| 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 | 37.7 | Very low | 43.9 | Very low | 235 Ų | 235 | 134.4 Ų | 134.4 | 100% | 1.158 | 85% | 0.85 | S | S | * | * | 0 | 145.4 | 0 | -85 | -147.6 | 69.5 | 0 | 0 | 109 | |||||
| 2 | P | 49 | Very low | 43.1 | Very low | 117 Ų | 117 | 131.5 Ų | 131.5 | 76% | 0.76 | 84% | 0.838 | S | S | * | * | trans | -82.2 | 167.8 | -142.8 | 35.6 | -35 | 0 | 0 | 0 | 113 | ||||
| 3 | G | 40.3 | Very low | 42.5 | Very low | 70 Ų | 70 | 138.8 Ų | 138.8 | 72% | 0.722 | 84% | 0.839 | S | S | * | * | cis | 161.7 | 149.9 | 12.1 | 0 | 0 | 0 | 0 | 0 | 108.7 | ||||
| 4 | H | 49.8 | Very low | 42 | Very low | 185 Ų | 185 | 141.7 Ų | 141.7 | 86% | 0.856 | 84% | 0.839 | S | S | * | * | trans | -58.5 | 154.5 | -172.8 | -56.9 | -85.8 | 0 | 0 | 0 | 116 | ||||
| 5 | S | 43.8 | Very low | 41.4 | Very low | 124 Ų | 124 | 139.8 Ų | 139.8 | 87% | 0.867 | 84% | 0.835 | S | S | * | * | -171.2 | 135.5 | 111.5 | -87 | 0 | 0 | 0 | 0 | 113.8 | |||||
| 6 | S | 44.2 | Very low | 41.1 | Very low | 126 Ų | 126 | 142.4 Ų | 142.4 | 88% | 0.881 | 83% | 0.832 | S | S | * | * | trans | -78.5 | 152.2 | 179.9 | -52.2 | 0 | 0 | 0 | 0 | 112.8 | ||||
| 7 | G | 37.6 | Very low | 40.7 | Very low | 80 Ų | 80 | 143.7 Ų | 143.7 | 83% | 0.825 | 83% | 0.828 | S | S | * | * | trans | -153.9 | 104.8 | 160.3 | 0 | 0 | 0 | 0 | 0 | 109.9 | ||||
| 8 | A | 45.3 | Very low | 40.4 | Very low | 93 Ų | 93 | 148.4 Ų | 148.4 | 77% | 0.769 | 83% | 0.83 | S | S | * | * | trans | -91.1 | 149.2 | 177.2 | 0 | 0 | 0 | 0 | 0 | 111.3 | ||||
| 9 | P | 47.4 | Very low | 40.1 | Very low | 125 Ų | 125 | 146.3 Ų | 146.3 | 81% | 0.812 | 83% | 0.826 | S | S | * | * | trans | -95.3 | 129.7 | 165.9 | 33.7 | -25.4 | 0 | 0 | 0 | 110.5 | ||||
| 10 | Q | 40.7 | Very low | 39.7 | Very low | 189 Ų | 189 | 144.7 Ų | 144.7 | 88% | 0.883 | 83% | 0.825 | S | S | * | * | trans | -108 | 116.3 | 170.5 | -77.1 | -112.5 | -26 | 0 | 0 | 109.9 | ||||
| 11 | T | 47.2 | Very low | 39.7 | Very low | 134 Ų | 134 | 146.6 Ų | 146.6 | 82% | 0.822 | 83% | 0.826 | S | S | * | * | trans | -95.5 | 134.1 | 161.6 | 59.7 | 0 | 0 | 0 | 0 | 109 | ||||
| 12 | S | 33.8 | Very low | 39.5 | Very low | 100 Ų | 100 | 138.2 Ų | 138.2 | 70% | 0.699 | 80% | 0.8 | S | S | * | * | trans | -171.7 | 106.1 | 164.4 | 171.7 | 0 | 0 | 0 | 0 | 109 | ||||
| 13 | R | 35.4 | Very low | 38.8 | Very low | 226 Ų | 226 | 140 Ų | 140 | 85% | 0.853 | 80% | 0.803 | S | S | * | * | 73.3 | 119.4 | 83.9 | -74 | -172.3 | 178.9 | -170 | 1.5 | 115.9 | |||||
| 14 | H | 35.4 | Very low | 38.4 | Very low | 180 Ų | 180 | 145.1 Ų | 145.1 | 83% | 0.833 | 81% | 0.808 | S | S | * | * | trans | 44.6 | 130.8 | 135.5 | -69.4 | -65.4 | 0 | 0 | 0 | 123.1 | ||||
| 15 | S | 33.2 | Very low | 38 | Very low | 113 Ų | 113 | 145.8 Ų | 145.8 | 79% | 0.79 | 81% | 0.809 | S | S | * | * | -176.4 | 130.4 | 111.5 | 74.8 | 0 | 0 | 0 | 0 | 108.8 | |||||
| 16 | K | 36.8 | Very low | 38.1 | Very low | 181 Ų | 181 | 145.2 Ų | 145.2 | 79% | 0.787 | 80% | 0.802 | S | S | * | * | 78.1 | 136.2 | 67 | -98.3 | -169.9 | -175.9 | -178.6 | 0 | 116.2 | |||||
| 17 | H | 34.3 | Very low | 37.5 | Very low | 165 Ų | 165 | 145.4 Ų | 145.4 | 76% | 0.764 | 80% | 0.803 | S | S | * | * | trans | 84.2 | 138.2 | 170.8 | -64 | -72.6 | 0 | 0 | 0 | 116.2 | ||||
| 18 | R | 34.4 | Very low | 37.6 | Very low | 229 Ų | 229 | 152.5 Ų | 152.5 | 86% | 0.864 | 81% | 0.805 | S | S | * | * | cis | -161.6 | 161.3 | 26.4 | -133 | 167.2 | -170.9 | -115.9 | 5 | 111.4 | ||||
