 2.98Å; N382-R386 VanDerWaalsContact O-CG 3.3Å; N382-R386 WeakPolarHBondContact O-CG 3.47Å; N382-R386 PolarHBondContact O-N 2.91Å |
| 383 | E | 97.5 | Very high | 97.1 | Very high | 127 Ų | 127 | 104.6 Ų | 104.6 | 59% | 0.593 | 50% | 0.503 | S | S | * | . | H | α-helix | trans | -70.9 | -46.2 | 177 | -72.7 | 177.9 | -170.9 | 0 | 0 | 112 | N379 E380 T385 R386 L387 | N379-E383 PolarHBondContact O-N 3.36Å; E380-E383 PolarHBondContact O-N 3.3Å; E383-T385 VanDerWaalsContact C-N 3.29Å; E383-T385 PolarHBondContact O-N 3.37Å; E383-R386 PolarHBondContact O-N 2.83Å; E383-R386 VanDerWaalsContact O-N 3.15Å; E383-L387 PolarHBondContact O-N 2.91Å |
| 384 | L | 97.1 | Very high | 97.1 | Very high | 89 Ų | 89 | 105.2 Ų | 105.2 | 47% | 0.466 | 50% | 0.503 | S | S | . | . | H | α-helix | trans | -58.7 | -41.7 | 171.4 | -67.7 | 175.2 | 0 | 0 | 0 | 111 | E380 R386 L387 I388 | E380-L384 HydrophobicContact CG-CD1 4.13Å; E380-L384 HydrophobicContact CG-CG 4.44Å; E380-L384 WeakPolarHBondContact O-CB 3.29Å; E380-L384 WeakPolarHBondContact O-CG 3.45Å; E380-L384 PolarHBondContact O-N 2.93Å; L384-R386 PolarHBondContact O-N 3.09Å; L384-L387 PolarHBondContact O-N 3.45Å; L384-I388 WeakPolarHBondContact O-CB 3.37Å; L384-I388 VanDerWaalsContact O-CG1 3.25Å; L384-I388 WeakPolarHBondContact O-CG1 3.46Å; L384-I388 PolarHBondContact O-N 3.27Å |
| 385 | T | 97.8 | Very high | 97.1 | Very high | 62 Ų | 62 | 103.4 Ų | 103.4 | 38% | 0.38 | 49% | 0.493 | S | S | . | . | H | α-helix | trans | -60.8 | -42.7 | 175.1 | -62 | 0 | 0 | 0 | 0 | 111.9 | I381 E383 I388 Q389 | I381-T385 VanDerWaalsContact O-CB 3.25Å; I381-T385 WeakPolarHBondContact O-CB 3.38Å; I381-T385 PolarHBondContact O-N 3.4Å; I381-T385 PolarHBondContact O-OG1 3.18Å; E383-T385 VanDerWaalsContact C-N 3.29Å; E383-T385 PolarHBondContact O-N 3.37Å; T385-I388 PolarHBondContact O-N 3.04Å; T385-Q389 WeakPolarHBondContact O-CG 3.39Å; T385-Q389 PolarHBondContact O-N 2.94Å |
| 386 | R | 97.9 | Very high | 97.1 | Very high | 144 Ų | 144 | 100.9 Ų | 100.9 | 54% | 0.543 | 49% | 0.489 | S | S | . | . | H | α-helix | trans | -67.1 | -35.8 | 174.9 | -72 | 174.2 | -170.1 | 115.7 | -4.6 | 112.6 | N382 E383 L384 Q389 R390 | N382-R386 VanDerWaalsContact O-CG 3.3Å; N382-R386 WeakPolarHBondContact O-CG 3.47Å; N382-R386 PolarHBondContact O-N 2.91Å; E383-R386 PolarHBondContact O-N 2.83Å; E383-R386 VanDerWaalsContact O-N 3.15Å; L384-R386 PolarHBondContact O-N 3.09Å; R386-Q389 PolarHBondContact O-N 3.48Å; R386-R390 WeakPolarHBondContact O-CG 3.42Å; R386-R390 PolarHBondContact O-N 3.4Å; R386-R390 VanDerWaalsContact O-N 3.07Å |
| 387 | L | 97.8 | Very high | 97.1 | Very high | 70 Ų | 70 | 101 Ų | 101 | 37% | 0.366 | 49% | 0.486 | S | S | . | . | H | α-helix | trans | -66 | -46.9 | 174.7 | -178 | 61.6 | 0 | 0 | 0 | 110.9 | E383 L384 Q389 R390 L391 | E383-L387 PolarHBondContact O-N 2.91Å; L384-L387 PolarHBondContact O-N 3.45Å; L387-Q389 VanDerWaalsContact C-N 3.29Å; L387-Q389 PolarHBondContact O-N 3.13Å; L387-R390 PolarHBondContact O-N 3.38Å; L387-R390 VanDerWaalsContact O-N 3.15Å; L387-L391 HydrophobicContact CD1-CD1 4.16Å; L387-L391 HydrophobicContact CD1-CG 4.24Å; L387-L391 HydrophobicContact CG-CD1 3.93Å; L387-L391 HydrophobicContact CG-CG 4.43Å; L387-L391 WeakPolarHBondContact O-CG 3.29Å; L387-L391 PolarHBondContact O-N 2.98Å |
| 388 | I | 97.4 | Very high | 96.9 | Very high | 87 Ų | 87 | 101.7 Ų | 101.7 | 45% | 0.446 | 49% | 0.49 | S | S | . | . | H | α-helix | trans | -57.4 | -41.4 | 174.8 | -69.7 | 163.6 | 0 | 0 | 0 | 111.1 | L384 T385 K392 | L384-I388 WeakPolarHBondContact O-CB 3.37Å; L384-I388 VanDerWaalsContact O-CG1 3.25Å; L384-I388 WeakPolarHBondContact O-CG1 3.46Å; L384-I388 PolarHBondContact O-N 3.27Å; T385-I388 PolarHBondContact O-N 3.04Å; I388-K392 HydrophobicContact CG2-CD 4.01Å; I388-K392 WeakPolarHBondContact O-CB 3.37Å; I388-K392 VanDerWaalsContact O-CG 3.24Å; I388-K392 WeakPolarHBondContact O-CG 3.33Å; I388-K392 PolarHBondContact O-N 3.38Å |
| 389 | Q | 96.8 | Very high | 96.8 | Very high | 125 Ų | 125 | 98.5 Ų | 98.5 | 58% | 0.584 | 48% | 0.481 | S | S | * | . | H | α-helix | trans | -64.8 | -42 | 176.2 | -75.7 | 175.2 | -12.4 | 0 | 0 | 112.7 | T385 R386 L387 A393 | T385-Q389 WeakPolarHBondContact O-CG 3.39Å; T385-Q389 PolarHBondContact O-N 2.94Å; R386-Q389 PolarHBondContact O-N 3.48Å; L387-Q389 VanDerWaalsContact C-N 3.29Å; L387-Q389 PolarHBondContact O-N 3.13Å; Q389-A393 PolarHBondContact O-N 3.44Å; Q389-A393 VanDerWaalsContact O-N 3.09Å |
| 390 | R | 97.4 | Very high | 96.8 | Very high | 148 Ų | 148 | 98.1 Ų | 98.1 | 56% | 0.558 | 49% | 0.488 | S | S | * | . | H | α-helix | trans | -63.7 | -51.1 | 175.3 | -75.4 | -174.7 | -70.6 | 157 | -4.2 | 112 | R386 L387 K392 A393 E394 | R386-R390 WeakPolarHBondContact O-CG 3.42Å; R386-R390 PolarHBondContact O-N 3.4Å; R386-R390 VanDerWaalsContact O-N 3.07Å; L387-R390 PolarHBondContact O-N 3.38Å; L387-R390 VanDerWaalsContact O-N 3.15Å; R390-K392 VanDerWaalsContact C-N 3.29Å; R390-K392 PolarHBondContact O-N 2.88Å; R390-A393 WeakPolarHBondContact O-CA 3.4Å; R390-A393 WeakPolarHBondContact O-CB 3.41Å; R390-A393 PolarHBondContact O-N 3.12Å; R390-E394 PolarHBondContact O-N 3.42Å |
| 391 | L | 95.1 | Very high | 96.8 | Very high | 83 Ų | 83 | 97.3 Ų | 97.3 | 44% | 0.435 | 48% | 0.484 | S | S | . | . | H | α-helix | trans | -60 | -38.7 | 178.7 | -68.2 | 171.3 | 0 | 0 | 0 | 111.8 | L387 E394 I395 | L387-L391 HydrophobicContact CD1-CD1 4.16Å; L387-L391 HydrophobicContact CD1-CG 4.24Å; L387-L391 HydrophobicContact CG-CD1 3.93Å; L387-L391 HydrophobicContact CG-CG 4.43Å; L387-L391 WeakPolarHBondContact O-CG 3.29Å; L387-L391 PolarHBondContact O-N 2.98Å; L391-E394 PolarHBondContact O-N 2.72Å; L391-I395 WeakPolarHBondContact O-CB 3.38Å; L391-I395 WeakPolarHBondContact O-CD1 3.37Å; L391-I395 VanDerWaalsContact O-CG1 3.25Å; L391-I395 WeakPolarHBondContact O-CG1 3.38Å; L391-I395 PolarHBondContact O-N 2.88Å |
| 392 | K | 96.4 | Very high | 96.5 | Very high | 134 Ų | 134 | 100.4 Ų | 100.4 | 58% | 0.583 | 49% | 0.489 | S | S | * | . | H | α-helix | trans | -61.4 | -43 | 171.9 | -78.1 | 175.1 | 178.2 | -179.3 | 0 | 112.3 | I388 R390 I395 E396 | I388-K392 HydrophobicContact CG2-CD 4.01Å; I388-K392 WeakPolarHBondContact O-CB 3.37Å; I388-K392 VanDerWaalsContact O-CG 3.24Å; I388-K392 WeakPolarHBondContact O-CG 3.33Å; I388-K392 PolarHBondContact O-N 3.38Å; R390-K392 VanDerWaalsContact C-N 3.29Å; R390-K392 PolarHBondContact O-N 2.88Å; K392-I395 PolarHBondContact O-N 3.21Å; K392-E396 WeakPolarHBondContact O-CG 3.42Å; K392-E396 PolarHBondContact O-N 3.37Å |
| 393 | A | 96 | Very high | 96.5 | Very high | 63 Ų | 63 | 100 Ų | 100 | 52% | 0.521 | 49% | 0.494 | S | S | . | . | H | α-helix | trans | -66.2 | -36.6 | 176.9 | 0 | 0 | 0 | 0 | 0 | 112.5 | Q389 R390 E396 H397 | Q389-A393 PolarHBondContact O-N 3.44Å; Q389-A393 VanDerWaalsContact O-N 3.09Å; R390-A393 WeakPolarHBondContact O-CA 3.4Å; R390-A393 WeakPolarHBondContact O-CB 3.41Å; R390-A393 PolarHBondContact O-N 3.12Å; A393-E396 PolarHBondContact O-N 3.17Å; A393-H397 WeakPolarHBondContact O-CB 3.38Å; A393-H397 PolarHBondContact O-N 3.49Å |
| 394 | E | 97.2 | Very high | 96.5 | Very high | 109 Ų | 109 | 101.7 Ų | 101.7 | 51% | 0.509 | 50% | 0.499 | S | S | . | . | H | α-helix | trans | -67.4 | -40.4 | 174 | -71.5 | 165.6 | -156.3 | 0 | 0 | 112 | R390 L391 H397 T398 | R390-E394 PolarHBondContact O-N 3.42Å; L391-E394 PolarHBondContact O-N 2.72Å; E394-H397 PolarHBondContact O-N 3.31Å; E394-T398 WeakPolarHBondContact O-CG2 3.4Å; E394-T398 PolarHBondContact O-N 2.93Å; E394-T398 PolarHBondContact O-OG1 3.45Å |
| 395 | I | 96.5 | Very high | 96.3 | Very high | 85 Ų | 85 | 102.9 Ų | 102.9 | 44% | 0.436 | 51% | 0.506 | S | S | . | . | H | α-helix | trans | -60.8 | -47.3 | 172.2 | -71.6 | 163.8 | 0 | 0 | 0 | 111.1 | L391 K392 H397 T398 K399 | L391-I395 WeakPolarHBondContact O-CB 3.38Å; L391-I395 WeakPolarHBondContact O-CD1 3.37Å; L391-I395 VanDerWaalsContact O-CG1 3.25Å; L391-I395 WeakPolarHBondContact O-CG1 3.38Å; L391-I395 PolarHBondContact O-N 2.88Å; K392-I395 PolarHBondContact O-N 3.21Å; I395-H397 VanDerWaalsContact C-N 3.32Å; I395-H397 PolarHBondContact O-N 3.48Å; I395-T398 WeakPolarHBondContact CA-OG1 3.33Å; I395-T398 PolarHBondContact O-N 2.93Å; I395-T398 PolarHBondContact O-OG1 3.22Å; I395-K399 HydrophobicContact CG2-CD 4.13Å; I395-K399 WeakPolarHBondContact O-CB 3.49Å; I395-K399 VanDerWaalsContact O-CG 3.25Å; I395-K399 WeakPolarHBondContact O-CG 3.09Å; I395-K399 PolarHBondContact O-N 3.48Å |
| 396 | E | 97.4 | Very high | 96.2 | Very high | 107 Ų | 107 | 104.4 Ų | 104.4 | 50% | 0.5 | 51% | 0.508 | S | S | . | . | H | α-helix | trans | -68.2 | -32.4 | 177.2 | -64.1 | -48.8 | 127.5 | 0 | 0 | 112.3 | K392 A393 K399 A400 | K392-E396 WeakPolarHBondContact O-CG 3.42Å; K392-E396 PolarHBondContact O-N 3.37Å; A393-E396 PolarHBondContact O-N 3.17Å; E396-K399 IonicContact OE1-NZ 2.85Å; E396-K399 PolarHBondContact OE1-NZ 2.95Å; E396-K399 IonicContact OE2-NZ 2.76Å; E396-A400 WeakPolarHBondContact O-CB 3.15Å; E396-A400 PolarHBondContact O-N 2.92Å |
| 397 | H | 97 | Very high | 96.1 | Very high | 95 Ų | 95 | 100.5 Ų | 100.5 | 44% | 0.44 | 51% | 0.507 | S | S | . | . | H | α-helix | trans | -65.4 | -47.5 | 174 | -170.2 | 59.6 | 0 | 0 | 0 | 112.4 | A393 E394 I395 A400 Q401 | A393-H397 WeakPolarHBondContact O-CB 3.38Å; A393-H397 PolarHBondContact O-N 3.49Å; E394-H397 PolarHBondContact O-N 3.31Å; I395-H397 VanDerWaalsContact C-N 3.32Å; I395-H397 PolarHBondContact O-N 3.48Å; H397-A400 PolarHBondContact O-N 3.25Å; H397-Q401 PolarHBondContact CD2-NE2 3.48Å; H397-Q401 PolarHBondContact NE2-NE2 3.34Å; H397-Q401 WeakPolarHBondContact O-CG 3.45Å; H397-Q401 PolarHBondContact O-N 2.74Å |
| 398 | T | 92.6 | Very high | 96 | Very high | 78 Ų | 78 | 100 Ų | 100 | 48% | 0.479 | 51% | 0.513 | S | S | . | . | H | α-helix | trans | -66.9 | -38.9 | 178.5 | 51.3 | 0 | 0 | 0 | 0 | 111.9 | E394 I395 A400 Q401 R402 | E394-T398 WeakPolarHBondContact O-CG2 3.4Å; E394-T398 PolarHBondContact O-N 2.93Å; E394-T398 PolarHBondContact O-OG1 3.45Å; I395-T398 WeakPolarHBondContact CA-OG1 3.33Å; I395-T398 PolarHBondContact O-N 2.93Å; I395-T398 PolarHBondContact O-OG1 3.22Å; T398-A400 PolarHBondContact O-N 2.91Å; T398-Q401 PolarHBondContact O-N 3.39Å; T398-R402 WeakPolarHBondContact O-CB 3.4Å; T398-R402 PolarHBondContact O-N 3.11Å |