| 19 | S | 34.8 | Very low | 37.1 | Very low | 107 Ų | 107 | 153.8 Ų | 153.8 | 75% | 0.748 | 80% | 0.804 | S | S | * | * | trans | -61.1 | 151.2 | 177.7 | 52.5 | 0 | 0 | 0 | 0 | 117.4 | ||||
| 20 | S | 33.6 | Very low | 36.6 | Very low | 114 Ų | 114 | 155.3 Ų | 155.3 | 80% | 0.797 | 80% | 0.804 | S | S | * | * | trans | -162.8 | 149.2 | 130.6 | -160.8 | 0 | 0 | 0 | 0 | 112.9 | ||||
| 21 | Q | 39 | Very low | 36.2 | Very low | 185 Ų | 185 | 155.5 Ų | 155.5 | 86% | 0.864 | 80% | 0.797 | S | S | * | * | trans | -54.6 | 158.7 | -178.6 | -60.6 | 164 | -24.8 | 0 | 0 | 112.8 | ||||
| 22 | G | 33 | Very low | 35.6 | Very low | 59 Ų | 59 | 160.8 Ų | 160.8 | 61% | 0.608 | 80% | 0.802 | S | S | * | * | cis | 113.2 | 117.2 | 24.5 | 0 | 0 | 0 | 0 | 0 | 110.4 | ||||
| 23 | N | 34.1 | Very low | 35.5 | Very low | 154 Ų | 154 | 162.6 Ų | 162.6 | 82% | 0.824 | 80% | 0.8 | S | S | * | * | trans | 96.9 | 114.7 | 165.5 | -48.7 | -31.8 | 0 | 0 | 0 | 116.6 | ||||
| 24 | H | 32.3 | Very low | 35.4 | Very low | 178 Ų | 178 | 157.1 Ų | 157.1 | 82% | 0.824 | 80% | 0.796 | S | S | * | * | 60.5 | 115.1 | 73.5 | -75.2 | 22.5 | 0 | 0 | 0 | 111.6 | |||||
| 25 | K | 41 | Very low | 35.4 | Very low | 199 Ų | 199 | 155.3 Ų | 155.3 | 87% | 0.865 | 80% | 0.798 | S | S | * | * | 179.7 | 177.7 | 70.4 | -117.5 | -175.4 | 178.9 | 176.2 | 0 | 111.4 | |||||
| 26 | P | 47.2 | Very low | 35.3 | Very low | 112 Ų | 112 | 153.6 Ų | 153.6 | 73% | 0.727 | 80% | 0.798 | S | S | * | * | trans | -95.3 | 171.1 | -162 | 40.4 | -38.6 | 0 | 0 | 0 | 114.6 | ||||
| 27 | S | 31.7 | Very low | 35.3 | Very low | 130 Ų | 130 | 152.8 Ų | 152.8 | 91% | 0.909 | 80% | 0.801 | S | S | * | * | trans | -122.8 | 127.4 | 168.1 | -71 | 0 | 0 | 0 | 0 | 112.1 | ||||
| 28 | R | 38.2 | Very low | 35.7 | Very low | 229 Ų | 229 | 150.6 Ų | 150.6 | 86% | 0.864 | 80% | 0.802 | S | S | * | * | trans | -130.4 | 161 | 168.1 | -153.9 | -177.8 | -170.7 | -176.4 | 3.1 | 106.6 | ||||
| 29 | T | 36.1 | Very low | 35.5 | Very low | 121 Ų | 121 | 146.6 Ų | 146.6 | 74% | 0.742 | 80% | 0.797 | S | S | * | * | trans | 90.5 | 148.5 | 161.3 | 83.5 | 0 | 0 | 0 | 0 | 115.8 | ||||
| 30 | I | 37.1 | Very low | 35.5 | Very low | 157 Ų | 157 | 148.1 Ų | 148.1 | 81% | 0.805 | 80% | 0.796 | S | S | * | * | cis | -154.9 | 154 | 17.2 | -50.2 | 165.2 | 0 | 0 | 0 | 110.4 | ||||
| 31 | Y | 31 | Very low | 35.5 | Very low | 192 Ų | 192 | 153.8 Ų | 153.8 | 75% | 0.753 | 80% | 0.801 | S | S | * | * | trans | -47.8 | 149.4 | 156.8 | -152.9 | -99.2 | 0 | 0 | 0 | 116.5 | E33 | Y31-E33 HydrophobicContact CE1-CB 4.34Š| ||
| 32 | R | 35 | Very low | 35.1 | Very low | 246 Ų | 246 | 153.5 Ų | 153.5 | 93% | 0.928 | 80% | 0.799 | S | S | * | * | trans | -162.9 | 134.8 | 143.4 | -145.3 | 178 | -176.3 | 175.5 | 0.8 | 113.3 | ||||
| 33 | E | 31.3 | Very low | 35.2 | Very low | 138 Ų | 138 | 158.4 Ų | 158.4 | 65% | 0.645 | 81% | 0.81 | S | S | * | * | trans | -97.7 | 149.4 | 178.9 | 169.7 | 178.7 | -174.8 | 0 | 0 | 111.2 | Y31 | Y31-E33 HydrophobicContact CE1-CB 4.34Š| ||
| 34 | S | 35 | Very low | 35.1 | Very low | 110 Ų | 110 | 159.8 Ų | 159.8 | 77% | 0.769 | 81% | 0.812 | S | S | * | * | trans | 169.3 | 111.8 | 139.5 | -73.9 | 0 | 0 | 0 | 0 | 113.9 | ||||
| 35 | T | 35.1 | Very low | 35 | Very low | 142 Ų | 142 | 155 Ų | 155 | 87% | 0.871 | 81% | 0.81 | S | S | * | * | 37.5 | 132.1 | 124.5 | -26.1 | 0 | 0 | 0 | 0 | 123.1 | |||||
| 36 | G | 30.5 | Very low | 34.6 | Very low | 77 Ų | 77 | 153.4 Ų | 153.4 | 79% | 0.794 | 81% | 0.806 | S | S | * | * | trans | 166.7 | 105.4 | 152.1 | 0 | 0 | 0 | 0 | 0 | 116.2 | ||||