| 399 | K | 97.2 | Very high | 95.9 | Very high | 113 Ų | 113 | 99.6 Ų | 99.6 | 49% | 0.491 | 51% | 0.514 | S | S | . | . | H | α-helix | trans | -57.1 | -46.5 | 169.1 | -74.3 | 171.8 | 179.9 | 174.4 | 0 | 112.3 | I395 E396 Q401 R402 A403 | I395-K399 HydrophobicContact CG2-CD 4.13Å; I395-K399 WeakPolarHBondContact O-CB 3.49Å; I395-K399 VanDerWaalsContact O-CG 3.25Å; I395-K399 WeakPolarHBondContact O-CG 3.09Å; I395-K399 PolarHBondContact O-N 3.48Å; E396-K399 IonicContact OE1-NZ 2.85Å; E396-K399 PolarHBondContact OE1-NZ 2.95Å; E396-K399 IonicContact OE2-NZ 2.76Å; K399-Q401 VanDerWaalsContact C-N 3.35Å; K399-Q401 PolarHBondContact O-N 3.32Å; K399-R402 PolarHBondContact O-N 2.85Å; K399-A403 PolarHBondContact O-N 2.91Å |
| 400 | A | 96.3 | Very high | 95.9 | Very high | 62 Ų | 62 | 95.9 Ų | 95.9 | 51% | 0.512 | 51% | 0.505 | S | S | . | . | H | α-helix | trans | -65.6 | -36.2 | 178.1 | 0 | 0 | 0 | 0 | 0 | 112.6 | E396 H397 T398 K404 | E396-A400 WeakPolarHBondContact O-CB 3.15Å; E396-A400 PolarHBondContact O-N 2.92Å; H397-A400 PolarHBondContact O-N 3.25Å; T398-A400 PolarHBondContact O-N 2.91Å; A400-K404 WeakPolarHBondContact O-CB 3.48Å; A400-K404 PolarHBondContact O-N 3.19Å; A400-K404 VanDerWaalsContact O-N 3.14Å |
| 401 | Q | 96.1 | Very high | 95.9 | Very high | 98 Ų | 98 | 93.3 Ų | 93.3 | 46% | 0.458 | 50% | 0.5 | S | S | . | . | H | α-helix | trans | -64.1 | -46.6 | 171.6 | -72 | -175.2 | 2 | 0 | 0 | 111.6 | H397 T398 K399 K404 L405 | H397-Q401 PolarHBondContact CD2-NE2 3.48Å; H397-Q401 PolarHBondContact NE2-NE2 3.34Å; H397-Q401 WeakPolarHBondContact O-CG 3.45Å; H397-Q401 PolarHBondContact O-N 2.74Å; T398-Q401 PolarHBondContact O-N 3.39Å; K399-Q401 VanDerWaalsContact C-N 3.35Å; K399-Q401 PolarHBondContact O-N 3.32Å; Q401-K404 WeakPolarHBondContact O-CB 3.23Å; Q401-K404 PolarHBondContact O-N 3.01Å; Q401-L405 WeakPolarHBondContact O-CG 3.44Å; Q401-L405 PolarHBondContact O-N 2.94Å |
| 402 | R | 92.4 | Very high | 95.7 | Very high | 167 Ų | 167 | 92.5 Ų | 92.5 | 63% | 0.63 | 50% | 0.504 | S | S | * | . | H | α-helix | trans | -57 | -52.6 | 176.9 | 177.2 | -177.5 | 164 | -178 | -4.6 | 111.2 | T398 K399 K404 L405 E406 | T398-R402 WeakPolarHBondContact O-CB 3.4Å; T398-R402 PolarHBondContact O-N 3.11Å; K399-R402 PolarHBondContact O-N 2.85Å; R402-K404 PolarHBondContact O-N 3.4Å; R402-L405 PolarHBondContact O-N 3.4Å; R402-E406 HydrophobicContact CG-CG 4.31Å; R402-E406 IonicContact CZ-OE1 3.39Å; R402-E406 IonicContact NE-OE1 3.45Å; R402-E406 PolarHBondContact NE-OE1 2.87Å; R402-E406 IonicContact NE-OE2 3.2Å; R402-E406 IonicContact NH2-OE1 2.69Å; R402-E406 PolarHBondContact NH2-OE1 3.1Å; R402-E406 WeakPolarHBondContact O-CG 3.37Å; R402-E406 PolarHBondContact O-N 3.07Å |
| 403 | A | 96.3 | Very high | 95.6 | Very high | 53 Ų | 53 | 92.3 Ų | 92.3 | 44% | 0.438 | 51% | 0.506 | S | S | . | . | H | α-helix | trans | -59.3 | -35.4 | 179 | 0 | 0 | 0 | 0 | 0 | 112.6 | K399 A407 | K399-A403 PolarHBondContact O-N 2.91Å; A403-A407 WeakPolarHBondContact O-CB 3.5Å; A403-A407 PolarHBondContact O-N 2.62Å |
| 404 | K | 97.1 | Very high | 95.7 | Very high | 163 Ų | 163 | 95.9 Ų | 95.9 | 71% | 0.709 | 51% | 0.506 | S | S | * | . | H | α-helix | trans | -66.6 | -40.1 | 173.8 | -173.8 | -171.9 | 174.3 | -168.5 | 0 | 112.2 | A400 Q401 R402 A408 | A400-K404 WeakPolarHBondContact O-CB 3.48Å; A400-K404 PolarHBondContact O-N 3.19Å; A400-K404 VanDerWaalsContact O-N 3.14Å; Q401-K404 WeakPolarHBondContact O-CB 3.23Å; Q401-K404 PolarHBondContact O-N 3.01Å; R402-K404 PolarHBondContact O-N 3.4Å; K404-A408 WeakPolarHBondContact O-CB 3.24Å; K404-A408 PolarHBondContact O-N 3.11Å; K404-A408 VanDerWaalsContact O-N 3.09Å |
| 405 | L | 93.5 | Very high | 95.6 | Very high | 115 Ų | 115 | 95.7 Ų | 95.7 | 60% | 0.602 | 51% | 0.505 | S | S | * | . | H | α-helix | trans | -70.3 | -43.2 | 177.6 | -69.7 | 173.3 | 0 | 0 | 0 | 111.4 | Q401 R402 A407 A408 V409 | Q401-L405 WeakPolarHBondContact O-CG 3.44Å; Q401-L405 PolarHBondContact O-N 2.94Å; R402-L405 PolarHBondContact O-N 3.4Å; L405-A407 VanDerWaalsContact C-N 3.33Å; L405-A407 PolarHBondContact O-N 3.49Å; L405-A408 PolarHBondContact O-N 2.98Å; L405-A408 VanDerWaalsContact O-N 3.1Å; L405-V409 WeakPolarHBondContact O-CG2 3.48Å; L405-V409 PolarHBondContact O-N 3.33Å |
| 406 | E | 96.2 | Very high | 95.5 | Very high | 93 Ų | 93 | 93.4 Ų | 93.4 | 44% | 0.435 | 50% | 0.502 | S | S | . | . | H | α-helix | trans | -58.1 | -43.8 | 174.3 | -71.5 | 171.1 | 153.3 | 0 | 0 | 111.4 | R402 A408 V409 A410 | R402-E406 HydrophobicContact CG-CG 4.31Å; R402-E406 IonicContact CZ-OE1 3.39Å; R402-E406 IonicContact NE-OE1 3.45Å; R402-E406 PolarHBondContact NE-OE1 2.87Å; R402-E406 IonicContact NE-OE2 3.2Å; R402-E406 IonicContact NH2-OE1 2.69Å; R402-E406 PolarHBondContact NH2-OE1 3.1Å; R402-E406 WeakPolarHBondContact O-CG 3.37Å; R402-E406 PolarHBondContact O-N 3.07Å; E406-A408 VanDerWaalsContact C-N 3.34Å; E406-A408 PolarHBondContact O-N 3.29Å; E406-V409 PolarHBondContact O-N 2.73Å; E406-A410 WeakPolarHBondContact O-CB 3.44Å; E406-A410 PolarHBondContact O-N 2.86Å |
| 407 | A | 96.6 | Very high | 95.5 | Very high | 63 Ų | 63 | 94 Ų | 94 | 52% | 0.521 | 51% | 0.505 | S | S | . | . | H | α-helix | trans | -64.3 | -35.5 | 174.4 | 0 | 0 | 0 | 0 | 0 | 113.3 | A403 L405 E411 | A403-A407 WeakPolarHBondContact O-CB 3.5Å; A403-A407 PolarHBondContact O-N 2.62Å; L405-A407 VanDerWaalsContact C-N 3.33Å; L405-A407 PolarHBondContact O-N 3.49Å; A407-E411 WeakPolarHBondContact O-CB 3.48Å; A407-E411 PolarHBondContact O-N 3.34Å; A407-E411 VanDerWaalsContact O-N 3.13Å |
| 408 | A | 94.3 | Very high | 95.5 | Very high | 59 Ų | 59 | 91.9 Ų | 91.9 | 49% | 0.488 | 50% | 0.504 | S | S | . | . | H | α-helix | trans | -71.9 | -36.2 | 176.7 | 0 | 0 | 0 | 0 | 0 | 112.5 | K404 L405 E406 A412 | K404-A408 WeakPolarHBondContact O-CB 3.24Å; K404-A408 PolarHBondContact O-N 3.11Å; K404-A408 VanDerWaalsContact O-N 3.09Å; L405-A408 PolarHBondContact O-N 2.98Å; L405-A408 VanDerWaalsContact O-N 3.1Å; E406-A408 VanDerWaalsContact C-N 3.34Å; E406-A408 PolarHBondContact O-N 3.29Å; A408-A412 WeakPolarHBondContact O-CB 3.45Å; A408-A412 PolarHBondContact O-N 3.47Å |
| 409 | V | 95.2 | Very high | 95.7 | Very high | 78 Ų | 78 | 91.8 Ų | 91.8 | 47% | 0.473 | 50% | 0.503 | S | S | . | . | H | α-helix | trans | -64.5 | -51.3 | 172.9 | 170 | 0 | 0 | 0 | 0 | 110.1 | L405 E406 E411 A412 E413 | L405-V409 WeakPolarHBondContact O-CG2 3.48Å; L405-V409 PolarHBondContact O-N 3.33Å; E406-V409 PolarHBondContact O-N 2.73Å; V409-E411 VanDerWaalsContact C-N 3.27Å; V409-E411 PolarHBondContact O-N 3.29Å; V409-A412 PolarHBondContact O-N 2.84Å; V409-E413 HydrophobicContact CG1-CG 4.26Å; V409-E413 WeakPolarHBondContact O-CG 3.42Å; V409-E413 PolarHBondContact O-N 3.05Å |
| 410 | A | 96.3 | Very high | 95.7 | Very high | 47 Ų | 47 | 90.7 Ų | 90.7 | 39% | 0.388 | 50% | 0.502 | S | S | . | . | H | α-helix | trans | -58.1 | -38.4 | 179.2 | 0 | 0 | 0 | 0 | 0 | 112.7 | E406 R414 | E406-A410 WeakPolarHBondContact O-CB 3.44Å; E406-A410 PolarHBondContact O-N 2.86Å; A410-R414 WeakPolarHBondContact O-CG 3.27Å; A410-R414 PolarHBondContact O-N 2.96Å |
| 411 | E | 97.4 | Very high | 95.8 | Very high | 95 Ų | 95 | 90.9 Ų | 90.9 | 44% | 0.444 | 49% | 0.494 | S | S | . | . | H | α-helix | trans | -69.8 | -38.8 | 175.8 | -175.3 | 59.6 | -168.8 | 0 | 0 | 112.7 | A407 V409 R414 Q415 | A407-E411 WeakPolarHBondContact O-CB 3.48Å; A407-E411 PolarHBondContact O-N 3.34Å; A407-E411 VanDerWaalsContact O-N 3.13Å; V409-E411 VanDerWaalsContact C-N 3.27Å; V409-E411 PolarHBondContact O-N 3.29Å; E411-R414 IonicContact OE1-CZ 2.87Å; E411-R414 IonicContact OE1-NH2 2.69Å; E411-R414 PolarHBondContact OE1-NH2 2.66Å; E411-R414 IonicContact OE2-CZ 3.81Å; E411-R414 VanDerWaalsContact OE2-CZ 3.24Å; E411-R414 IonicContact OE2-NE 3.09Å; E411-R414 PolarHBondContact OE2-NE 2.88Å; E411-R414 IonicContact OE2-NH2 2.67Å; E411-R414 PolarHBondContact OE2-NH2 3.5Å; E411-Q415 WeakPolarHBondContact O-CB 3.48Å; E411-Q415 PolarHBondContact O-N 3.48Å |
| 412 | A | 91.6 | Very high | 95.9 | Very high | 65 Ų | 65 | 90 Ų | 90 | 54% | 0.537 | 49% | 0.493 | S | S | . | . | H | α-helix | trans | -65.5 | -39.2 | 174.2 | 0 | 0 | 0 | 0 | 0 | 112.1 | A408 V409 Q415 G416 | A408-A412 WeakPolarHBondContact O-CB 3.45Å; A408-A412 PolarHBondContact O-N 3.47Å; V409-A412 PolarHBondContact O-N 2.84Å; A412-Q415 PolarHBondContact O-N 2.89Å; A412-G416 PolarHBondContact O-N 3.31Å |
| 413 | E | 94.8 | Very high | 96.1 | Very high | 130 Ų | 130 | 84.8 Ų | 84.8 | 61% | 0.607 | 49% | 0.485 | S | S | * | . | H | α-helix | trans | -61.8 | -51 | 174.1 | -73.4 | 173.1 | 163.7 | 0 | 0 | 111.2 | V409 Q415 G416 E417 | V409-E413 HydrophobicContact CG1-CG 4.26Å; V409-E413 WeakPolarHBondContact O-CG 3.42Å; V409-E413 PolarHBondContact O-N 3.05Å; E413-Q415 VanDerWaalsContact C-N 3.29Å; E413-Q415 PolarHBondContact O-N 3.32Å; E413-G416 PolarHBondContact O-N 2.92Å; E413-E417 WeakPolarHBondContact O-CB 3.34Å; E413-E417 PolarHBondContact O-N 3.1Å |
| 414 | R | 97.1 | Very high | 96.2 | Very high | 138 Ų | 138 | 88 Ų | 88 | 52% | 0.521 | 49% | 0.49 | S | S | . | . | H | α-helix | trans | -57.5 | -42 | 174.7 | -69.9 | -166.8 | -31.1 | 92.4 | 4.6 | 112.4 | A410 E411 E417 A418 | A410-R414 WeakPolarHBondContact O-CG 3.27Å; A410-R414 PolarHBondContact O-N 2.96Å; E411-R414 IonicContact OE1-CZ 2.87Å; E411-R414 IonicContact OE1-NH2 2.69Å; E411-R414 PolarHBondContact OE1-NH2 2.66Å; E411-R414 IonicContact OE2-CZ 3.81Å; E411-R414 VanDerWaalsContact OE2-CZ 3.24Å; E411-R414 IonicContact OE2-NE 3.09Å; E411-R414 PolarHBondContact OE2-NE 2.88Å; E411-R414 IonicContact OE2-NH2 2.67Å; E411-R414 PolarHBondContact OE2-NH2 3.5Å; R414-E417 PolarHBondContact O-N 3.32Å; R414-A418 WeakPolarHBondContact O-CB 3.46Å; R414-A418 PolarHBondContact O-N 3.47Å |
| 415 | Q | 96.6 | Very high | 96.3 | Very high | 106 Ų | 106 | 83.9 Ų | 83.9 | 50% | 0.495 | 48% | 0.48 | S | S | . | . | H | α-helix | trans | -68.1 | -37.9 | -178.9 | -175.5 | 58.9 | 38 | 0 | 0 | 111.4 | E411 A412 E413 A418 T419 | E411-Q415 WeakPolarHBondContact O-CB 3.48Å; E411-Q415 PolarHBondContact O-N 3.48Å; A412-Q415 PolarHBondContact O-N 2.89Å; E413-Q415 VanDerWaalsContact C-N 3.29Å; E413-Q415 PolarHBondContact O-N 3.32Å; Q415-A418 PolarHBondContact O-N 3.05Å; Q415-T419 WeakPolarHBondContact O-CG2 3.42Å; Q415-T419 PolarHBondContact O-N 3.26Å; Q415-T419 VanDerWaalsContact O-N 3.13Å; Q415-T419 PolarHBondContact O-OG1 2.71Å |