| 37 | L | 35.8 | Very low | 33.9 | Very low | 165 Ų | 165 | 154.5 Ų | 154.5 | 86% | 0.864 | 80% | 0.801 | S | S | * | * | trans | -81.8 | 153.2 | 164.6 | -148 | 90.9 | 0 | 0 | 0 | 109.8 | ||||
| 38 | P | 43.9 | Very low | 33.9 | Very low | 119 Ų | 119 | 156.1 Ų | 156.1 | 77% | 0.773 | 79% | 0.792 | S | S | * | * | -146 | 142.8 | 92.5 | 34.1 | -15.2 | 0 | 0 | 0 | 113.4 | |||||
| 39 | D | 29.7 | Very low | 33.7 | Very low | 144 Ų | 144 | 155 Ų | 155 | 77% | 0.77 | 79% | 0.788 | S | S | * | * | 81.3 | 138.8 | 89.8 | -154.2 | 26.1 | 0 | 0 | 0 | 117.2 | |||||
| 40 | L | 35.4 | Very low | 33.5 | Very low | 139 Ų | 139 | 155.6 Ų | 155.6 | 73% | 0.728 | 78% | 0.782 | S | S | * | * | trans | -50.3 | 145.7 | -171.1 | -124.1 | 85.8 | 0 | 0 | 0 | 118.1 | ||||
| 41 | R | 33.6 | Very low | 33.2 | Very low | 234 Ų | 234 | 154.6 Ų | 154.6 | 88% | 0.883 | 77% | 0.773 | S | S | * | * | 165.2 | 133.1 | 112.9 | -87.9 | -178.8 | -151 | -107.4 | 2.1 | 114.6 | |||||
| 42 | E | 30.5 | Very low | 33.4 | Very low | 178 Ų | 178 | 154.4 Ų | 154.4 | 83% | 0.832 | 78% | 0.779 | S | S | * | * | trans | -52.2 | 147.2 | 156 | -78.5 | 167.3 | 124.4 | 0 | 0 | 114.2 | ||||
| 43 | L | 33.9 | Very low | 33.2 | Very low | 162 Ų | 162 | 149.5 Ų | 149.5 | 85% | 0.848 | 77% | 0.771 | S | S | * | * | 165.7 | 119.7 | 117 | -92.4 | 153.3 | 0 | 0 | 0 | 112.1 | |||||
| 44 | H | 32 | Very low | 33.4 | Very low | 184 Ų | 184 | 150.9 Ų | 150.9 | 85% | 0.852 | 78% | 0.783 | S | S | * | * | 53.8 | 131.2 | 127.3 | -131.1 | 37.7 | 0 | 0 | 0 | 122.1 | |||||
| 45 | G | 30.4 | Very low | 33.5 | Very low | 76 Ų | 76 | 154.3 Ų | 154.3 | 78% | 0.784 | 79% | 0.786 | S | S | * | * | trans | 168.7 | 90.9 | 161.9 | 0 | 0 | 0 | 0 | 0 | 115.3 | ||||
| 46 | E | 32.3 | Very low | 34.2 | Very low | 166 Ų | 166 | 153 Ų | 153 | 78% | 0.776 | 78% | 0.78 | S | S | * | * | trans | -65.6 | 170.3 | 174.8 | -85 | -80.8 | 168 | 0 | 0 | 115.7 | ||||
| 47 | H | 33.8 | Very low | 34.4 | Very low | 136 Ų | 136 | 160.4 Ų | 160.4 | 63% | 0.63 | 78% | 0.784 | S | S | * | * | trans | 89.6 | 107.3 | 147.2 | -112.1 | -88.6 | 0 | 0 | 0 | 121.1 | ||||
| 48 | F | 32.4 | Very low | 34.1 | Very low | 163 Ų | 163 | 159.9 Ų | 159.9 | 72% | 0.715 | 78% | 0.777 | S | S | * | * | 164.8 | 131.2 | 98.9 | -96.3 | -76 | 0 | 0 | 0 | 115 | |||||
| 49 | R | 33.7 | Very low | 33.8 | Very low | 207 Ų | 207 | 161.3 Ų | 161.3 | 78% | 0.781 | 78% | 0.784 | S | S | * | * | trans | 40.1 | 128.1 | 142.1 | -81.1 | -179.1 | 169.3 | -143.1 | -4.3 | 121.9 | ||||
| 50 | E | 30.3 | Very low | 33.9 | Very low | 133 Ų | 133 | 160.9 Ų | 160.9 | 62% | 0.621 | 78% | 0.777 | S | S | * | * | 99.2 | 132.2 | 51.6 | -152.4 | 178.6 | -157.1 | 0 | 0 | 113.8 | |||||
| 51 | H | 32.4 | Very low | 33.6 | Very low | 135 Ų | 135 | 160.2 Ų | 160.2 | 63% | 0.625 | 78% | 0.784 | S | S | * | * | trans | 78.1 | 119.4 | 167.1 | -61.6 | -58.5 | 0 | 0 | 0 | 121 | ||||
| 52 | H | 34.3 | Very low | 33.7 | Very low | 188 Ų | 188 | 156.4 Ų | 156.4 | 87% | 0.87 | 77% | 0.774 | S | S | * | * | -171.3 | 129.9 | 99.4 | -92.9 | -66.6 | 0 | 0 | 0 | 113.4 | |||||
| 53 | N | 31.8 | Very low | 34 | Very low | 143 Ų | 143 | 155.8 Ų | 155.8 | 77% | 0.765 | 78% | 0.777 | S | S | * | * | trans | -65.2 | 148.5 | 171.4 | -74.9 | -45.7 | 0 | 0 | 0 | 112.8 | ||||
| 54 | N | 35.5 | Very low | 33.8 | Very low | 167 Ų | 167 | 151.6 Ų | 151.6 | 89% | 0.893 | 77% | 0.772 | S | S | * | * | trans | -153.6 | 121.8 | 146.1 | -86.9 | -51.8 | 0 | 0 | 0 | 111.6 | ||||