| 416 | G | 94 | Very high | 96.5 | Very high | 36 Ų | 36 | 83.6 Ų | 83.6 | 37% | 0.371 | 47% | 0.474 | S | S | . | . | H | α-helix | trans | -67.5 | -39.5 | 172.8 | 0 | 0 | 0 | 0 | 0 | 113.1 | A412 E413 T419 L420 | A412-G416 PolarHBondContact O-N 3.31Å; E413-G416 PolarHBondContact O-N 2.92Å; G416-T419 PolarHBondContact O-OG1 3.38Å; G416-T419 VanDerWaalsContact O-OG1 3.05Å; G416-L420 WeakPolarHBondContact O-CB 3.14Å; G416-L420 PolarHBondContact O-N 3.06Å |
| 417 | E | 97.4 | Very high | 96.6 | Very high | 121 Ų | 121 | 83.8 Ų | 83.8 | 57% | 0.565 | 48% | 0.477 | S | S | * | . | H | α-helix | trans | -63.9 | -41.8 | 173.5 | -177.1 | 176.7 | -163 | 0 | 0 | 111.4 | E413 R414 L420 N421 | E413-E417 WeakPolarHBondContact O-CB 3.34Å; E413-E417 PolarHBondContact O-N 3.1Å; R414-E417 PolarHBondContact O-N 3.32Å; E417-L420 PolarHBondContact O-N 3.06Å; E417-N421 WeakPolarHBondContact O-CB 3.26Å; E417-N421 VanDerWaalsContact O-CG 3.3Å; E417-N421 PolarHBondContact O-N 3.27Å; E417-N421 PolarHBondContact O-ND2 2.84Å |
| 418 | A | 97.1 | Very high | 96.6 | Very high | 50 Ų | 50 | 82.8 Ų | 82.8 | 41% | 0.413 | 47% | 0.469 | S | S | . | . | H | α-helix | trans | -62.8 | -44.4 | 177.6 | 0 | 0 | 0 | 0 | 0 | 112.7 | R414 Q415 N421 D422 | R414-A418 WeakPolarHBondContact O-CB 3.46Å; R414-A418 PolarHBondContact O-N 3.47Å; Q415-A418 PolarHBondContact O-N 3.05Å; A418-N421 PolarHBondContact O-N 3.02Å; A418-D422 PolarHBondContact O-N 3.14Å |
| 419 | T | 97.1 | Very high | 96.8 | Very high | 76 Ų | 76 | 85.1 Ų | 85.1 | 47% | 0.466 | 47% | 0.474 | S | S | . | . | H | α-helix | trans | -69.9 | -35.5 | 177.2 | 55.2 | 0 | 0 | 0 | 0 | 112.4 | Q415 G416 D422 A423 | Q415-T419 WeakPolarHBondContact O-CG2 3.42Å; Q415-T419 PolarHBondContact O-N 3.26Å; Q415-T419 VanDerWaalsContact O-N 3.13Å; Q415-T419 PolarHBondContact O-OG1 2.71Å; G416-T419 PolarHBondContact O-OG1 3.38Å; G416-T419 VanDerWaalsContact O-OG1 3.05Å; T419-D422 PolarHBondContact O-N 2.99Å; T419-A423 WeakPolarHBondContact O-CB 3.41Å; T419-A423 PolarHBondContact O-N 3.03Å |
| 420 | L | 96.6 | Very high | 97 | Very high | 90 Ų | 90 | 87.5 Ų | 87.5 | 47% | 0.471 | 48% | 0.483 | S | S | . | . | H | α-helix | trans | -65.3 | -40.8 | 174.7 | -173.2 | 158.6 | 0 | 0 | 0 | 111.4 | G416 E417 A423 K424 | G416-L420 WeakPolarHBondContact O-CB 3.14Å; G416-L420 PolarHBondContact O-N 3.06Å; E417-L420 PolarHBondContact O-N 3.06Å; L420-A423 PolarHBondContact O-N 3.26Å; L420-K424 HydrophobicContact CD2-CD 3.77Å; L420-K424 HydrophobicContact CD2-CG 4.26Å; L420-K424 WeakPolarHBondContact O-CG 3.4Å; L420-K424 PolarHBondContact O-N 3.35Å |
| 421 | N | 98.3 | Very high | 97.1 | Very high | 65 Ų | 65 | 91 Ų | 91 | 35% | 0.348 | 49% | 0.492 | S | S | . | . | H | α-helix | trans | -69.2 | -39.8 | 176.2 | -73.1 | -28.2 | 0 | 0 | 0 | 112.3 | E417 A418 A423 K424 C425 | E417-N421 WeakPolarHBondContact O-CB 3.26Å; E417-N421 VanDerWaalsContact O-CG 3.3Å; E417-N421 PolarHBondContact O-N 3.27Å; E417-N421 PolarHBondContact O-ND2 2.84Å; A418-N421 PolarHBondContact O-N 3.02Å; N421-A423 PolarHBondContact O-N 2.82Å; N421-K424 WeakPolarHBondContact O-CB 3.42Å; N421-K424 PolarHBondContact O-N 2.9Å; N421-C425 PolarHBondContact O-N 3.21Å; N421-C425 PolarHBondContact O-SG 3.37Å |
| 422 | D | 98.1 | Very high | 97.1 | Very high | 80 Ų | 80 | 90.6 Ų | 90.6 | 43% | 0.428 | 50% | 0.498 | S | S | . | . | H | α-helix | trans | -59.4 | -43.1 | 170.9 | 170.1 | 60.2 | 0 | 0 | 0 | 112.2 | A418 T419 C425 K426 | A418-D422 PolarHBondContact O-N 3.14Å; T419-D422 PolarHBondContact O-N 2.99Å; D422-C425 PolarHBondContact O-N 2.96Å; D422-K426 WeakPolarHBondContact O-CG 3.23Å; D422-K426 PolarHBondContact O-N 3.03Å; D422-K426 WeakPolarHBondContact OD1-CE 3.34Å; D422-K426 IonicContact OD1-NZ 3.38Å; D422-K426 PolarHBondContact OD1-NZ 3.37Å; D422-K426 IonicContact OD2-NZ 2.66Å; D422-K426 PolarHBondContact OD2-NZ 3.13Å |
| 423 | A | 97.2 | Very high | 97.4 | Very high | 57 Ų | 57 | 90 Ų | 90 | 47% | 0.471 | 49% | 0.493 | S | S | . | . | H | α-helix | trans | -63.9 | -39.5 | 174.6 | 0 | 0 | 0 | 0 | 0 | 112.9 | T419 L420 N421 K426 L427 | T419-A423 WeakPolarHBondContact O-CB 3.41Å; T419-A423 PolarHBondContact O-N 3.03Å; L420-A423 PolarHBondContact O-N 3.26Å; N421-A423 PolarHBondContact O-N 2.82Å; A423-K426 PolarHBondContact O-N 2.92Å; A423-L427 WeakPolarHBondContact O-CB 3.46Å; A423-L427 PolarHBondContact O-N 3.25Å |
| 424 | K | 97.9 | Very high | 97.6 | Very high | 122 Ų | 122 | 88.5 Ų | 88.5 | 53% | 0.53 | 49% | 0.489 | S | S | . | . | H | α-helix | trans | -62.6 | -44 | 173.4 | -79.1 | 174.3 | 175.8 | 162.3 | 0 | 112.4 | L420 N421 L427 A428 | L420-K424 HydrophobicContact CD2-CD 3.77Å; L420-K424 HydrophobicContact CD2-CG 4.26Å; L420-K424 WeakPolarHBondContact O-CG 3.4Å; L420-K424 PolarHBondContact O-N 3.35Å; N421-K424 WeakPolarHBondContact O-CB 3.42Å; N421-K424 PolarHBondContact O-N 2.9Å; K424-L427 PolarHBondContact O-N 3.12Å; K424-A428 PolarHBondContact O-N 3.23Å |
| 425 | C | 98.3 | Very high | 97.6 | Very high | 75 Ų | 75 | 86.5 Ų | 86.5 | 51% | 0.507 | 49% | 0.485 | S | S | . | . | H | α-helix | trans | -59.8 | -48.4 | 176.7 | -68.3 | 0 | 0 | 0 | 0 | 110.9 | N421 D422 L427 A428 D429 | N421-C425 PolarHBondContact O-N 3.21Å; N421-C425 PolarHBondContact O-SG 3.37Å; D422-C425 PolarHBondContact O-N 2.96Å; C425-L427 VanDerWaalsContact C-N 3.29Å; C425-L427 PolarHBondContact O-N 3.07Å; C425-A428 PolarHBondContact O-N 3.19Å; C425-A428 VanDerWaalsContact O-N 3.13Å; C425-D429 VanDerWaalsContact O-CG 3.32Å; C425-D429 PolarHBondContact O-N 3.36Å |
| 426 | K | 98.3 | Very high | 97.7 | Very high | 109 Ų | 109 | 87 Ų | 87 | 47% | 0.474 | 49% | 0.488 | S | S | . | . | H | α-helix | trans | -59.8 | -37.6 | 176.6 | -72.4 | 165 | 179.4 | 163.8 | 0 | 113.1 | D422 A423 L430 | D422-K426 WeakPolarHBondContact O-CG 3.23Å; D422-K426 PolarHBondContact O-N 3.03Å; D422-K426 WeakPolarHBondContact OD1-CE 3.34Å; D422-K426 IonicContact OD1-NZ 3.38Å; D422-K426 PolarHBondContact OD1-NZ 3.37Å; D422-K426 IonicContact OD2-NZ 2.66Å; D422-K426 PolarHBondContact OD2-NZ 3.13Å; A423-K426 PolarHBondContact O-N 2.92Å; K426-L430 WeakPolarHBondContact O-CB 3.33Å; K426-L430 VanDerWaalsContact O-CG 3.27Å; K426-L430 WeakPolarHBondContact O-CG 3.45Å; K426-L430 PolarHBondContact O-N 2.93Å; K426-L430 VanDerWaalsContact O-N 3.08Å |
| 427 | L | 97.6 | Very high | 97.9 | Very high | 97 Ų | 97 | 88.2 Ų | 88.2 | 51% | 0.508 | 49% | 0.494 | S | S | . | . | H | α-helix | trans | -64.9 | -46.6 | 174.5 | -179.9 | 145.7 | 0 | 0 | 0 | 111 | A423 K424 C425 D429 L430 E431 | A423-L427 WeakPolarHBondContact O-CB 3.46Å; A423-L427 PolarHBondContact O-N 3.25Å; K424-L427 PolarHBondContact O-N 3.12Å; C425-L427 VanDerWaalsContact C-N 3.29Å; C425-L427 PolarHBondContact O-N 3.07Å; L427-D429 PolarHBondContact O-N 3.21Å; L427-L430 PolarHBondContact O-N 3.35Å; L427-E431 HydrophobicContact CD2-CG 4.28Å; L427-E431 WeakPolarHBondContact O-CG 3.25Å; L427-E431 PolarHBondContact O-N 3.39Å |
| 428 | A | 98.4 | Very high | 98 | Very high | 42 Ų | 42 | 88.2 Ų | 88.2 | 35% | 0.347 | 49% | 0.492 | S | S | . | . | H | α-helix | trans | -62.2 | -40.1 | 176.9 | 0 | 0 | 0 | 0 | 0 | 112.6 | K424 C425 E431 C432 | K424-A428 PolarHBondContact O-N 3.23Å; C425-A428 PolarHBondContact O-N 3.19Å; C425-A428 VanDerWaalsContact O-N 3.13Å; A428-E431 PolarHBondContact O-N 3.28Å; A428-C432 WeakPolarHBondContact O-CB 3.36Å; A428-C432 PolarHBondContact O-N 3Å; A428-C432 PolarHBondContact O-SG 3.4Å |
| 429 | D | 98.3 | Very high | 98 | Very high | 109 Ų | 109 | 91.3 Ų | 91.3 | 58% | 0.583 | 50% | 0.498 | S | S | * | . | H | α-helix | trans | -61.6 | -43.6 | 175.2 | -69 | -27.4 | 0 | 0 | 0 | 111.5 | C425 L427 C432 A433 | C425-D429 VanDerWaalsContact O-CG 3.32Å; C425-D429 PolarHBondContact O-N 3.36Å; L427-D429 PolarHBondContact O-N 3.21Å; D429-C432 PolarHBondContact O-N 3.23Å; D429-A433 WeakPolarHBondContact O-CB 3.49Å; D429-A433 PolarHBondContact O-N 3.48Å |
| 430 | L | 98.1 | Very high | 98.1 | Very high | 127 Ų | 127 | 90 Ų | 90 | 67% | 0.665 | 49% | 0.488 | S | S | * | . | H | α-helix | trans | -67.6 | -38.9 | 176.9 | -72.3 | 172 | 0 | 0 | 0 | 112.5 | K426 L427 A433 L434 | K426-L430 WeakPolarHBondContact O-CB 3.33Å; K426-L430 VanDerWaalsContact O-CG 3.27Å; K426-L430 WeakPolarHBondContact O-CG 3.45Å; K426-L430 PolarHBondContact O-N 2.93Å; K426-L430 VanDerWaalsContact O-N 3.08Å; L427-L430 PolarHBondContact O-N 3.35Å; L430-A433 PolarHBondContact O-N 3.16Å; L430-L434 VanDerWaalsContact O-CB 3.24Å; L430-L434 WeakPolarHBondContact O-CB 3.47Å; L430-L434 PolarHBondContact O-N 3.28Å |
| 431 | E | 98.3 | Very high | 98.1 | Very high | 122 Ų | 122 | 91 Ų | 91 | 57% | 0.57 | 49% | 0.492 | S | S | * | . | H | α-helix | trans | -63 | -42.1 | 173.2 | -74.1 | 179.9 | 157.4 | 0 | 0 | 111.6 | L427 A428 L434 Q435 | L427-E431 HydrophobicContact CD2-CG 4.28Å; L427-E431 WeakPolarHBondContact O-CG 3.25Å; L427-E431 PolarHBondContact O-N 3.39Å; A428-E431 PolarHBondContact O-N 3.28Å; E431-L434 PolarHBondContact O-N 3.32Å; E431-Q435 WeakPolarHBondContact O-CB 3.17Å; E431-Q435 PolarHBondContact O-N 2.98Å |
| 432 | C | 98.3 | Very high | 98.1 | Very high | 85 Ų | 85 | 90.2 Ų | 90.2 | 57% | 0.574 | 49% | 0.494 | S | S | * | . | H | α-helix | trans | -63.4 | -47.4 | 175.2 | -69.4 | 0 | 0 | 0 | 0 | 111.6 | A428 D429 L434 Q435 Q436 | A428-C432 WeakPolarHBondContact O-CB 3.36Å; A428-C432 PolarHBondContact O-N 3Å; A428-C432 PolarHBondContact O-SG 3.4Å; D429-C432 PolarHBondContact O-N 3.23Å; C432-L434 VanDerWaalsContact C-N 3.34Å; C432-L434 PolarHBondContact O-N 3.44Å; C432-Q435 PolarHBondContact O-N 2.85Å; C432-Q436 WeakPolarHBondContact O-CB 3.39Å; C432-Q436 PolarHBondContact O-N 2.85Å |
| 433 | A | 98.1 | Very high | 98.1 | Very high | 53 Ų | 53 | 92 Ų | 92 | 44% | 0.438 | 50% | 0.495 | S | S | . | . | H | α-helix | trans | -61.3 | -40.7 | 176.8 | 0 | 0 | 0 | 0 | 0 | 112.3 | D429 L430 Q436 A437 | D429-A433 WeakPolarHBondContact O-CB 3.49Å; D429-A433 PolarHBondContact O-N 3.48Å; L430-A433 PolarHBondContact O-N 3.16Å; A433-Q436 PolarHBondContact O-N 3.01Å; A433-A437 WeakPolarHBondContact O-CB 3.47Å; A433-A437 PolarHBondContact O-N 3.47Å |
| 434 | L | 98.1 | Very high | 98.2 | Very high | 98 Ų | 98 | 94 Ų | 94 | 51% | 0.513 | 50% | 0.495 | S | S | . | . | H | α-helix | trans | -65.6 | -39.1 | 175.8 | 178.7 | 145.5 | 0 | 0 | 0 | 112 | L430 E431 C432 K438 | L430-L434 VanDerWaalsContact O-CB 3.24Å; L430-L434 WeakPolarHBondContact O-CB 3.47Å; L430-L434 PolarHBondContact O-N 3.28Å; E431-L434 PolarHBondContact O-N 3.32Å; C432-L434 VanDerWaalsContact C-N 3.34Å; C432-L434 PolarHBondContact O-N 3.44Å; L434-K438 HydrophobicContact CD2-CD 4.06Å; L434-K438 VanDerWaalsContact CD2-CE 3.47Å; L434-K438 WeakPolarHBondContact O-CG 3.21Å; L434-K438 PolarHBondContact O-N 3.42Å; L434-K438 VanDerWaalsContact O-N 3.11Å |
| 435 | Q | 98.4 | Very high | 98.2 | Very high | 97 Ų | 97 | 93.5 Ų | 93.5 | 45% | 0.453 | 50% | 0.497 | S | S | . | . | H | α-helix | trans | -70 | -37.4 | 176 | -172.9 | 64.3 | -2.3 | 0 | 0 | 112 | E431 C432 K438 Q439 | E431-Q435 WeakPolarHBondContact O-CB 3.17Å; E431-Q435 PolarHBondContact O-N 2.98Å; C432-Q435 PolarHBondContact O-N 2.85Å; Q435-K438 PolarHBondContact O-N 3.07Å; Q435-Q439 WeakPolarHBondContact O-CG 3.46Å; Q435-Q439 PolarHBondContact O-N 2.75Å; Q435-Q439 VanDerWaalsContact O-N 3.1Å |
| 436 | Q | 98.4 | Very high | 98.2 | Very high | 116 Ų | 116 | 96.4 Ų | 96.4 | 54% | 0.542 | 50% | 0.497 | S | S | . | . | H | α-helix | trans | -63.3 | -47.2 | 172.6 | -175.8 | 175.4 | -10.9 | 0 | 0 | 111.4 | C432 A433 K438 Q439 D440 | C432-Q436 WeakPolarHBondContact O-CB 3.39Å; C432-Q436 PolarHBondContact O-N 2.85Å; A433-Q436 PolarHBondContact O-N 3.01Å; Q436-K438 VanDerWaalsContact C-N 3.28Å; Q436-K438 PolarHBondContact O-N 3.12Å; Q436-Q439 WeakPolarHBondContact O-CA 3.45Å; Q436-Q439 WeakPolarHBondContact O-CB 3.49Å; Q436-Q439 PolarHBondContact O-N 2.79Å; Q436-D440 PolarHBondContact O-N 3.14Å |
| 437 | A | 98 | Very high | 98.2 | Very high | 61 Ų | 61 | 96 Ų | 96 | 50% | 0.504 | 50% | 0.497 | S | S | . | . | H | α-helix | trans | -59.2 | -36.6 | 176.9 | 0 | 0 | 0 | 0 | 0 | 112.8 | A433 D440 M441 | A433-A437 WeakPolarHBondContact O-CB 3.47Å; A433-A437 PolarHBondContact O-N 3.47Å; A437-D440 PolarHBondContact O-N 2.98Å; A437-M441 WeakPolarHBondContact O-CB 3.41Å; A437-M441 PolarHBondContact O-N 3.31Å |
| 438 | K | 98.3 | Very high | 98.2 | Very high | 122 Ų | 122 | 99 Ų | 99 | 53% | 0.53 | 50% | 0.503 | S | S | . | . | H | α-helix | trans | -63.6 | -42.4 | 171.4 | -75.1 | 170.9 | 177 | 172.9 | 0 | 112.6 | L434 Q435 Q436 A442 | L434-K438 HydrophobicContact CD2-CD 4.06Å; L434-K438 VanDerWaalsContact CD2-CE 3.47Å; L434-K438 WeakPolarHBondContact O-CG 3.21Å; L434-K438 PolarHBondContact O-N 3.42Å; L434-K438 VanDerWaalsContact O-N 3.11Å; Q435-K438 PolarHBondContact O-N 3.07Å; Q436-K438 VanDerWaalsContact C-N 3.28Å; Q436-K438 PolarHBondContact O-N 3.12Å; K438-A442 WeakPolarHBondContact O-CB 3.32Å; K438-A442 PolarHBondContact O-N 2.9Å |
| 439 | Q | 98.4 | Very high | 98.2 | Very high | 114 Ų | 114 | 102.2 Ų | 102.2 | 53% | 0.533 | 51% | 0.511 | S | S | . | . | H | α-helix | trans | -65.6 | -39.2 | 177 | -69.9 | 173.6 | 14.8 | 0 | 0 | 111.8 | Q435 Q436 A442 R443 | Q435-Q439 WeakPolarHBondContact O-CG 3.46Å; Q435-Q439 PolarHBondContact O-N 2.75Å; Q435-Q439 VanDerWaalsContact O-N 3.1Å; Q436-Q439 WeakPolarHBondContact O-CA 3.45Å; Q436-Q439 WeakPolarHBondContact O-CB 3.49Å; Q436-Q439 PolarHBondContact O-N 2.79Å; Q439-A442 CarbonylContact O-C 3.58Å; Q439-A442 PolarHBondContact O-N 3.07Å; Q439-R443 WeakPolarHBondContact O-CB 3.33Å; Q439-R443 PolarHBondContact O-N 3.36Å |
| 440 | D | 98.3 | Very high | 98.2 | Very high | 50 Ų | 50 | 102.6 Ų | 102.6 | 27% | 0.267 | 51% | 0.509 | S | S | . | . | H | α-helix | trans | -71.1 | -40 | 178.8 | -69.8 | -26.1 | 0 | 0 | 0 | 112 | Q436 A437 A442 R443 Q444 | Q436-D440 PolarHBondContact O-N 3.14Å; A437-D440 PolarHBondContact O-N 2.98Å; D440-A442 VanDerWaalsContact C-N 3.35Å; D440-A442 PolarHBondContact O-N 3.26Å; D440-R443 WeakPolarHBondContact O-CA 3.43Å; D440-R443 VanDerWaalsContact O-CB 3.31Å; D440-R443 WeakPolarHBondContact O-CB 3.32Å; D440-R443 PolarHBondContact O-N 3Å; D440-R443 VanDerWaalsContact O-N 3.08Å; D440-R443 IonicContact OD1-CZ 2.75Å; D440-R443 IonicContact OD1-NE 3.68Å; D440-R443 PolarHBondContact OD1-NE 3.46Å; D440-R443 IonicContact OD1-NH2 2.73Å; D440-R443 PolarHBondContact OD1-NH2 3.31Å; D440-Q444 WeakPolarHBondContact O-CG 3.46Å; D440-Q444 PolarHBondContact O-N 2.95Å |
| 441 | M | 98.1 | Very high | 98.2 | Very high | 110 Ų | 110 | 102.1 Ų | 102.1 | 54% | 0.542 | 51% | 0.506 | S | S | . | . | H | α-helix | trans | -58.4 | -45.5 | 168.3 | 177.5 | 64.6 | 83.3 | 0 | 0 | 111.6 | A437 R443 Q444 L445 | A437-M441 WeakPolarHBondContact O-CB 3.41Å; A437-M441 PolarHBondContact O-N 3.31Å; M441-R443 PolarHBondContact O-N 2.77Å; M441-Q444 PolarHBondContact O-N 2.95Å; M441-L445 HydrophobicContact CG-CD1 4.3Å; M441-L445 WeakPolarHBondContact O-CG 3.38Å; M441-L445 PolarHBondContact O-N 2.85Å; M441-L445 HydrophobicContact SD-CG 4.44Å |
| 442 | A | 98.2 | Very high | 98.2 | Very high | 48 Ų | 48 | 101.1 Ų | 101.1 | 40% | 0.397 | 50% | 0.503 | S | S | . | . | H | α-helix | trans | -67.3 | -18 | 176.3 | 0 | 0 | 0 | 0 | 0 | 113.7 | K438 Q439 D440 R446 | K438-A442 WeakPolarHBondContact O-CB 3.32Å; K438-A442 PolarHBondContact O-N 2.9Å; Q439-A442 CarbonylContact O-C 3.58Å; Q439-A442 PolarHBondContact O-N 3.07Å; D440-A442 VanDerWaalsContact C-N 3.35Å; D440-A442 PolarHBondContact O-N 3.26Å; A442-R446 PolarHBondContact O-NE 3.07Å |
| 443 | R | 98.3 | Very high | 98.1 | Very high | 118 Ų | 118 | 101.3 Ų | 101.3 | 45% | 0.445 | 50% | 0.498 | S | S | . | . | H | α-helix | trans | -80.5 | -51.1 | 171.5 | -165 | -162.7 | -47.9 | -144.6 | 4.5 | 110.9 | Q439 D440 M441 L445 R446 E447 | Q439-R443 WeakPolarHBondContact O-CB 3.33Å; Q439-R443 PolarHBondContact O-N 3.36Å; D440-R443 WeakPolarHBondContact O-CA 3.43Å; D440-R443 VanDerWaalsContact O-CB 3.31Å; D440-R443 WeakPolarHBondContact O-CB 3.32Å; D440-R443 PolarHBondContact O-N 3Å; D440-R443 VanDerWaalsContact O-N 3.08Å; D440-R443 IonicContact OD1-CZ 2.75Å; D440-R443 IonicContact OD1-NE 3.68Å; D440-R443 PolarHBondContact OD1-NE 3.46Å; D440-R443 IonicContact OD1-NH2 2.73Å; D440-R443 PolarHBondContact OD1-NH2 3.31Å; M441-R443 PolarHBondContact O-N 2.77Å; R443-L445 VanDerWaalsContact C-N 3.29Å; R443-L445 PolarHBondContact O-N 2.96Å; R443-R446 WeakPolarHBondContact O-CB 3.33Å; R443-R446 PolarHBondContact O-N 3.43Å; R443-E447 WeakPolarHBondContact CD-OE1 3.32Å; R443-E447 VanDerWaalsContact CG-OE1 3.32Å; R443-E447 WeakPolarHBondContact CG-OE1 3.4Å; R443-E447 PolarHBondContact O-N 3.05Å |
| 444 | Q | 97.9 | Very high | 98.1 | Very high | 99 Ų | 99 | 101.3 Ų | 101.3 | 46% | 0.463 | 50% | 0.498 | S | S | . | . | H | α-helix | trans | -55.3 | -43.8 | 176.4 | -72.2 | -179.8 | -33.5 | 0 | 0 | 111.7 | D440 M441 R446 E447 Y448 | D440-Q444 WeakPolarHBondContact O-CG 3.46Å; D440-Q444 PolarHBondContact O-N 2.95Å; M441-Q444 PolarHBondContact O-N 2.95Å; Q444-R446 VanDerWaalsContact C-N 3.27Å; Q444-R446 PolarHBondContact O-N 2.82Å; Q444-E447 PolarHBondContact O-N 3.33Å; Q444-Y448 HydrophobicContact CB-CD2 4.37Å; Q444-Y448 HydrophobicContact CB-CE2 4.38Å; Q444-Y448 WeakPolarHBondContact O-CB 3.39Å; Q444-Y448 WeakPolarHBondContact O-CD2 3.37Å; Q444-Y448 PolarHBondContact O-N 3.5Å |
| 445 | L | 98.3 | Very high | 98.1 | Very high | 111 Ų | 111 | 101.7 Ų | 101.7 | 58% | 0.581 | 50% | 0.496 | S | S | * | . | H | α-helix | trans | -59.4 | -34.7 | 176.7 | -73.4 | 171.2 | 0 | 0 | 0 | 113.3 | M441 R443 Q449 | M441-L445 HydrophobicContact CG-CD1 4.3Å; M441-L445 WeakPolarHBondContact O-CG 3.38Å; M441-L445 PolarHBondContact O-N 2.85Å; M441-L445 HydrophobicContact SD-CG 4.44Å; R443-L445 VanDerWaalsContact C-N 3.29Å; R443-L445 PolarHBondContact O-N 2.96Å; L445-Q449 PolarHBondContact O-N 3.46Å |
| 446 | R | 98.1 | Very high | 98.1 | Very high | 136 Ų | 136 | 101.1 Ų | 101.1 | 51% | 0.513 | 50% | 0.496 | S | S | . | . | H | α-helix | trans | -72.9 | -46.8 | 174.8 | -71.6 | 179.2 | -69.8 | 111.8 | -10.3 | 111.4 | A442 R443 Q444 Y448 Q449 E450 | A442-R446 PolarHBondContact O-NE 3.07Å; R443-R446 WeakPolarHBondContact O-CB 3.33Å; R443-R446 PolarHBondContact O-N 3.43Å; Q444-R446 VanDerWaalsContact C-N 3.27Å; Q444-R446 PolarHBondContact O-N 2.82Å; R446-Y448 VanDerWaalsContact C-N 3.3Å; R446-Y448 PolarHBondContact O-N 3.42Å; R446-Q449 PolarHBondContact O-N 3.43Å; R446-E450 WeakPolarHBondContact O-CG 3.49Å; R446-E450 PolarHBondContact O-N 2.81Å |
| 447 | E | 98 | Very high | 98.1 | Very high | 100 Ų | 100 | 97 Ų | 97 | 47% | 0.467 | 48% | 0.484 | S | S | . | . | H | α-helix | trans | -58.9 | -40.4 | 176.8 | -68.2 | 167.4 | -172.4 | 0 | 0 | 111.7 | R443 Q444 E450 L451 | R443-E447 WeakPolarHBondContact CD-OE1 3.32Å; R443-E447 VanDerWaalsContact CG-OE1 3.32Å; R443-E447 WeakPolarHBondContact CG-OE1 3.4Å; R443-E447 PolarHBondContact O-N 3.05Å; Q444-E447 PolarHBondContact O-N 3.33Å; E447-E450 PolarHBondContact O-N 3.43Å; E447-L451 WeakPolarHBondContact O-CB 3.48Å; E447-L451 PolarHBondContact O-N 3.39Å |
| 448 | Y | 98.3 | Very high | 98.1 | Very high | 161 Ų | 161 | 98.7 Ų | 98.7 | 63% | 0.631 | 48% | 0.484 | S | S | * | . | H | α-helix | trans | -64.4 | -39.9 | 172.9 | -83.2 | -61.8 | 0 | 0 | 0 | 113 | Q444 R446 M452 | Q444-Y448 HydrophobicContact CB-CD2 4.37Å; Q444-Y448 HydrophobicContact CB-CE2 4.38Å; Q444-Y448 WeakPolarHBondContact O-CB 3.39Å; Q444-Y448 WeakPolarHBondContact O-CD2 3.37Å; Q444-Y448 PolarHBondContact O-N 3.5Å; R446-Y448 VanDerWaalsContact C-N 3.3Å; R446-Y448 PolarHBondContact O-N 3.42Å; Y448-M452 WeakPolarHBondContact O-CB 3.25Å; Y448-M452 PolarHBondContact O-N 2.93Å |
| 449 | Q | 98.2 | Very high | 98 | Very high | 109 Ų | 109 | 96 Ų | 96 | 51% | 0.509 | 48% | 0.475 | S | S | . | . | H | α-helix | trans | -68.3 | -40.3 | 176.6 | -174.3 | 62.1 | 61.3 | 0 | 0 | 111.7 | L445 R446 M452 N453 | L445-Q449 PolarHBondContact O-N 3.46Å; R446-Q449 PolarHBondContact O-N 3.43Å; Q449-M452 PolarHBondContact O-N 2.91Å; Q449-N453 PolarHBondContact NE2-OD1 2.87Å; Q449-N453 WeakPolarHBondContact O-CB 3.48Å; Q449-N453 PolarHBondContact O-N 2.89Å; Q449-N453 PolarHBondContact O-ND2 2.86Å; Q449-N453 PolarHBondContact O-OD1 3.33Å |
| 450 | E | 97.8 | Very high | 98 | Very high | 118 Ų | 118 | 96 Ų | 96 | 55% | 0.551 | 48% | 0.478 | S | S | * | . | H | α-helix | trans | -62.1 | -44.7 | 174.6 | -72 | 166.5 | -156.4 | 0 | 0 | 111.2 | R446 E447 N453 A454 | R446-E450 WeakPolarHBondContact O-CG 3.49Å; R446-E450 PolarHBondContact O-N 2.81Å; E447-E450 PolarHBondContact O-N 3.43Å; E450-N453 PolarHBondContact O-N 3.33Å; E450-A454 PolarHBondContact O-N 3.23Å |