| 55 | H | 36.4 | Very low | 34 | Very low | 182 Ų | 182 | 149.3 Ų | 149.3 | 84% | 0.843 | 77% | 0.774 | S | S | * | * | trans | -103.2 | 157.6 | 160.3 | -95.4 | -28.7 | 0 | 0 | 0 | 108.6 | ||||
| 56 | P | 48.9 | Very low | 34.4 | Very low | 114 Ų | 114 | 151 Ų | 151 | 74% | 0.74 | 77% | 0.773 | S | S | * | * | -146.2 | 140.9 | 105.1 | 32.5 | -14.2 | 0 | 0 | 0 | 117.2 | |||||
| 57 | R | 35.8 | Very low | 34.6 | Very low | 233 Ų | 233 | 153.5 Ų | 153.5 | 88% | 0.879 | 78% | 0.776 | S | S | * | * | trans | 41 | 112.2 | 135.2 | -52.4 | -177.3 | -165.2 | 166.7 | 4.7 | 119.2 | ||||
| 58 | H | 29.7 | Very low | 34.5 | Very low | 155 Ų | 155 | 157.4 Ų | 157.4 | 72% | 0.718 | 79% | 0.785 | S | S | * | * | 73.4 | 105.8 | 73.9 | -146.5 | -71.7 | 0 | 0 | 0 | 115.1 | E60 | H58-E60 IonicContact CE1-OE2 3.69Š| |||
| 59 | T | 36.2 | Very low | 35.3 | Very low | 148 Ų | 148 | 160.6 Ų | 160.6 | 91% | 0.908 | 79% | 0.794 | S | S | * | * | trans | -129.2 | 124.1 | 149 | 43.5 | 0 | 0 | 0 | 0 | 108.4 | ||||
| 60 | E | 33.3 | Very low | 35.7 | Very low | 135 Ų | 135 | 155.9 Ų | 155.9 | 63% | 0.631 | 79% | 0.79 | S | S | * | * | trans | -94.5 | 135.3 | -177.3 | -163 | -179.9 | 150.1 | 0 | 0 | 109.8 | H58 K62 | H58-E60 IonicContact CE1-OE2 3.69Å; E60-K62 WeakPolarHBondContact OE1-CE 3.23Å | ||
| 61 | S | 27.5 | Very low | 36 | Very low | 126 Ų | 126 | 160.9 Ų | 160.9 | 88% | 0.881 | 80% | 0.803 | S | S | * | * | trans | -146.1 | 122 | 154 | 175.9 | 0 | 0 | 0 | 0 | 108 | ||||
| 62 | K | 37.1 | Very low | 36.1 | Very low | 154 Ų | 154 | 162.6 Ų | 162.6 | 67% | 0.67 | 82% | 0.817 | S | S | * | * | trans | -74.6 | 142.7 | -168.5 | -71.7 | 166.2 | 169.6 | 169.8 | 0 | 112.3 | E60 | E60-K62 WeakPolarHBondContact OE1-CE 3.23Š| ||
| 63 | N | 35.5 | Very low | 36.4 | Very low | 165 Ų | 165 | 156.7 Ų | 156.7 | 88% | 0.882 | 81% | 0.807 | S | S | * | * | 161.8 | 116.4 | 120.9 | -75 | -23.6 | 0 | 0 | 0 | 111 | |||||
| 64 | G | 31.5 | Very low | 36.5 | Very low | 73 Ų | 73 | 156.2 Ų | 156.2 | 75% | 0.753 | 81% | 0.81 | S | S | * | * | trans | 134.2 | 129.2 | 163.7 | 0 | 0 | 0 | 0 | 0 | 115.4 | ||||
| 65 | P | 36.2 | Very low | 37.1 | Very low | 137 Ų | 137 | 153.1 Ų | 153.1 | 89% | 0.89 | 81% | 0.807 | S | S | * | * | trans | -86.6 | 138.6 | -150.2 | 32.9 | -34.9 | 0 | 0 | 0 | 116.1 | ||||
| 66 | S | 38.6 | Very low | 37.5 | Very low | 110 Ų | 110 | 155.4 Ų | 155.4 | 77% | 0.769 | 81% | 0.808 | S | S | * | * | trans | -85.4 | 132.2 | 168.2 | 173.8 | 0 | 0 | 0 | 0 | 111.9 | ||||
| 67 | R | 35.2 | Very low | 37.1 | Very low | 219 Ų | 219 | 154.3 Ų | 154.3 | 83% | 0.826 | 81% | 0.809 | S | S | * | * | trans | 149.9 | 120.6 | 131.2 | -87.2 | -172.3 | -175.9 | -169.6 | 1.9 | 111 | ||||
| 68 | R | 32.1 | Very low | 37.5 | Very low | 219 Ų | 219 | 148.4 Ų | 148.4 | 83% | 0.826 | 80% | 0.803 | S | S | * | * | 166.5 | 125.4 | 95.8 | -80.8 | -163.5 | -162.5 | -163.5 | 4.7 | 109.4 | |||||
| 69 | Y | 48.8 | Very low | 38.1 | Very low | 230 Ų | 230 | 149.5 Ų | 149.5 | 90% | 0.902 | 81% | 0.809 | S | S | * | * | trans | -63 | 146.8 | 149.3 | -82.9 | -90 | 0 | 0 | 0 | 109.7 | ||||
| 70 | P | 43.2 | Very low | 38.5 | Very low | 108 Ų | 108 | 148.6 Ų | 148.6 | 70% | 0.701 | 80% | 0.803 | S | S | * | * | -126.9 | 120.9 | 126.7 | 31.8 | -19.5 | 0 | 0 | 0 | 108.9 | |||||
| 71 | R | 35.9 | Very low | 39.1 | Very low | 237 Ų | 237 | 148.5 Ų | 148.5 | 89% | 0.894 | 81% | 0.806 | S | S | * | * | 58.7 | 75.7 | 86.7 | -161.8 | 173.5 | -173.6 | 166.9 | 1.2 | 111.9 | G73 | R71-G73 PolarHBondContact O-N 3.36Š| |||