| 451 | L | 98.3 | Very high | 97.9 | Very high | 116 Ų | 116 | 98.1 Ų | 98.1 | 61% | 0.607 | 49% | 0.486 | S | S | * | . | H | α-helix | trans | -64.2 | -40.1 | 175.1 | -177.5 | 61.9 | 0 | 0 | 0 | 112.6 | E447 A454 K455 | E447-L451 WeakPolarHBondContact O-CB 3.48Å; E447-L451 PolarHBondContact O-N 3.39Å; L451-A454 PolarHBondContact O-N 3.03Å; L451-K455 WeakPolarHBondContact O-CB 3.19Å; L451-K455 PolarHBondContact O-N 3.28Å |
| 452 | M | 97.8 | Very high | 97.8 | Very high | 102 Ų | 102 | 96.7 Ų | 96.7 | 50% | 0.502 | 48% | 0.48 | S | S | . | . | H | α-helix | trans | -62 | -44.6 | 173.9 | -178.2 | 64 | 73.5 | 0 | 0 | 111.2 | Y448 Q449 A454 K455 L456 | Y448-M452 WeakPolarHBondContact O-CB 3.25Å; Y448-M452 PolarHBondContact O-N 2.93Å; Q449-M452 PolarHBondContact O-N 2.91Å; M452-A454 VanDerWaalsContact C-N 3.35Å; M452-A454 PolarHBondContact O-N 3.5Å; M452-K455 PolarHBondContact O-N 2.82Å; M452-L456 HydrophobicContact CG-CD1 4.34Å; M452-L456 WeakPolarHBondContact O-CG 3.35Å; M452-L456 PolarHBondContact O-N 2.76Å |
| 453 | N | 97.9 | Very high | 97.7 | Very high | 88 Ų | 88 | 97 Ų | 97 | 47% | 0.471 | 48% | 0.483 | S | S | . | . | H | α-helix | trans | -61.6 | -43.5 | 177.3 | -66.4 | -12.4 | 0 | 0 | 0 | 111.2 | Q449 E450 L456 G457 | Q449-N453 PolarHBondContact NE2-OD1 2.87Å; Q449-N453 WeakPolarHBondContact O-CB 3.48Å; Q449-N453 PolarHBondContact O-N 2.89Å; Q449-N453 PolarHBondContact O-ND2 2.86Å; Q449-N453 PolarHBondContact O-OD1 3.33Å; E450-N453 PolarHBondContact O-N 3.33Å; N453-L456 PolarHBondContact O-N 3.47Å; N453-G457 PolarHBondContact O-N 3.14Å |
| 454 | A | 98.1 | Very high | 97.6 | Very high | 53 Ų | 53 | 94.5 Ų | 94.5 | 44% | 0.438 | 48% | 0.48 | S | S | . | . | H | α-helix | trans | -62.4 | -42.7 | 175.1 | 0 | 0 | 0 | 0 | 0 | 112.1 | E450 L451 M452 L456 G457 L458 | E450-A454 PolarHBondContact O-N 3.23Å; L451-A454 PolarHBondContact O-N 3.03Å; M452-A454 VanDerWaalsContact C-N 3.35Å; M452-A454 PolarHBondContact O-N 3.5Å; A454-L456 PolarHBondContact O-N 3.25Å; A454-G457 PolarHBondContact O-N 3.48Å; A454-L458 WeakPolarHBondContact O-CG 3.44Å; A454-L458 PolarHBondContact O-N 3.4Å |
| 455 | K | 97.9 | Very high | 97.6 | Very high | 106 Ų | 106 | 96.5 Ų | 96.5 | 46% | 0.461 | 49% | 0.485 | S | S | . | . | H | α-helix | trans | -60.3 | -43.9 | 175.6 | -174.8 | -90.5 | 176.1 | -176.6 | 0 | 111.8 | L451 M452 G457 L458 D459 | L451-K455 WeakPolarHBondContact O-CB 3.19Å; L451-K455 PolarHBondContact O-N 3.28Å; M452-K455 PolarHBondContact O-N 2.82Å; K455-G457 VanDerWaalsContact C-N 3.34Å; K455-L458 PolarHBondContact O-N 3.34Å; K455-D459 WeakPolarHBondContact CD-OD2 3.41Å; K455-D459 WeakPolarHBondContact CE-OD1 3.41Å; K455-D459 WeakPolarHBondContact CE-OD2 3.28Å; K455-D459 IonicContact NZ-OD1 2.79Å; K455-D459 PolarHBondContact NZ-OD1 3.25Å; K455-D459 IonicContact NZ-OD2 3.97Å; K455-D459 PolarHBondContact NZ-OD2 2.84Å; K455-D459 PolarHBondContact O-N 2.94Å |
| 456 | L | 97.9 | Very high | 97.4 | Very high | 86 Ų | 86 | 98.8 Ų | 98.8 | 45% | 0.45 | 49% | 0.486 | S | S | . | . | H | α-helix | trans | -64.8 | -37.7 | 176.2 | -69.3 | 172 | 0 | 0 | 0 | 112 | M452 N453 A454 D459 I460 | M452-L456 HydrophobicContact CG-CD1 4.34Å; M452-L456 WeakPolarHBondContact O-CG 3.35Å; M452-L456 PolarHBondContact O-N 2.76Å; N453-L456 PolarHBondContact O-N 3.47Å; A454-L456 PolarHBondContact O-N 3.25Å; L456-D459 PolarHBondContact O-N 3.04Å; L456-I460 WeakPolarHBondContact O-CD1 3.19Å; L456-I460 VanDerWaalsContact O-CG1 3.29Å; L456-I460 WeakPolarHBondContact O-CG1 3.39Å; L456-I460 PolarHBondContact O-N 3.49Å; L456-I460 VanDerWaalsContact O-N 3.12Å |
| 457 | G | 97.7 | Very high | 97.2 | Very high | 29 Ų | 29 | 101.4 Ų | 101.4 | 30% | 0.299 | 50% | 0.496 | S | S | . | . | H | α-helix | trans | -59.3 | -49 | 171.1 | 0 | 0 | 0 | 0 | 0 | 112.3 | N453 A454 K455 D459 I460 E461 | N453-G457 PolarHBondContact O-N 3.14Å; A454-G457 PolarHBondContact O-N 3.48Å; K455-G457 VanDerWaalsContact C-N 3.34Å; G457-D459 PolarHBondContact O-N 2.84Å; G457-I460 WeakPolarHBondContact O-CB 3.28Å; G457-I460 PolarHBondContact O-N 3.49Å; G457-I460 VanDerWaalsContact O-N 3.17Å; G457-E461 PolarHBondContact O-N 3.47Å |
| 458 | L | 97.6 | Very high | 96.9 | Very high | 96 Ų | 96 | 102.4 Ų | 102.4 | 50% | 0.503 | 50% | 0.504 | S | S | . | . | H | α-helix | trans | -63.4 | -37.2 | 177.4 | -69 | 171.9 | 0 | 0 | 0 | 113 | A454 K455 I460 E461 I462 | A454-L458 WeakPolarHBondContact O-CG 3.44Å; A454-L458 PolarHBondContact O-N 3.4Å; K455-L458 PolarHBondContact O-N 3.34Å; L458-I460 VanDerWaalsContact C-N 3.33Å; L458-I460 PolarHBondContact O-N 3.44Å; L458-E461 PolarHBondContact O-N 2.81Å; L458-I462 WeakPolarHBondContact O-CB 3.4Å; L458-I462 WeakPolarHBondContact O-CD1 3.22Å; L458-I462 VanDerWaalsContact O-CG1 3.23Å; L458-I462 WeakPolarHBondContact O-CG1 3.19Å; L458-I462 PolarHBondContact O-N 3.4Å |
| 459 | D | 97.4 | Very high | 96.5 | Very high | 66 Ų | 66 | 99.9 Ų | 99.9 | 35% | 0.353 | 50% | 0.5 | S | S | . | . | H | α-helix | trans | -61.5 | -42 | 173.4 | -71.2 | -29.1 | 0 | 0 | 0 | 111.5 | K455 L456 G457 I462 A463 | K455-D459 WeakPolarHBondContact CD-OD2 3.41Å; K455-D459 WeakPolarHBondContact CE-OD1 3.41Å; K455-D459 WeakPolarHBondContact CE-OD2 3.28Å; K455-D459 IonicContact NZ-OD1 2.79Å; K455-D459 PolarHBondContact NZ-OD1 3.25Å; K455-D459 IonicContact NZ-OD2 3.97Å; K455-D459 PolarHBondContact NZ-OD2 2.84Å; K455-D459 PolarHBondContact O-N 2.94Å; L456-D459 PolarHBondContact O-N 3.04Å; G457-D459 PolarHBondContact O-N 2.84Å; D459-I462 PolarHBondContact O-N 3.16Å; D459-A463 WeakPolarHBondContact O-CB 3.34Å; D459-A463 PolarHBondContact O-N 2.77Å |
| 460 | I | 97.2 | Very high | 95.9 | Very high | 114 Ų | 114 | 99.8 Ų | 99.8 | 59% | 0.585 | 50% | 0.5 | S | S | * | . | H | α-helix | trans | -64 | -47 | 176.6 | -67.6 | 163.3 | 0 | 0 | 0 | 109.7 | L456 G457 L458 I462 A463 T464 | L456-I460 WeakPolarHBondContact O-CD1 3.19Å; L456-I460 VanDerWaalsContact O-CG1 3.29Å; L456-I460 WeakPolarHBondContact O-CG1 3.39Å; L456-I460 PolarHBondContact O-N 3.49Å; L456-I460 VanDerWaalsContact O-N 3.12Å; G457-I460 WeakPolarHBondContact O-CB 3.28Å; G457-I460 PolarHBondContact O-N 3.49Å; G457-I460 VanDerWaalsContact O-N 3.17Å; L458-I460 VanDerWaalsContact C-N 3.33Å; L458-I460 PolarHBondContact O-N 3.44Å; I460-I462 PolarHBondContact O-N 3.32Å; I460-A463 PolarHBondContact O-N 3.1Å; I460-T464 HydrophobicContact CG2-CG2 4.5Å; I460-T464 WeakPolarHBondContact O-CG2 3.13Å; I460-T464 PolarHBondContact O-N 3.18Å; I460-T464 PolarHBondContact O-OG1 3.38Å |
| 461 | E | 97.6 | Very high | 94.9 | Very high | 95 Ų | 95 | 95.8 Ų | 95.8 | 44% | 0.444 | 49% | 0.491 | S | S | . | . | H | α-helix | trans | -56.1 | -51.3 | 175 | -74 | 179.6 | -159.5 | 0 | 0 | 111.3 | G457 L458 A463 T464 Y465 | G457-E461 PolarHBondContact O-N 3.47Å; L458-E461 PolarHBondContact O-N 2.81Å; E461-A463 VanDerWaalsContact C-N 3.3Å; E461-A463 PolarHBondContact O-N 2.9Å; E461-T464 WeakPolarHBondContact CA-OG1 3.48Å; E461-T464 PolarHBondContact O-N 3.49Å; E461-T464 PolarHBondContact O-OG1 3.3Å; E461-Y465 HydrophobicContact CB-CD2 4.31Å; E461-Y465 HydrophobicContact CB-CE2 4Å; E461-Y465 WeakPolarHBondContact O-CD2 3.39Å; E461-Y465 PolarHBondContact O-N 2.79Å |
| 462 | I | 96.1 | Very high | 93.6 | Very high | 79 Ų | 79 | 94.6 Ų | 94.6 | 41% | 0.405 | 48% | 0.482 | S | S | . | . | H | α-helix | trans | -57.5 | -42 | 177.2 | -69.5 | 164.6 | 0 | 0 | 0 | 111.4 | L458 D459 I460 Y465 R466 | L458-I462 WeakPolarHBondContact O-CB 3.4Å; L458-I462 WeakPolarHBondContact O-CD1 3.22Å; L458-I462 VanDerWaalsContact O-CG1 3.23Å; L458-I462 WeakPolarHBondContact O-CG1 3.19Å; L458-I462 PolarHBondContact O-N 3.4Å; D459-I462 PolarHBondContact O-N 3.16Å; I460-I462 PolarHBondContact O-N 3.32Å; I462-Y465 PolarHBondContact O-N 2.81Å; I462-R466 WeakPolarHBondContact O-CB 3.49Å; I462-R466 WeakPolarHBondContact O-CG 3.44Å; I462-R466 PolarHBondContact O-N 3.14Å |
| 463 | A | 96.3 | Very high | 92.1 | Very high | 56 Ų | 56 | 95.6 Ų | 95.6 | 46% | 0.463 | 49% | 0.485 | S | S | . | . | H | α-helix | trans | -65.1 | -38 | 176.1 | 0 | 0 | 0 | 0 | 0 | 112.3 | D459 I460 E461 R467 | D459-A463 WeakPolarHBondContact O-CB 3.34Å; D459-A463 PolarHBondContact O-N 2.77Å; I460-A463 PolarHBondContact O-N 3.1Å; E461-A463 VanDerWaalsContact C-N 3.3Å; E461-A463 PolarHBondContact O-N 2.9Å; A463-R467 PolarHBondContact O-N 3.13Å; A463-R467 VanDerWaalsContact O-N 3.1Å |
| 464 | T | 95.3 | Very high | 90.2 | Very high | 64 Ų | 64 | 95.2 Ų | 95.2 | 39% | 0.393 | 49% | 0.49 | S | S | . | . | H | α-helix | trans | -69.2 | -42.3 | 174.8 | 60.7 | 0 | 0 | 0 | 0 | 112.5 | I460 E461 R466 R467 L468 | I460-T464 HydrophobicContact CG2-CG2 4.5Å; I460-T464 WeakPolarHBondContact O-CG2 3.13Å; I460-T464 PolarHBondContact O-N 3.18Å; I460-T464 PolarHBondContact O-OG1 3.38Å; E461-T464 WeakPolarHBondContact CA-OG1 3.48Å; E461-T464 PolarHBondContact O-N 3.49Å; E461-T464 PolarHBondContact O-OG1 3.3Å; T464-R466 PolarHBondContact O-N 2.99Å; T464-R467 PolarHBondContact O-N 3.47Å; T464-L468 WeakPolarHBondContact O-CG 3.39Å; T464-L468 PolarHBondContact O-N 3.21Å |
| 465 | Y | 97.2 | Very high | 88.5 | Confident | 142 Ų | 142 | 101 Ų | 101 | 56% | 0.557 | 50% | 0.5 | S | S | * | . | H | α-helix | trans | -62.2 | -41.9 | 175.3 | -70.8 | -57.3 | 0 | 0 | 0 | 111.8 | E461 I462 L468 L469 | E461-Y465 HydrophobicContact CB-CD2 4.31Å; E461-Y465 HydrophobicContact CB-CE2 4Å; E461-Y465 WeakPolarHBondContact O-CD2 3.39Å; E461-Y465 PolarHBondContact O-N 2.79Å; I462-Y465 PolarHBondContact O-N 2.81Å; Y465-L468 PolarHBondContact O-N 3.05Å; Y465-L469 WeakPolarHBondContact O-CG 3.47Å; Y465-L469 PolarHBondContact O-N 3.17Å |
| 466 | R | 94.7 | Very high | 86.5 | Confident | 159 Ų | 159 | 100.9 Ų | 100.9 | 60% | 0.6 | 50% | 0.504 | S | S | * | . | H | α-helix | trans | -58.8 | -49.5 | 173.2 | -75.9 | 176 | -177.5 | 168.9 | 3.1 | 111.8 | I462 T464 L468 L469 E470 | I462-R466 WeakPolarHBondContact O-CB 3.49Å; I462-R466 WeakPolarHBondContact O-CG 3.44Å; I462-R466 PolarHBondContact O-N 3.14Å; T464-R466 PolarHBondContact O-N 2.99Å; R466-L468 VanDerWaalsContact C-N 3.3Å; R466-L468 PolarHBondContact O-N 2.89Å; R466-L469 PolarHBondContact O-N 3.18Å; R466-L469 VanDerWaalsContact O-N 3.14Å; R466-E470 WeakPolarHBondContact O-CB 3.36Å; R466-E470 VanDerWaalsContact O-CG 3.27Å; R466-E470 WeakPolarHBondContact O-CG 3.37Å; R466-E470 PolarHBondContact O-N 3.46Å |
| 467 | R | 93.1 | Very high | 84.3 | Confident | 191 Ų | 191 | 102 Ų | 102 | 72% | 0.721 | 52% | 0.518 | S | S | * | . | H | α-helix | trans | -60.3 | -37 | 178.1 | -176.3 | -179.8 | -69.5 | 169.9 | -1.7 | 113.1 | A463 T464 G471 | A463-R467 PolarHBondContact O-N 3.13Å; A463-R467 VanDerWaalsContact O-N 3.1Å; T464-R467 PolarHBondContact O-N 3.47Å; R467-G471 PolarHBondContact O-N 3.17Å; R467-G471 VanDerWaalsContact O-N 3.11Å |
| 468 | L | 92.8 | Very high | 82.1 | Confident | 121 Ų | 121 | 109.4 Ų | 109.4 | 63% | 0.634 | 55% | 0.545 | S | S | * | . | H | α-helix | trans | -68 | -41.5 | 175.5 | -72 | 171.4 | 0 | 0 | 0 | 111.8 | T464 Y465 R466 G471 E472 | T464-L468 WeakPolarHBondContact O-CG 3.39Å; T464-L468 PolarHBondContact O-N 3.21Å; Y465-L468 PolarHBondContact O-N 3.05Å; R466-L468 VanDerWaalsContact C-N 3.3Å; R466-L468 PolarHBondContact O-N 2.89Å; L468-G471 PolarHBondContact O-N 2.86Å; L468-E472 PolarHBondContact O-N 3.3Å |
| 469 | L | 89.9 | Confident | 79.9 | Confident | 107 Ų | 107 | 107.8 Ų | 107.8 | 56% | 0.56 | 55% | 0.551 | S | S | * | * | H | α-helix | trans | -65.8 | -44.7 | 175.8 | -71.7 | 166.2 | 0 | 0 | 0 | 111.9 | Y465 R466 G471 E472 E473 | Y465-L469 WeakPolarHBondContact O-CG 3.47Å; Y465-L469 PolarHBondContact O-N 3.17Å; R466-L469 PolarHBondContact O-N 3.18Å; R466-L469 VanDerWaalsContact O-N 3.14Å; L469-G471 PolarHBondContact O-N 3.22Å; L469-E472 PolarHBondContact O-N 3.06Å; L469-E473 WeakPolarHBondContact O-CG 3.45Å; L469-E473 PolarHBondContact O-N 3.14Å |
| 470 | E | 85.4 | Confident | 77.6 | Confident | 107 Ų | 107 | 109.6 Ų | 109.6 | 50% | 0.5 | 56% | 0.564 | S | S | . | * | H | α-helix | trans | -55.8 | -36.7 | 172.5 | -71.1 | 159.7 | -163.7 | 0 | 0 | 111.5 | R466 S474 | R466-E470 WeakPolarHBondContact O-CB 3.36Å; R466-E470 VanDerWaalsContact O-CG 3.27Å; R466-E470 WeakPolarHBondContact O-CG 3.37Å; R466-E470 PolarHBondContact O-N 3.46Å; E470-S474 WeakPolarHBondContact O-CB 3.36Å; E470-S474 PolarHBondContact O-N 2.8Å; E470-S474 PolarHBondContact O-OG 3.31Å |
| 471 | G | 77.3 | Confident | 75.4 | Confident | 35 Ų | 35 | 106.7 Ų | 106.7 | 36% | 0.361 | 56% | 0.563 | S | S | . | * | H | α-helix | trans | -68.3 | -37.8 | 173.9 | 0 | 0 | 0 | 0 | 0 | 114.3 | R467 L468 L469 S474 R475 | R467-G471 PolarHBondContact O-N 3.17Å; R467-G471 VanDerWaalsContact O-N 3.11Å; L468-G471 PolarHBondContact O-N 2.86Å; L469-G471 PolarHBondContact O-N 3.22Å; G471-S474 WeakPolarHBondContact O-CB 3.39Å; G471-R475 WeakPolarHBondContact O-CG 3.46Å; G471-R475 PolarHBondContact O-N 2.96Å |
| 472 | E | 70.9 | Confident | 73.1 | Confident | 90 Ų | 90 | 109 Ų | 109 | 42% | 0.421 | 59% | 0.586 | S | S | . | * | H | α-helix | trans | -73.5 | -40.2 | 173.8 | -77.9 | -64.2 | 117.1 | 0 | 0 | 112.3 | L468 L469 S474 R475 L476 | L468-E472 PolarHBondContact O-N 3.3Å; L469-E472 PolarHBondContact O-N 3.06Å; E472-S474 VanDerWaalsContact C-N 3.26Å; E472-S474 PolarHBondContact O-N 2.83Å; E472-R475 WeakPolarHBondContact O-CB 3.48Å; E472-R475 PolarHBondContact O-N 3.14Å; E472-R475 WeakPolarHBondContact OE1-CD 3.45Å; E472-R475 IonicContact OE1-CZ 2.77Å; E472-R475 IonicContact OE1-NE 3.24Å; E472-R475 IonicContact OE1-NH1 3.85Å; E472-R475 PolarHBondContact OE1-NH1 3.39Å; E472-R475 IonicContact OE2-NH1 2.64Å; E472-L476 WeakPolarHBondContact O-CG 3.45Å; E472-L476 PolarHBondContact O-N 3.21Å |
| 473 | E | 64.9 | Low | 70.6 | Confident | 123 Ų | 123 | 110.6 Ų | 110.6 | 58% | 0.575 | 60% | 0.599 | S | S | * | * | H | α-helix | trans | -58.8 | -39.7 | 173.1 | -73.1 | 178 | -179.3 | 0 | 0 | 111 | L469 R475 L476 C477 | L469-E473 WeakPolarHBondContact O-CG 3.45Å; L469-E473 PolarHBondContact O-N 3.14Å; E473-R475 VanDerWaalsContact C-N 3.3Å; E473-R475 PolarHBondContact O-N 3.33Å; E473-L476 PolarHBondContact O-N 3.12Å; E473-C477 WeakPolarHBondContact O-CB 3.33Å; E473-C477 PolarHBondContact O-N 2.96Å |
| 474 | S | 59.3 | Low | 68.3 | Low | 81 Ų | 81 | 116 Ų | 116 | 57% | 0.566 | 62% | 0.62 | S | S | * | * | H | α-helix | trans | -58.2 | -39.4 | 172.7 | -59.1 | 0 | 0 | 0 | 0 | 112.6 | E470 G471 E472 | E470-S474 WeakPolarHBondContact O-CB 3.36Å; E470-S474 PolarHBondContact O-N 2.8Å; E470-S474 PolarHBondContact O-OG 3.31Å; G471-S474 WeakPolarHBondContact O-CB 3.39Å; E472-S474 VanDerWaalsContact C-N 3.26Å; E472-S474 PolarHBondContact O-N 2.83Å |
| 475 | R | 62.5 | Low | 65.9 | Low | 173 Ų | 173 | 119.2 Ų | 119.2 | 65% | 0.653 | 63% | 0.633 | S | S | * | * | H | α-helix | trans | -74.8 | -30.2 | 178 | -65.3 | 173.2 | 68.6 | -153.3 | -2.8 | 113 | G471 E472 E473 | G471-R475 WeakPolarHBondContact O-CG 3.46Å; G471-R475 PolarHBondContact O-N 2.96Å; E472-R475 WeakPolarHBondContact O-CB 3.48Å; E472-R475 PolarHBondContact O-N 3.14Å; E472-R475 WeakPolarHBondContact OE1-CD 3.45Å; E472-R475 IonicContact OE1-CZ 2.77Å; E472-R475 IonicContact OE1-NE 3.24Å; E472-R475 IonicContact OE1-NH1 3.85Å; E472-R475 PolarHBondContact OE1-NH1 3.39Å; E472-R475 IonicContact OE2-NH1 2.64Å; E473-R475 VanDerWaalsContact C-N 3.3Å; E473-R475 PolarHBondContact O-N 3.33Å |
| 476 | L | 55.1 | Low | 63.5 | Low | 105 Ų | 105 | 118.2 Ų | 118.2 | 55% | 0.55 | 65% | 0.647 | S | S | . | * | H | α-helix | trans | -80.7 | -38.4 | 179.9 | -70.6 | 166.4 | 0 | 0 | 0 | 112.1 | E472 E473 E478 G479 V480 | E472-L476 WeakPolarHBondContact O-CG 3.45Å; E472-L476 PolarHBondContact O-N 3.21Å; E473-L476 PolarHBondContact O-N 3.12Å; L476-E478 VanDerWaalsContact C-N 3.28Å; L476-E478 PolarHBondContact O-N 2.92Å; L476-G479 PolarHBondContact O-N 2.81Å; L476-G479 VanDerWaalsContact O-N 3.12Å; L476-V480 PolarHBondContact O-N 2.91Å |
| 477 | C | 52 | Low | 60.9 | Low | 110 Ų | 110 | 116.4 Ų | 116.4 | 74% | 0.743 | 65% | 0.654 | S | S | * | * | H | α-helix | trans | -67.3 | -22.3 | 178 | -82.8 | 0 | 0 | 0 | 0 | 114.4 | E473 G479 | E473-C477 WeakPolarHBondContact O-CB 3.33Å; E473-C477 PolarHBondContact O-N 2.96Å; C477-G479 VanDerWaalsContact C-N 3.32Å |
| 478 | E | 51 | Low | 58.6 | Low | 184 Ų | 184 | 113.3 Ų | 113.3 | 86% | 0.86 | 66% | 0.661 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -83.1 | -8.3 | 174.3 | -155.5 | 166.7 | -146.5 | 0 | 0 | 112.7 | L476 | L476-E478 VanDerWaalsContact C-N 3.28Å; L476-E478 PolarHBondContact O-N 2.92Å |
| 479 | G | 52.6 | Low | 56.1 | Low | 61 Ų | 61 | 112.8 Ų | 112.8 | 63% | 0.629 | 67% | 0.668 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -123.4 | -22.2 | -172.5 | 0 | 0 | 0 | 0 | 0 | 117.6 | L476 C477 | L476-G479 PolarHBondContact O-N 2.81Å; L476-G479 VanDerWaalsContact O-N 3.12Å; C477-G479 VanDerWaalsContact C-N 3.32Å |
| 480 | V | 48 | Very low | 54.1 | Low | 105 Ų | 105 | 112.8 Ų | 112.8 | 64% | 0.636 | 68% | 0.677 | S | S | * | * | trans | -137.3 | 128.1 | -173.4 | -174.1 | 0 | 0 | 0 | 0 | 112.3 | L476 | L476-V480 PolarHBondContact O-N 2.91Š| ||
| 481 | G | 51.6 | Low | 52 | Low | 53 Ų | 53 | 119 Ų | 119 | 55% | 0.546 | 70% | 0.696 | S | S | . | * | trans | -67.9 | 164.7 | 177 | 0 | 0 | 0 | 0 | 0 | 114.1 | V483 | G481-V483 PolarHBondContact O-N 2.79Å; G481-V483 VanDerWaalsContact O-N 3.16Å | ||
| 482 | P | 48.6 | Very low | 50.5 | Low | 144 Ų | 144 | 121.3 Ų | 121.3 | 94% | 0.935 | 72% | 0.719 | S | S | * | * | trans | -69.7 | 112.6 | -164.9 | 27.2 | -35.3 | 0 | 0 | 0 | 113.2 | ||||
| 483 | V | 45.1 | Very low | 49.1 | Very low | 112 Ų | 112 | 120.2 Ų | 120.2 | 68% | 0.679 | 73% | 0.732 | S | S | * | * | trans | -95.6 | 108.4 | 170.1 | -174.9 | 0 | 0 | 0 | 0 | 109.3 | G481 I485 | G481-V483 PolarHBondContact O-N 2.79Å; G481-V483 VanDerWaalsContact O-N 3.16Å; V483-I485 HydrophobicContact CG1-CD1 4.19Å; V483-I485 HydrophobicContact CG1-CG1 3.88Å; V483-I485 PolarHBondContact O-N 2.83Å | ||
| 484 | N | 48.1 | Very low | 47.6 | Very low | 170 Ų | 170 | 123 Ų | 123 | 91% | 0.909 | 75% | 0.75 | S | S | * | * | trans | -70 | 113.1 | 172.4 | -107 | -27.5 | 0 | 0 | 0 | 110 | ||||
| 485 | I | 44.3 | Very low | 46.4 | Very low | 130 Ų | 130 | 127 Ų | 127 | 67% | 0.667 | 76% | 0.764 | S | S | * | * | trans | -122.9 | 101.8 | 168.8 | -50.6 | -175.5 | 0 | 0 | 0 | 109 | V483 V487 | V483-I485 HydrophobicContact CG1-CD1 4.19Å; V483-I485 HydrophobicContact CG1-CG1 3.88Å; V483-I485 PolarHBondContact O-N 2.83Å; I485-V487 HydrophobicContact CG2-CG2 3.9Å; I485-V487 PolarHBondContact O-N 3.1Å | ||
| 486 | S | 47.3 | Very low | 44.9 | Very low | 122 Ų | 122 | 125.4 Ų | 125.4 | 85% | 0.853 | 78% | 0.778 | S | S | * | * | trans | -76.4 | 103.7 | 171.6 | 54.2 | 0 | 0 | 0 | 0 | 110.2 | ||||
| 487 | V | 39 | Very low | 44.2 | Very low | 121 Ų | 121 | 123.4 Ų | 123.4 | 73% | 0.733 | 78% | 0.783 | S | S | * | * | trans | -105.9 | 113.3 | 168.6 | -176.6 | 0 | 0 | 0 | 0 | 109.6 | I485 S489 | I485-V487 HydrophobicContact CG2-CG2 3.9Å; I485-V487 PolarHBondContact O-N 3.1Å; V487-S489 PolarHBondContact O-N 2.89Å | ||
| 488 | S | 45.8 | Very low | 44 | Very low | 125 Ų | 125 | 124.3 Ų | 124.3 | 87% | 0.874 | 79% | 0.787 | S | S | * | * | trans | -65.6 | 118.1 | 168.8 | -59.5 | 0 | 0 | 0 | 0 | 110.2 | ||||
| 489 | S | 39.7 | Very low | 43.5 | Very low | 110 Ų | 110 | 123.5 Ų | 123.5 | 77% | 0.769 | 78% | 0.783 | S | S | * | * | trans | -145.1 | 148.5 | 157.5 | -166.5 | 0 | 0 | 0 | 0 | 111 | V487 | V487-S489 PolarHBondContact O-N 2.89Š| ||
| 490 | S | 48 | Very low | 43.9 | Very low | 107 Ų | 107 | 125.2 Ų | 125.2 | 75% | 0.748 | 78% | 0.784 | S | S | * | * | trans | -68.4 | 146.3 | -172.2 | 54.4 | 0 | 0 | 0 | 0 | 112.7 | ||||
| 491 | R | 41.2 | Very low | 43.3 | Very low | 238 Ų | 238 | 127.1 Ų | 127.1 | 90% | 0.898 | 79% | 0.789 | S | S | * | * | trans | -154.2 | 112.9 | 148.3 | -117.6 | 167.5 | -179 | 170.8 | 0.6 | 111.4 | G493 | R491-G493 PolarHBondContact O-N 2.9Š| ||
| 492 | G | 45 | Very low | 42.4 | Very low | 83 Ų | 83 | 130.6 Ų | 130.6 | 86% | 0.856 | 80% | 0.8 | S | S | * | * | trans | -62.7 | 120.3 | 141.7 | 0 | 0 | 0 | 0 | 0 | 106.7 | ||||
| 493 | G | 41.7 | Very low | 41.5 | Very low | 67 Ų | 67 | 128.6 Ų | 128.6 | 69% | 0.691 | 80% | 0.795 | S | S | * | * | trans | -116 | 119.5 | -177.5 | 0 | 0 | 0 | 0 | 0 | 110.8 | R491 | R491-G493 PolarHBondContact O-N 2.9Š| ||
| 494 | L | 33.5 | Very low | 41 | Very low | 182 Ų | 182 | 128.3 Ų | 128.3 | 95% | 0.953 | 80% | 0.798 | S | S | * | * | trans | -105.4 | 110.5 | 150.5 | -101.1 | 162.3 | 0 | 0 | 0 | 106.6 | ||||
| 495 | L | 34.2 | Very low | 40.4 | Very low | 164 Ų | 164 | 125.4 Ų | 125.4 | 86% | 0.859 | 79% | 0.791 | S | S | * | * | trans | -84.8 | 140.6 | 171.6 | -88.9 | 160 | 0 | 0 | 0 | 109.2 | ||||
| 496 | C | 31.8 | Very low | 39.8 | Very low | 140 Ų | 140 | 124.8 Ų | 124.8 | 95% | 0.946 | 79% | 0.794 | S | S | * | * | trans | -144.1 | 141.3 | 154.7 | -150.3 | 0 | 0 | 0 | 0 | 110 | ||||