| 72 | N | 34.3 | Very low | 39.9 | Very low | 172 Ų | 172 | 145.2 Ų | 145.2 | 92% | 0.92 | 79% | 0.792 | S | S | * | * | trans | -69.3 | 117.6 | 158.9 | -76.1 | -13.9 | 0 | 0 | 0 | 108.4 | ||||
| 73 | G | 40.2 | Very low | 40.3 | Very low | 64 Ų | 64 | 146.8 Ų | 146.8 | 66% | 0.66 | 80% | 0.799 | S | S | * | * | trans | -163 | 75.5 | -179.1 | 0 | 0 | 0 | 0 | 0 | 110.3 | R71 | R71-G73 PolarHBondContact O-N 3.36Š| ||
| 74 | T | 34.7 | Very low | 41 | Very low | 133 Ų | 133 | 146.2 Ų | 146.2 | 82% | 0.816 | 79% | 0.794 | S | S | * | * | trans | -147 | 101.6 | 149.6 | -36.9 | 0 | 0 | 0 | 0 | 108 | R76 | T74-R76 PolarHBondContact O-N 3.32Š| ||
| 75 | A | 48.8 | Very low | 41.8 | Very low | 101 Ų | 101 | 149 Ų | 149 | 84% | 0.835 | 80% | 0.799 | S | S | * | * | trans | -58.3 | 118 | 166 | 0 | 0 | 0 | 0 | 0 | 108.9 | ||||
| 76 | R | 44.5 | Very low | 41.6 | Very low | 230 Ų | 230 | 145.4 Ų | 145.4 | 87% | 0.868 | 79% | 0.787 | S | S | * | * | trans | -131.6 | 125.9 | 147.5 | -72.8 | -152 | 179.5 | -157.9 | 3.6 | 107.3 | T74 S78 | T74-R76 PolarHBondContact O-N 3.32Å; R76-S78 PolarHBondContact O-N 3.28Å | ||
| 77 | A | 40 | Very low | 41.7 | Very low | 91 Ų | 91 | 145.6 Ų | 145.6 | 75% | 0.752 | 79% | 0.788 | S | S | * | * | trans | -50.1 | 127.2 | -167.3 | 0 | 0 | 0 | 0 | 0 | 112.2 | E79 | A77-E79 PolarHBondContact O-N 3.48Š| ||
| 78 | S | 43.8 | Very low | 41.9 | Very low | 109 Ų | 109 | 139.9 Ų | 139.9 | 76% | 0.762 | 79% | 0.788 | S | S | * | * | trans | -67.8 | 107.7 | 154.7 | -55.1 | 0 | 0 | 0 | 0 | 106.4 | R76 T80 | R76-S78 PolarHBondContact O-N 3.28Å; S78-T80 VanDerWaalsContact C-N 3.26Å; S78-T80 PolarHBondContact O-N 3.02Å | ||
| 79 | E | 43 | Very low | 42.2 | Very low | 179 Ų | 179 | 137 Ų | 137 | 84% | 0.836 | 79% | 0.789 | S | S | * | * | trans | -69.5 | 88.3 | 170.5 | -64.3 | 178.4 | -169.1 | 0 | 0 | 108.1 | A77 I81 | A77-E79 PolarHBondContact O-N 3.48Å; E79-I81 PolarHBondContact O-N 3.13Å; E79-I81 VanDerWaalsContact O-N 3.14Å | ||
| 80 | T | 44 | Very low | 41.9 | Very low | 128 Ų | 128 | 131.8 Ų | 131.8 | 79% | 0.785 | 79% | 0.786 | S | S | * | * | trans | -72.7 | 98.8 | 168.3 | -52.2 | 0 | 0 | 0 | 0 | 107.5 | S78 G82 | S78-T80 VanDerWaalsContact C-N 3.26Å; S78-T80 PolarHBondContact O-N 3.02Å; T80-G82 PolarHBondContact O-N 3.33Å | ||
| 81 | I | 46.8 | Very low | 41.6 | Very low | 134 Ų | 134 | 131 Ų | 131 | 69% | 0.687 | 79% | 0.789 | S | S | * | * | trans | -68.9 | 91 | 165.9 | -64.4 | 166.5 | 0 | 0 | 0 | 106.7 | E79 F83 | E79-I81 PolarHBondContact O-N 3.13Å; E79-I81 VanDerWaalsContact O-N 3.14Å; I81-F83 PolarHBondContact O-N 3.03Å | ||
| 82 | G | 42.7 | Very low | 41.7 | Very low | 57 Ų | 57 | 126 Ų | 126 | 59% | 0.588 | 79% | 0.787 | S | S | * | * | trans | -71.5 | 112.9 | 167.4 | 0 | 0 | 0 | 0 | 0 | 108.8 | T80 I84 | T80-G82 PolarHBondContact O-N 3.33Å; G82-I84 PolarHBondContact O-N 3.3Å | ||
| 83 | F | 45.6 | Very low | 42.3 | Very low | 186 Ų | 186 | 122.5 Ų | 122.5 | 82% | 0.816 | 78% | 0.782 | S | S | * | * | trans | -65.5 | 119.2 | 166 | -71 | -85.9 | 0 | 0 | 0 | 108.3 | I81 P85 | I81-F83 PolarHBondContact O-N 3.03Å; F83-P85 VanDerWaalsContact O-CD 3.26Å; F83-P85 WeakPolarHBondContact O-CD 3.37Å | ||
| 84 | I | 50.8 | Low | 42.3 | Very low | 153 Ų | 153 | 124.9 Ų | 124.9 | 79% | 0.785 | 79% | 0.788 | S | S | * | * | trans | -69.2 | 119.5 | 168 | -61 | -167.5 | 0 | 0 | 0 | 107.4 | G82 G86 | G82-I84 PolarHBondContact O-N 3.3Å; I84-G86 VanDerWaalsContact C-N 3.3Å; I84-G86 PolarHBondContact O-N 2.67Å | ||