| 497 | G | 39.3 | Very low | 39 | Very low | 63 Ų | 63 | 126.2 Ų | 126.2 | 65% | 0.649 | 79% | 0.791 | S | S | * | * | trans | 112 | 155.3 | -176 | 0 | 0 | 0 | 0 | 0 | 113.3 | ||||
| 498 | P | 49.3 | Very low | 38.7 | Very low | 129 Ų | 129 | 125.5 Ų | 125.5 | 84% | 0.838 | 79% | 0.791 | S | S | * | * | cis | -129.2 | 169.4 | 8.2 | 42.2 | -27 | 0 | 0 | 0 | 115.9 | ||||
| 499 | E | 40.2 | Very low | 38.2 | Very low | 168 Ų | 168 | 130.2 Ų | 130.2 | 79% | 0.785 | 79% | 0.79 | S | S | * | * | trans | -59.7 | 178.5 | 149.3 | -83.1 | -84.7 | 143.8 | 0 | 0 | 111.1 | ||||
| 500 | P | 60.1 | Low | 37.8 | Very low | 97 Ų | 97 | 130.5 Ų | 130.5 | 63% | 0.63 | 79% | 0.792 | S | S | * | * | cis | -142.6 | -177.9 | 14.6 | 25.8 | 1.4 | 0 | 0 | 0 | 117.1 | ||||
| 501 | L | 35.6 | Very low | 37 | Very low | 144 Ų | 144 | 128.5 Ų | 128.5 | 75% | 0.754 | 79% | 0.788 | S | S | * | * | 146.9 | 110.4 | 120.8 | -75.9 | 176.9 | 0 | 0 | 0 | 116.8 | |||||
| 502 | V | 33.3 | Very low | 36.6 | Very low | 127 Ų | 127 | 123 Ų | 123 | 77% | 0.77 | 78% | 0.781 | S | S | * | * | 43.7 | 118.2 | 129.4 | -172.6 | 0 | 0 | 0 | 0 | 121.6 | |||||
| 503 | A | 29.1 | Very low | 36 | Very low | 102 Ų | 102 | 124.3 Ų | 124.3 | 84% | 0.843 | 77% | 0.772 | S | S | * | * | trans | -156.3 | 155.1 | 132.8 | 0 | 0 | 0 | 0 | 0 | 110.9 | ||||
| 504 | S | 34.5 | Very low | 35.5 | Very low | 106 Ų | 106 | 129.2 Ų | 129.2 | 74% | 0.741 | 78% | 0.775 | S | S | * | * | trans | -119.1 | -178.8 | -161 | -53.7 | 0 | 0 | 0 | 0 | 116 | ||||
| 505 | S | 34.8 | Very low | 35.4 | Very low | 108 Ų | 108 | 126.4 Ų | 126.4 | 76% | 0.755 | 77% | 0.77 | S | S | * | * | trans | 93.6 | 146.7 | 153.7 | 84.8 | 0 | 0 | 0 | 0 | 117.6 | ||||
| 506 | T | 31.7 | Very low | 35.1 | Very low | 118 Ų | 118 | 121.6 Ų | 121.6 | 72% | 0.724 | 76% | 0.761 | S | S | * | * | cis | -169.1 | 177 | -10.2 | 18.2 | 0 | 0 | 0 | 0 | 111.2 | ||||
| 507 | L | 31.4 | Very low | 35 | Very low | 152 Ų | 152 | 120.3 Ų | 120.3 | 80% | 0.796 | 75% | 0.753 | S | S | * | * | trans | 83.2 | 112.6 | 161.7 | -63.6 | 145.9 | 0 | 0 | 0 | 116.6 | ||||
| 508 | S | 32.8 | Very low | 34.8 | Very low | 106 Ų | 106 | 123.2 Ų | 123.2 | 74% | 0.741 | 76% | 0.763 | S | S | * | * | 86.6 | 147.9 | 76.9 | -73.2 | 0 | 0 | 0 | 0 | 113.4 | |||||
| 509 | R | 35.3 | Very low | 33.9 | Very low | 223 Ų | 223 | 122.9 Ų | 122.9 | 84% | 0.842 | 76% | 0.764 | S | S | * | * | cis | 170.1 | 147.7 | -10.2 | 163.7 | 177.2 | 161.1 | -177.3 | -5.2 | 105.7 | ||||
| 510 | S | 32.1 | Very low | 33.6 | Very low | 117 Ų | 117 | 121.7 Ų | 121.7 | 82% | 0.818 | 77% | 0.768 | S | S | * | * | trans | 73.9 | 142.8 | 176.3 | -53.9 | 0 | 0 | 0 | 0 | 116.8 | ||||
| 511 | G | 29.7 | Very low | 32.5 | Very low | 64 Ų | 64 | 123 Ų | 123 | 66% | 0.66 | 78% | 0.778 | S | S | * | * | cis | -160.5 | 145.8 | -7.1 | 0 | 0 | 0 | 0 | 0 | 110.9 | ||||
| 512 | V | 33.8 | Very low | 32.2 | Very low | 124 Ų | 124 | 120.1 Ų | 120.1 | 75% | 0.752 | 78% | 0.775 | S | S | * | * | 50.1 | 116.7 | 104.1 | -161.1 | 0 | 0 | 0 | 0 | 112.8 | F514 | V512-F514 HydrophobicContact CG1-CD1 4.33Å; V512-F514 HydrophobicContact CG1-CE1 3.46Å; V512-F514 VanDerWaalsContact CG1-CE1 3.46Å; V512-F514 HydrophobicContact CG1-CZ 3.72Å | |||
| 513 | T | 31.2 | Very low | 32.1 | Very low | 110 Ų | 110 | 120.6 Ų | 120.6 | 68% | 0.675 | 78% | 0.778 | S | S | * | * | -160.1 | 134.4 | 83.7 | 50.8 | 0 | 0 | 0 | 0 | 116 | |||||
| 514 | F | 31.9 | Very low | 32.1 | Very low | 170 Ų | 170 | 121.7 Ų | 121.7 | 75% | 0.746 | 78% | 0.78 | S | S | * | * | trans | 20.8 | 151.2 | 141.9 | -8.6 | -66.7 | 0 | 0 | 0 | 121.7 | V512 | V512-F514 HydrophobicContact CG1-CD1 4.33Å; V512-F514 HydrophobicContact CG1-CE1 3.46Å; V512-F514 VanDerWaalsContact CG1-CE1 3.46Å; V512-F514 HydrophobicContact CG1-CZ 3.72Å | ||
| 515 | S | 31.7 | Very low | 32 | Very low | 122 Ų | 122 | 120.2 Ų | 120.2 | 85% | 0.853 | 78% | 0.782 | S | S | * | * | cis | -156.4 | 168.7 | 20.4 | -62.9 | 0 | 0 | 0 | 0 | 109.7 | ||||
| 516 | G | 28.4 | Very low | 31.7 | Very low | 64 Ų | 64 | 122.4 Ų | 122.4 | 66% | 0.66 | 79% | 0.79 | S | S | * | * | cis | 169.5 | 151.5 | -5.1 | 0 | 0 | 0 | 0 | 0 | 111.5 | ||||
| 517 | S | 30.1 | Very low | 31.7 | Very low | 112 Ų | 112 | 124.7 Ų | 124.7 | 78% | 0.783 | 80% | 0.797 | S | S | * | * | trans | 46.3 | 114.2 | 165.9 | 52.9 | 0 | 0 | 0 | 0 | 119.3 | ||||
| 518 | S | 34.6 | Very low | 31.7 | Very low | 124 Ų | 124 | 122 Ų | 122 | 87% | 0.867 | 80% | 0.796 | S | S | * | * | 69.3 | 115.4 | 52.8 | -49.7 | 0 | 0 | 0 | 0 | 115.7 | |||||
| 519 | S | 30.2 | Very low | 31.5 | Very low | 122 Ų | 122 | 122.1 Ų | 122.1 | 85% | 0.853 | 80% | 0.798 | S | S | * | * | trans | -149 | 140.7 | 140.6 | 63.4 | 0 | 0 | 0 | 0 | 110.4 | ||||
| 520 | V | 32.6 | Very low | 31.1 | Very low | 143 Ų | 143 | 117.9 Ų | 117.9 | 87% | 0.867 | 80% | 0.801 | S | S | * | * | trans | -116 | 156.3 | -177.1 | -179.9 | 0 | 0 | 0 | 0 | 108.9 | ||||
| 521 | C | 37.2 | Very low | 31 | Very low | 125 Ų | 125 | 116 Ų | 116 | 85% | 0.845 | 80% | 0.799 | S | S | * | * | trans | -59.9 | 146.3 | -177.4 | -49.2 | 0 | 0 | 0 | 0 | 115.4 | ||||
| 522 | A | 29.8 | Very low | 32.4 | Very low | 84 Ų | 84 | 118.6 Ų | 118.6 | 69% | 0.694 | 81% | 0.805 | S | S | * | * | trans | -161.3 | 103.7 | 153 | 0 | 0 | 0 | 0 | 0 | 109 | ||||
| 523 | T | 31.3 | Very low | 32.3 | Very low | 136 Ų | 136 | 119.7 Ų | 119.7 | 83% | 0.834 | 81% | 0.807 | S | S | * | * | 86.3 | 145.3 | 96 | 54 | 0 | 0 | 0 | 0 | 117.3 | |||||
| 524 | S | 29.8 | Very low | 32.4 | Very low | 126 Ų | 126 | 122.2 Ų | 122.2 | 88% | 0.881 | 82% | 0.815 | S | S | * | * | trans | 77.8 | 124.7 | 168.4 | -64 | 0 | 0 | 0 | 0 | 118.4 | ||||
| 525 | G | 31.1 | Very low | 32.2 | Very low | 75 Ų | 75 | 118.1 Ų | 118.1 | 77% | 0.773 | 82% | 0.82 | S | S | * | * | trans | -121.7 | 171 | 166.1 | 0 | 0 | 0 | 0 | 0 | 111.4 | ||||
| 526 | V | 30.2 | Very low | 32.1 | Very low | 154 Ų | 154 | 116 Ų | 116 | 93% | 0.933 | 82% | 0.818 | S | S | * | * | trans | -140.7 | 151.3 | 169.6 | 178.5 | 0 | 0 | 0 | 0 | 108.8 | ||||
| 527 | L | 31.1 | Very low | 32.1 | Very low | 165 Ų | 165 | 118.1 Ų | 118.1 | 86% | 0.864 | 83% | 0.83 | S | S | * | * | trans | -83 | 176 | -174.4 | -82.9 | 148 | 0 | 0 | 0 | 114.7 | ||||
| 528 | A | 29.9 | Very low | 32.1 | Very low | 95 Ų | 95 | 121.7 Ų | 121.7 | 79% | 0.785 | 83% | 0.834 | S | S | * | * | trans | 80.2 | 145.6 | 160.7 | 0 | 0 | 0 | 0 | 0 | 117.4 | ||||
| 529 | S | 29.5 | Very low | 31.9 | Very low | 110 Ų | 110 | 122.6 Ų | 122.6 | 77% | 0.769 | 83% | 0.834 | S | S | * | * | cis | -162.8 | 163.5 | -11.3 | 48.2 | 0 | 0 | 0 | 0 | 112.4 | ||||
| 530 | C | 26.8 | Very low | 32 | Very low | 133 Ų | 133 | 121 Ų | 121 | 90% | 0.899 | 83% | 0.828 | S | S | * | * | trans | -15.7 | 146.2 | 161.3 | -46.8 | 0 | 0 | 0 | 0 | 120 | ||||
| 531 | G | 30.9 | Very low | 32.3 | Very low | 77 Ų | 77 | 120.2 Ų | 120.2 | 79% | 0.794 | 83% | 0.826 | S | S | * | * | trans | 150.5 | 130.6 | 148.6 | 0 | 0 | 0 | 0 | 0 | 115.8 | ||||
| 532 | P | 58.2 | Low | 32 | Very low | 119 Ų | 119 | 119 Ų | 119 | 77% | 0.773 | 83% | 0.825 | S | S | * | * | trans | -113.7 | 179.5 | -172.2 | 41.7 | -34 | 0 | 0 | 0 | 115.9 | ||||
| 533 | N | 32.8 | Very low | 32.1 | Very low | 148 Ų | 148 | 121.5 Ų | 121.5 | 79% | 0.791 | 83% | 0.832 | S | S | * | * | trans | 96.7 | 147.3 | 151 | -85.7 | -12.3 | 0 | 0 | 0 | 122.4 | ||||
| 534 | L | 32.4 | Very low | 32.1 | Very low | 163 Ų | 163 | 118.2 Ų | 118.2 | 85% | 0.853 | 83% | 0.825 | S | S | * | * | trans | 77.3 | 90.4 | 155.6 | -71.3 | 154 | 0 | 0 | 0 | 119.7 | ||||
| 535 | G | 28.4 | Very low | 32.1 | Very low | 83 Ų | 83 | 119.3 Ų | 119.3 | 86% | 0.856 | 82% | 0.821 | S | S | * | * | 74.4 | 137.9 | 101 | 0 | 0 | 0 | 0 | 0 | 120.3 | |||||
| 536 | G | 28.8 | Very low | 32 | Very low | 78 Ų | 78 | 122.2 Ų | 122.2 | 80% | 0.804 | 82% | 0.818 | S | S | * | * | trans | 129.2 | 108.6 | 153.3 | 0 | 0 | 0 | 0 | 0 | 117 | ||||
| 537 | A | 29.5 | Very low | 32 | Very low | 109 Ų | 109 | 121.8 Ų | 121.8 | 90% | 0.901 | 81% | 0.81 | S | S | * | * | trans | 59.4 | 144 | 141.9 | 0 | 0 | 0 | 0 | 0 | 122.4 | ||||
| 538 | Q | 29.6 | Very low | 32 | Very low | 187 Ų | 187 | 118.9 Ų | 118.9 | 87% | 0.874 | 80% | 0.803 | S | S | * | * | trans | -53.2 | 148.5 | 170.5 | -49.4 | 167.3 | 13.4 | 0 | 0 | 113.4 | ||||
| 539 | V | 30.4 | Very low | 32 | Very low | 142 Ų | 142 | 120.9 Ų | 120.9 | 86% | 0.861 | 81% | 0.806 | S | S | * | * | -152.5 | 133.4 | 127.4 | 164.6 | 0 | 0 | 0 | 0 | 107.9 | |||||
| 540 | A | 31.4 | Very low | 31.9 | Very low | 90 Ų | 90 | 119 Ų | 119 | 74% | 0.744 | 80% | 0.804 | S | S | * | * | trans | -95 | 155.2 | 165.9 | 0 | 0 | 0 | 0 | 0 | 110.4 | ||||
| 541 | P | 39.2 | Very low | 32.2 | Very low | 125 Ų | 125 | 118.9 Ų | 118.9 | 81% | 0.812 | 80% | 0.8 | S | S | * | * | trans | -118.3 | 128.4 | 151.1 | 32.4 | -21.9 | 0 | 0 | 0 | 111.1 | ||||
| 542 | A | 31.3 | Very low | 32.3 | Very low | 101 Ų | 101 | 126.6 Ų | 126.6 | 84% | 0.835 | 81% | 0.805 | S | S | * | * | trans | -95.8 | 136.5 | 162.2 | 0 | 0 | 0 | 0 | 0 | 109.1 | ||||
| 543 | T | 32.1 | Very low | 31.1 | Very low | 135 Ų | 135 | 126.3 Ų | 126.3 | 83% | 0.828 | 81% | 0.805 | S | S | * | * | trans | -142.7 | 134.2 | 163.5 | 46.9 | 0 | 0 | 0 | 0 | 108.6 | ||||
| 544 | G | 31 | Very low | 31 | Very low | 68 Ų | 68 | 122.9 Ų | 122.9 | 70% | 0.701 | 81% | 0.805 | S | S | * | * | trans | -67.6 | -172.1 | 165.9 | 0 | 0 | 0 | 0 | 0 | 112.1 | ||||
| 545 | D | 29.2 | Very low | 31 | Very low | 149 Ų | 149 | 120.6 Ų | 120.6 | 80% | 0.797 | 80% | 0.803 | S | S | * | * | cis | -166.3 | 167.1 | 20.5 | -137.9 | -21 | 0 | 0 | 0 | 113.2 | ||||
| 546 | L | 30.2 | Very low | 31.1 | Very low | 136 Ų | 136 | 123 Ų | 123 | 71% | 0.712 | 80% | 0.8 | S | S | * | * | trans | 77.2 | 138.3 | 146.3 | -87.3 | 155.6 | 0 | 0 | 0 | 125.5 | ||||
| 547 | L | 29 | Very low | 31.2 | Very low | 145 Ų | 145 | 126 Ų | 126 | 76% | 0.759 | 80% | 0.797 | S | S | * | * | trans | 81.8 | 104.9 | 160.7 | -60.7 | 164 | 0 | 0 | 0 | 118.2 | ||||
| 548 | S | 30.7 | Very low | 31.3 | Very low | 103 Ų | 103 | 129.2 Ų | 129.2 | 72% | 0.72 | 80% | 0.798 | S | S | * | * | 78.4 | 136.1 | 71.2 | -67.3 | 0 | 0 | 0 | 0 | 113.1 | |||||
| 549 | T | 30.3 | Very low | 31.3 | Very low | 137 Ų | 137 | 124.9 Ų | 124.9 | 84% | 0.84 | 79% | 0.788 | S | S | * | * | cis | -157 | 152.3 | 28.9 | 46.2 | 0 | 0 | 0 | 0 | 115 | ||||