| 85 | P | 48.7 | Very low | 42.5 | Very low | 131 Ų | 131 | 130 Ų | 130 | 85% | 0.851 | 79% | 0.793 | S | S | * | * | trans | -74.2 | 89.5 | 166.8 | -5.5 | 24.1 | 0 | 0 | 0 | 107.5 | F83 | F83-P85 VanDerWaalsContact O-CD 3.26Å; F83-P85 WeakPolarHBondContact O-CD 3.37Å | ||
| 86 | G | 31.7 | Very low | 42.2 | Very low | 63 Ų | 63 | 131.4 Ų | 131.4 | 65% | 0.649 | 79% | 0.794 | S | S | * | * | trans | -81.2 | 126.9 | 172.7 | 0 | 0 | 0 | 0 | 0 | 110.5 | I84 A88 | I84-G86 VanDerWaalsContact C-N 3.3Å; I84-G86 PolarHBondContact O-N 2.67Å; G86-A88 PolarHBondContact O-N 3.06Å | ||
| 87 | S | 40.5 | Very low | 41.7 | Very low | 114 Ų | 114 | 126 Ų | 126 | 80% | 0.797 | 79% | 0.791 | S | S | * | * | trans | -50.3 | 126.9 | -175.5 | 57.4 | 0 | 0 | 0 | 0 | 114.2 | D89 | S87-D89 PolarHBondContact O-N 2.68Š| ||
| 88 | A | 39.4 | Very low | 41.5 | Very low | 99 Ų | 99 | 127.6 Ų | 127.6 | 82% | 0.818 | 80% | 0.795 | S | S | * | * | trans | -79.3 | 112.7 | 165.6 | 0 | 0 | 0 | 0 | 0 | 109.6 | G86 | G86-A88 PolarHBondContact O-N 3.06Š| ||
| 89 | D | 38.2 | Very low | 41 | Very low | 157 Ų | 157 | 125 Ų | 125 | 84% | 0.84 | 79% | 0.785 | S | S | * | * | trans | -64 | 136.3 | 164 | -99 | -36.7 | 0 | 0 | 0 | 110 | S87 A91 | S87-D89 PolarHBondContact O-N 2.68Å; D89-A91 PolarHBondContact O-N 3.32Å | ||
| 90 | S | 42.4 | Very low | 40.8 | Very low | 122 Ų | 122 | 122 Ų | 122 | 85% | 0.853 | 79% | 0.785 | S | S | * | * | trans | -74 | 114.1 | -175 | -56.3 | 0 | 0 | 0 | 0 | 110.6 | ||||
| 91 | A | 37 | Very low | 40.5 | Very low | 91 Ų | 91 | 121.9 Ų | 121.9 | 75% | 0.752 | 79% | 0.787 | S | S | * | * | trans | -105.1 | 139.9 | 167.7 | 0 | 0 | 0 | 0 | 0 | 110.6 | D89 | D89-A91 PolarHBondContact O-N 3.32Š| ||
| 92 | P | 38.3 | Very low | 40.6 | Very low | 131 Ų | 131 | 120.5 Ų | 120.5 | 85% | 0.851 | 79% | 0.787 | S | S | * | * | trans | -74.6 | 146.9 | -157.4 | 27.9 | -34.7 | 0 | 0 | 0 | 114.7 | S94 | P92-S94 PolarHBondContact O-N 3.17Š| ||
| 93 | A | 46.7 | Very low | 40.9 | Very low | 99 Ų | 99 | 123.7 Ų | 123.7 | 82% | 0.818 | 80% | 0.8 | S | S | * | * | trans | -57.9 | 117.9 | 169 | 0 | 0 | 0 | 0 | 0 | 111.7 | ||||
| 94 | S | 40.9 | Very low | 41.5 | Very low | 114 Ų | 114 | 121 Ų | 121 | 80% | 0.797 | 79% | 0.792 | S | S | * | * | trans | 162.8 | 99.3 | 136.4 | 54.1 | 0 | 0 | 0 | 0 | 110.1 | P92 | P92-S94 PolarHBondContact O-N 3.17Š| ||
| 95 | R | 38.2 | Very low | 41.9 | Very low | 240 Ų | 240 | 115.2 Ų | 115.2 | 91% | 0.906 | 77% | 0.77 | S | S | * | * | trans | -131.7 | 128.2 | 149.4 | -70.7 | -170.2 | 178.2 | -168.8 | 0.2 | 106.8 | S97 | R95-S97 PolarHBondContact O-N 2.95Å; R95-S97 VanDerWaalsContact O-N 3.13Å | ||
| 96 | P | 43.3 | Very low | 42.9 | Very low | 132 Ų | 132 | 119.3 Ų | 119.3 | 86% | 0.857 | 77% | 0.769 | S | S | * | * | trans | -63.5 | 119.8 | -175.1 | 24.4 | -31 | 0 | 0 | 0 | 109.2 | C98 | P96-C98 PolarHBondContact O-N 3.36Š| ||
| 97 | S | 34.5 | Very low | 44.5 | Very low | 115 Ų | 115 | 120.8 Ų | 120.8 | 80% | 0.804 | 77% | 0.769 | S | S | * | * | trans | -54.8 | 115 | 162.3 | -176.2 | 0 | 0 | 0 | 0 | 107.6 | R95 G99 | R95-S97 PolarHBondContact O-N 2.95Å; R95-S97 VanDerWaalsContact O-N 3.13Å; S97-G99 PolarHBondContact O-N 3.31Å | ||
| 98 | C | 34.3 | Very low | 45.5 | Very low | 126 Ų | 126 | 117 Ų | 117 | 85% | 0.851 | 74% | 0.742 | S | S | * | * | trans | -66.8 | 105.6 | 171.9 | -175.5 | 0 | 0 | 0 | 0 | 107.3 | P96 | P96-C98 PolarHBondContact O-N 3.36Š| ||
| 99 | G | 34.8 | Very low | 47 | Very low | 53 Ų | 53 | 114.2 Ų | 114.2 | 55% | 0.546 | 72% | 0.716 | S | S | . | * | trans | -63.6 | 144.2 | 179.7 | 0 | 0 | 0 | 0 | 0 | 112.3 | S97 C101 | S97-G99 PolarHBondContact O-N 3.31Å; G99-C101 PolarHBondContact O-N 3.12Å | ||