| 550 | G | 28.1 | Very low | 31.3 | Very low | 71 Ų | 71 | 128 Ų | 128 | 73% | 0.732 | 79% | 0.793 | S | S | * | * | trans | 84.6 | 150.8 | 146 | 0 | 0 | 0 | 0 | 0 | 119.1 | ||||
| 551 | T | 33.2 | Very low | 31.3 | Very low | 131 Ų | 131 | 128 Ų | 128 | 80% | 0.804 | 79% | 0.794 | S | S | * | * | cis | -165.2 | 143.6 | -2.6 | -29 | 0 | 0 | 0 | 0 | 111.6 | ||||
| 552 | R | 33.4 | Very low | 30.9 | Very low | 238 Ų | 238 | 128.4 Ų | 128.4 | 90% | 0.898 | 80% | 0.798 | S | S | * | * | trans | 59.1 | 141.3 | 159.7 | -85.3 | 171.4 | 165.2 | 179.5 | -6 | 118.1 | ||||
| 553 | S | 32.6 | Very low | 31 | Very low | 113 Ų | 113 | 131.1 Ų | 131.1 | 79% | 0.79 | 80% | 0.797 | S | S | * | * | cis | -149.6 | 165.8 | 2.2 | -70.4 | 0 | 0 | 0 | 0 | 106.8 | ||||
| 554 | G | 30 | Very low | 31.7 | Very low | 77 Ų | 77 | 129.9 Ų | 129.9 | 79% | 0.794 | 79% | 0.791 | S | S | * | * | cis | 136.8 | 84.4 | 5.4 | 0 | 0 | 0 | 0 | 0 | 111.4 | ||||
| 555 | S | 32.6 | Very low | 32 | Very low | 114 Ų | 114 | 132.6 Ų | 132.6 | 80% | 0.797 | 80% | 0.799 | S | S | * | * | trans | -155.8 | 95 | 171.2 | 59.9 | 0 | 0 | 0 | 0 | 114 | ||||
| 556 | V | 30.5 | Very low | 32.4 | Very low | 133 Ų | 133 | 131.6 Ų | 131.6 | 81% | 0.806 | 80% | 0.798 | S | S | * | * | trans | 10.7 | 104.8 | 144.7 | -174.4 | 0 | 0 | 0 | 0 | 116.5 | ||||
| 557 | L | 31.1 | Very low | 33.1 | Very low | 141 Ų | 141 | 130.6 Ų | 130.6 | 74% | 0.738 | 80% | 0.8 | S | S | * | * | 60.9 | 110.1 | 96 | -63.2 | 173.7 | 0 | 0 | 0 | 117.2 | |||||
| 558 | I | 32 | Very low | 33.1 | Very low | 177 Ų | 177 | 129.8 Ų | 129.8 | 91% | 0.908 | 81% | 0.805 | S | S | * | * | -132 | 136 | 124.4 | -67.8 | -171.4 | 0 | 0 | 0 | 107.1 | |||||
| 559 | S | 29.1 | Very low | 33.9 | Very low | 97 Ų | 97 | 130.5 Ų | 130.5 | 68% | 0.678 | 81% | 0.807 | S | S | * | * | trans | -102.3 | 142.7 | -178.7 | -51.7 | 0 | 0 | 0 | 0 | 111 | ||||
| 560 | E | 29.7 | Very low | 34.3 | Very low | 206 Ų | 206 | 132 Ų | 132 | 96% | 0.963 | 81% | 0.809 | S | S | * | * | trans | -147.4 | 150.4 | 145.5 | -138.7 | 167.9 | -170.2 | 0 | 0 | 110.8 | ||||
| 561 | A | 32.2 | Very low | 35.1 | Very low | 92 Ų | 92 | 134.4 Ų | 134.4 | 76% | 0.76 | 81% | 0.812 | S | S | * | * | P | Polyproline II helix | trans | -103.7 | 144.2 | -155 | 0 | 0 | 0 | 0 | 0 | 114.2 | ||
| 562 | C | 29.8 | Very low | 35.2 | Very low | 133 Ų | 133 | 135 Ų | 135 | 90% | 0.899 | 82% | 0.815 | S | S | * | * | P | Polyproline II helix | trans | -77 | 136 | 163.1 | -66.5 | 0 | 0 | 0 | 0 | 111 | ||
| 563 | I | 35.2 | Very low | 35.3 | Very low | 158 Ų | 158 | 133.1 Ų | 133.1 | 81% | 0.81 | 82% | 0.817 | S | S | * | * | P | Polyproline II helix | trans | -103.2 | 139.6 | 167 | -70.1 | -178.6 | 0 | 0 | 0 | 108.1 | ||
| 564 | P | 45.9 | Very low | 35.3 | Very low | 109 Ų | 109 | 131.8 Ų | 131.8 | 71% | 0.708 | 82% | 0.821 | S | S | * | * | P | Polyproline II helix | trans | -85.9 | 153.5 | -162.5 | 33.6 | -37 | 0 | 0 | 0 | 114.3 | ||
| 565 | S | 36.7 | Very low | 35.3 | Very low | 124 Ų | 124 | 132 Ų | 132 | 87% | 0.867 | 82% | 0.823 | S | S | * | * | P | Polyproline II helix | trans | -83.1 | 129.5 | 168.4 | -43.1 | 0 | 0 | 0 | 0 | 110.8 | ||
| 566 | V | 37.3 | Very low | 35.3 | Very low | 129 Ų | 129 | 137 Ų | 137 | 78% | 0.782 | 83% | 0.831 | S | S | * | * | trans | -124.7 | 131.1 | 166.8 | 178.2 | 0 | 0 | 0 | 0 | 108.2 | ||||
| 567 | P | 44.9 | Very low | 35.3 | Very low | 115 Ų | 115 | 136.5 Ų | 136.5 | 75% | 0.747 | 83% | 0.833 | S | S | * | * | trans | -92.5 | 155 | -171.1 | 36.5 | -35.9 | 0 | 0 | 0 | 113.3 | ||||
| 568 | C | 29.8 | Very low | 35.4 | Very low | 128 Ų | 128 | 134.8 Ų | 134.8 | 87% | 0.865 | 83% | 0.833 | S | S | * | * | trans | -154.8 | 163.3 | 167.1 | -105.2 | 0 | 0 | 0 | 0 | 110.6 | ||||
| 569 | P | 46.7 | Very low | 35.4 | Very low | 117 Ų | 117 | 132 Ų | 132 | 76% | 0.76 | 83% | 0.828 | S | S | * | * | -116.5 | 172.2 | -119.8 | 40.5 | -34.8 | 0 | 0 | 0 | 117 | |||||
| 570 | L | 40 | Very low | 35.7 | Very low | 170 Ų | 170 | 133.2 Ų | 133.2 | 89% | 0.89 | 84% | 0.837 | S | S | * | * | P | Polyproline II helix | trans | -57.8 | 145.1 | 165.7 | -71.3 | 160 | 0 | 0 | 0 | 112.8 | ||
| 571 | P | 43.9 | Very low | 35.7 | Very low | 120 Ų | 120 | 127.5 Ų | 127.5 | 78% | 0.779 | 83% | 0.833 | S | S | * | * | P | Polyproline II helix | trans | -103.9 | 144.2 | 154 | 34.3 | -27 | 0 | 0 | 0 | 112.6 | ||
| 572 | T | 35 | Very low | 35.7 | Very low | 144 Ų | 144 | 126.6 Ų | 126.6 | 88% | 0.883 | 83% | 0.833 | S | S | * | * | P | Polyproline II helix | trans | -83.7 | 166.2 | -175.3 | -14.2 | 0 | 0 | 0 | 0 | 113.4 | ||
| 573 | Q | 37.2 | Very low | 36 | Very low | 198 Ų | 198 | 132.2 Ų | 132.2 | 93% | 0.925 | 84% | 0.835 | S | S | * | * | P | Polyproline II helix | trans | -67 | 148.2 | 174.8 | -71.4 | -177.6 | -12.2 | 0 | 0 | 114.2 | ||
| 574 | G | 32.6 | Very low | 35.9 | Very low | 85 Ų | 85 | 130.5 Ų | 130.5 | 88% | 0.876 | 84% | 0.837 | S | S | * | * | 114.6 | 130.6 | 128.6 | 0 | 0 | 0 | 0 | 0 | 117.9 | |||||
| 575 | G | 29.8 | Very low | 35.5 | Very low | 82 Ų | 82 | 130.5 Ų | 130.5 | 85% | 0.845 | 84% | 0.839 | S | S | * | * | trans | 141 | 100.9 | 161 | 0 | 0 | 0 | 0 | 0 | 115.3 | ||||
| 576 | F | 31.4 | Very low | 35.3 | Very low | 218 Ų | 218 | 129.5 Ų | 129.5 | 96% | 0.956 | 83% | 0.832 | S | S | * | * | trans | -79.9 | 142.2 | 166.5 | -72.3 | -93.9 | 0 | 0 | 0 | 111.1 | ||||
| 577 | S | 30.5 | Very low | 35.2 | Very low | 123 Ų | 123 | 128.7 Ų | 128.7 | 86% | 0.86 | 83% | 0.828 | S | S | * | * | trans | -159.6 | 144.9 | 144.8 | -163.9 | 0 | 0 | 0 | 0 | 111.4 | ||||
| 578 | S | 34.6 | Very low | 34.8 | Very low | 106 Ų | 106 | 131.5 Ų | 131.5 | 74% | 0.741 | 83% | 0.83 | S | S | * | * | trans | -102 | 148.9 | 177.3 | -60.6 | 0 | 0 | 0 | 0 | 110.7 | ||||
| 579 | C | 30.2 | Very low | 34.9 | Very low | 118 Ų | 118 | 133.8 Ų | 133.8 | 80% | 0.797 | 83% | 0.826 | S | S | * | * | 163.4 | 125.5 | 126 | -89.5 | 0 | 0 | 0 | 0 | 114 | |||||
| 580 | S | 35.3 | Very low | 34.5 | Very low | 122 Ų | 122 | 134.4 Ų | 134.4 | 85% | 0.853 | 83% | 0.827 | S | S | * | * | trans | 37 | 119.3 | 143.1 | 61.8 | 0 | 0 | 0 | 0 | 121.9 | ||||
| 581 | G | 30.1 | Very low | 34.2 | Very low | 86 Ų | 86 | 131.6 Ų | 131.6 | 89% | 0.887 | 82% | 0.822 | S | S | * | * | trans | 177.9 | 121.4 | 157.4 | 0 | 0 | 0 | 0 | 0 | 111 | ||||
| 582 | G | 32.6 | Very low | 33.9 | Very low | 73 Ų | 73 | 131.9 Ų | 131.9 | 75% | 0.753 | 82% | 0.821 | S | S | * | * | trans | -111.3 | 171.4 | -168.8 | 0 | 0 | 0 | 0 | 0 | 116 | ||||
| 583 | R | 36.6 | Very low | 33.9 | Very low | 252 Ų | 252 | 130.6 Ų | 130.6 | 95% | 0.951 | 82% | 0.819 | S | S | * | * | trans | 68.3 | 111.6 | 167.8 | -44.3 | 179.3 | 93 | -163.4 | 7.7 | 116.4 | ||||
| 584 | S | 33.6 | Very low | 34.1 | Very low | 122 Ų | 122 | 127.6 Ų | 127.6 | 85% | 0.853 | 81% | 0.814 | S | S | * | * | -176.5 | 156.8 | 87.6 | -158.6 | 0 | 0 | 0 | 0 | 112.1 | |||||
| 585 | S | 36.2 | Very low | 34.4 | Very low | 108 Ų | 108 | 129.1 Ų | 129.1 | 76% | 0.755 | 81% | 0.811 | S | S | * | * | trans | -81.9 | 141.8 | -175.8 | 50.7 | 0 | 0 | 0 | 0 | 114.1 | ||||
| 586 | S | 34 | Very low | 34.8 | Very low | 103 Ų | 103 | 136.6 Ų | 136.6 | 72% | 0.72 | 81% | 0.814 | S | S | * | * | trans | -150.4 | 123.6 | 148.4 | -175 | 0 | 0 | 0 | 0 | 109.7 | ||||
| 587 | V | 34.4 | Very low | 35.4 | Very low | 113 Ų | 113 | 136.6 Ų | 136.6 | 69% | 0.685 | 81% | 0.807 | S | S | * | * | trans | -117.1 | 122.8 | -179.4 | 174.6 | 0 | 0 | 0 | 0 | 108.1 | F589 | V587-F589 HydrophobicContact CG1-CD2 3.53Å; V587-F589 HydrophobicContact CG1-CE2 3.65Å | ||
| 588 | H | 35.2 | Very low | 36.2 | Very low | 173 Ų | 173 | 137.3 Ų | 137.3 | 80% | 0.801 | 81% | 0.807 | S | S | * | * | trans | -117 | 102.3 | 167.2 | -88.4 | -75.5 | 0 | 0 | 0 | 109.7 | ||||
| 589 | F | 33.2 | Very low | 37.4 | Very low | 177 Ų | 177 | 140 Ų | 140 | 78% | 0.776 | 81% | 0.805 | S | S | * | * | trans | -77.4 | 131.1 | 166.3 | -87.2 | -85.9 | 0 | 0 | 0 | 110 | V587 | V587-F589 HydrophobicContact CG1-CD2 3.53Å; V587-F589 HydrophobicContact CG1-CE2 3.65Å | ||
| 590 | V | 37.7 | Very low | 38.3 | Very low | 130 Ų | 130 | 149.1 Ų | 149.1 | 79% | 0.788 | 83% | 0.825 | S | S | * | * | trans | -113.6 | 100.6 | 162.5 | 177.4 | 0 | 0 | 0 | 0 | 107.7 | T592 | V590-T592 PolarHBondContact O-N 3.13Š| ||
| 591 | S | 33.6 | Very low | 38.5 | Very low | 111 Ų | 111 | 150.5 Ų | 150.5 | 78% | 0.776 | 82% | 0.823 | S | S | * | * | trans | -72.9 | 120.9 | 177.2 | -55.5 | 0 | 0 | 0 | 0 | 110.6 | ||||
| 592 | T | 38.3 | Very low | 38.9 | Very low | 125 Ų | 125 | 153.8 Ų | 153.8 | 77% | 0.767 | 82% | 0.82 | S | S | * | * | trans | -116.1 | 104.4 | 166.8 | -47.5 | 0 | 0 | 0 | 0 | 108.9 | V590 | V590-T592 PolarHBondContact O-N 3.13Š| ||
| 593 | S | 35.1 | Very low | 39.2 | Very low | 118 Ų | 118 | 158.3 Ų | 158.3 | 83% | 0.825 | 82% | 0.824 | S | S | * | * | trans | -88.6 | 110.5 | -177 | 55.4 | 0 | 0 | 0 | 0 | 111.9 | ||||
| 594 | T | 40.4 | Very low | 39.4 | Very low | 134 Ų | 134 | 152.8 Ų | 152.8 | 82% | 0.822 | 82% | 0.816 | S | S | * | * | trans | -105.8 | 105.9 | 170.6 | 19.3 | 0 | 0 | 0 | 0 | 111.2 | R596 | T594-R596 PolarHBondContact O-N 3.15Š| ||
| 595 | S | 39.9 | Very low | 39.8 | Very low | 117 Ų | 117 | 154.8 Ų | 154.8 | 82% | 0.818 | 81% | 0.814 | S | S | * | * | trans | -69.9 | 121.9 | -179 | 178.5 | 0 | 0 | 0 | 0 | 112.3 | ||||
| 596 | R | 36.9 | Very low | 40 | Very low | 240 Ų | 240 | 157.9 Ų | 157.9 | 91% | 0.906 | 82% | 0.818 | S | S | * | * | trans | -76.4 | 130.9 | 165.4 | -76.7 | -175.1 | 175.9 | -176.2 | -0.3 | 109.8 | T594 | T594-R596 PolarHBondContact O-N 3.15Š| ||
| 597 | R | 45.3 | Very low | 40.4 | Very low | 217 Ų | 217 | 161.8 Ų | 161.8 | 82% | 0.819 | 83% | 0.825 | S | S | * | * | trans | -135.8 | 80.5 | 166.8 | -164.3 | -179.2 | -164.6 | 175.9 | 7.6 | 111 | ||||
| 598 | T | 47 | Very low | 40.9 | Very low | 138 Ų | 138 | 165.5 Ų | 165.5 | 85% | 0.847 | 84% | 0.836 | S | S | * | * | trans | -74 | 144.2 | 162.8 | 34.9 | 0 | 0 | 0 | 0 | 109.9 | ||||
| 599 | K | 58.7 | Low | 41.4 | Very low | 162 Ų | 162 | 164.9 Ų | 164.9 | 70% | 0.704 | 84% | 0.839 | S | S | * | * | trans | -124.4 | 125.1 | 171.4 | -84.7 | -174.5 | 173.6 | -176.4 | 0 | 107.8 | ||||
| 600 | Y | 50.3 | Low | 42.1 | Very low | 310 Ų | 310 | 163.8 Ų | 163.8 | 100% | 1.216 | 84% | 0.844 | S | S | * | * | trans | 54.3 | 0 | 169.7 | -64.6 | -74.2 | 0 | 0 | 0 | 116.7 |
Retrieved 600 of 600 residues in 170.8 ms
(Link to these results)