| 100 | S | 39 | Very low | 48.7 | Very low | 118 Ų | 118 | 113.6 Ų | 113.6 | 83% | 0.825 | 71% | 0.706 | S | S | * | * | trans | 35.5 | 85.3 | 146.9 | -58.2 | 0 | 0 | 0 | 0 | 116.7 | P102 | S100-P102 WeakPolarHBondContact O-CD 3.3Š| ||
| 101 | C | 37.5 | Very low | 50 | Low | 124 Ų | 124 | 110.7 Ų | 110.7 | 84% | 0.838 | 69% | 0.69 | S | S | * | * | trans | -65.1 | 120.8 | 149.3 | -83.5 | 0 | 0 | 0 | 0 | 107.6 | G99 S103 | G99-C101 PolarHBondContact O-N 3.12Å; C101-S103 PolarHBondContact O-N 3.14Å | ||
| 102 | P | 48.2 | Very low | 51.8 | Low | 106 Ų | 106 | 111.4 Ų | 111.4 | 69% | 0.688 | 68% | 0.68 | S | S | * | * | trans | -57.4 | 135.4 | 162.6 | 26.1 | -31.2 | 0 | 0 | 0 | 106.9 | S100 M104 | S100-P102 WeakPolarHBondContact O-CD 3.3Å; P102-M104 PolarHBondContact O-N 3.45Å | ||
| 103 | S | 49.8 | Very low | 53.7 | Low | 123 Ų | 123 | 109.9 Ų | 109.9 | 86% | 0.86 | 66% | 0.664 | S | S | * | * | trans | -52.6 | 90.9 | 174.1 | -179.7 | 0 | 0 | 0 | 0 | 109.2 | C101 G105 | C101-S103 PolarHBondContact O-N 3.14Å; S103-G105 PolarHBondContact O-N 3.42Å | ||
| 104 | M | 57 | Low | 54.7 | Low | 131 Ų | 131 | 108.6 Ų | 108.6 | 65% | 0.645 | 65% | 0.648 | S | S | * | * | trans | -71.5 | 102.8 | 174.1 | -167.1 | 70.9 | 82.7 | 0 | 0 | 104.1 | P102 S108 | P102-M104 PolarHBondContact O-N 3.45Å; M104-S108 VanDerWaalsContact CG-OG 3.3Å; M104-S108 WeakPolarHBondContact CG-OG 3.41Å | ||
| 105 | G | 59 | Low | 55.9 | Low | 31 Ų | 31 | 112.2 Ų | 112.2 | 32% | 0.32 | 65% | 0.645 | S | S | . | * | trans | -47.5 | 147.9 | -173.6 | 0 | 0 | 0 | 0 | 0 | 111.7 | S103 S107 S108 C109 | S103-G105 PolarHBondContact O-N 3.42Å; G105-S107 PolarHBondContact O-N 2.88Å; G105-S108 PolarHBondContact N-OG 2.96Å; G105-S108 PolarHBondContact O-N 3.04Å; G105-S108 PolarHBondContact O-OG 3.47Å; G105-C109 PolarHBondContact O-N 2.8Å | ||
| 106 | W | 70 | Confident | 57.7 | Low | 217 Ų | 217 | 106.5 Ų | 106.5 | 82% | 0.822 | 63% | 0.63 | S | S | * | * | H | α-helix | trans | -47.8 | -25.5 | 179.3 | 179.7 | -98.7 | 0 | 0 | 0 | 114 | C109 K110 | W106-C109 PolarHBondContact O-SG 3.38Å; W106-K110 WeakPolarHBondContact O-CB 3.33Å; W106-K110 PolarHBondContact O-N 2.83Å; W106-K110 VanDerWaalsContact O-N 3.13Å |
| 107 | S | 66.3 | Low | 59 | Low | 93 Ų | 93 | 107 Ų | 107 | 65% | 0.65 | 63% | 0.625 | S | S | * | * | H | α-helix | trans | -64.9 | -42.7 | 173 | 51.4 | 0 | 0 | 0 | 0 | 113.7 | G105 K110 A111 | G105-S107 PolarHBondContact O-N 2.88Å; S107-K110 PolarHBondContact O-N 3.13Å; S107-A111 PolarHBondContact O-N 3.31Å; S107-A111 VanDerWaalsContact O-N 3.14Å |
| 108 | S | 60.1 | Low | 60.2 | Low | 35 Ų | 35 | 108.5 Ų | 108.5 | 25% | 0.245 | 62% | 0.623 | C | S | . | * | H | α-helix | trans | -73.2 | -34.8 | 178.8 | 19 | 0 | 0 | 0 | 0 | 112.6 | M104 G105 K110 A111 L112 | M104-S108 VanDerWaalsContact CG-OG 3.3Å; M104-S108 WeakPolarHBondContact CG-OG 3.41Å; G105-S108 PolarHBondContact N-OG 2.96Å; G105-S108 PolarHBondContact O-N 3.04Å; G105-S108 PolarHBondContact O-OG 3.47Å; S108-K110 VanDerWaalsContact C-N 3.34Å; S108-A111 PolarHBondContact O-N 2.9Å; S108-L112 PolarHBondContact O-N 2.94Å; S108-L112 VanDerWaalsContact O-N 3.12Å |
| 109 | C | 71.4 | Confident | 61.2 | Low | 41 Ų | 41 | 106.5 Ų | 106.5 | 28% | 0.277 | 61% | 0.61 | S | S | . | * | H | α-helix | trans | -68 | -36.8 | 172.6 | 92.4 | 0 | 0 | 0 | 0 | 111.3 | G105 W106 A111 L112 L113 | G105-C109 PolarHBondContact O-N 2.8Å; W106-C109 PolarHBondContact O-SG 3.38Å; C109-A111 VanDerWaalsContact C-N 3.32Å; C109-A111 PolarHBondContact O-N 3.21Å; C109-L112 PolarHBondContact O-N 3.44Å; C109-L113 WeakPolarHBondContact O-CB 3.34Å; C109-L113 WeakPolarHBondContact O-CG 3.14Å; C109-L113 PolarHBondContact O-N 3.42Å |
| 110 | K | 73.3 | Confident | 61.7 | Low | 144 Ų | 144 | 106.8 Ų | 106.8 | 63% | 0.626 | 61% | 0.613 | S | S | * | * | H | α-helix | trans | -63.3 | -37.9 | 175.4 | -169.9 | 178 | 179.7 | -177.4 | 0 | 111.9 | W106 S107 S108 C114 | W106-K110 WeakPolarHBondContact O-CB 3.33Å; W106-K110 PolarHBondContact O-N 2.83Å; W106-K110 VanDerWaalsContact O-N 3.13Å; S107-K110 PolarHBondContact O-N 3.13Å; S108-K110 VanDerWaalsContact C-N 3.34Å; K110-C114 WeakPolarHBondContact O-CB 3.36Å; K110-C114 PolarHBondContact O-N 3.37Å |
| 111 | A | 71.3 | Confident | 62 | Low | 61 Ų | 61 | 106 Ų | 106 | 50% | 0.504 | 61% | 0.606 | S | S | . | * | H | α-helix | trans | -68.7 | -40.1 | 176.2 | 0 | 0 | 0 | 0 | 0 | 112.6 | S107 S108 C109 C114 R115 | S107-A111 PolarHBondContact O-N 3.31Å; S107-A111 VanDerWaalsContact O-N 3.14Å; S108-A111 PolarHBondContact O-N 2.9Å; C109-A111 VanDerWaalsContact C-N 3.32Å; C109-A111 PolarHBondContact O-N 3.21Å; A111-C114 PolarHBondContact O-N 3.44Å; A111-R115 WeakPolarHBondContact O-CB 3.5Å; A111-R115 PolarHBondContact O-N 3.43Å |
| 112 | L | 75 | Confident | 62.3 | Low | 105 Ų | 105 | 106.2 Ų | 106.2 | 55% | 0.55 | 61% | 0.607 | S | S | . | * | H | α-helix | trans | -65 | -45 | 174.5 | -89.6 | 155.1 | 0 | 0 | 0 | 112.2 | S108 C109 R115 M116 | S108-L112 PolarHBondContact O-N 2.94Å; S108-L112 VanDerWaalsContact O-N 3.12Å; C109-L112 PolarHBondContact O-N 3.44Å; L112-R115 PolarHBondContact O-N 3.08Å; L112-M116 WeakPolarHBondContact O-CG 3.29Å; L112-M116 PolarHBondContact O-N 3.28Å |
| 113 | L | 76.6 | Confident | 61.9 | Low | 100 Ų | 100 | 104.5 Ų | 104.5 | 52% | 0.524 | 61% | 0.609 | S | S | . | * | H | α-helix | trans | -64.1 | -41.1 | 175.7 | -73.3 | 167.6 | 0 | 0 | 0 | 111.6 | C109 R115 M116 L117 | C109-L113 WeakPolarHBondContact O-CB 3.34Å; C109-L113 WeakPolarHBondContact O-CG 3.14Å; C109-L113 PolarHBondContact O-N 3.42Å; L113-R115 VanDerWaalsContact C-N 3.32Å; L113-R115 PolarHBondContact O-N 2.88Å; L113-M116 PolarHBondContact O-N 2.89Å; L113-L117 VanDerWaalsContact O-CB 3.24Å; L113-L117 WeakPolarHBondContact O-CB 3.27Å; L113-L117 WeakPolarHBondContact O-CD1 3.43Å; L113-L117 VanDerWaalsContact O-CG 3.24Å; L113-L117 WeakPolarHBondContact O-CG 3.45Å; L113-L117 PolarHBondContact O-N 3.42Å |
| 114 | C | 69 | Low | 61.5 | Low | 71 Ų | 71 | 104.5 Ų | 104.5 | 48% | 0.48 | 61% | 0.609 | S | S | . | * | H | α-helix | trans | -64 | -39.1 | 174.5 | -169 | 0 | 0 | 0 | 0 | 111.2 | K110 A111 N118 | K110-C114 WeakPolarHBondContact O-CB 3.36Å; K110-C114 PolarHBondContact O-N 3.37Å; A111-C114 PolarHBondContact O-N 3.44Å; C114-N118 VanDerWaalsContact O-CB 3.31Å; C114-N118 WeakPolarHBondContact O-CB 3.2Å; C114-N118 PolarHBondContact O-N 2.9Å |
| 115 | R | 64.8 | Low | 60.5 | Low | 190 Ų | 190 | 109.3 Ų | 109.3 | 72% | 0.717 | 62% | 0.62 | S | S | * | * | H | α-helix | trans | -66.3 | -40.7 | 175.4 | -172 | 174.8 | -74.9 | -165.9 | -3.5 | 112.2 | A111 L112 L113 C119 | A111-R115 WeakPolarHBondContact O-CB 3.5Å; A111-R115 PolarHBondContact O-N 3.43Å; L112-R115 PolarHBondContact O-N 3.08Å; L113-R115 VanDerWaalsContact C-N 3.32Å; L113-R115 PolarHBondContact O-N 2.88Å; R115-C119 CarbonylContact O-C 3.55Å; R115-C119 WeakPolarHBondContact O-CA 3.11Å; R115-C119 WeakPolarHBondContact O-CB 3.37Å; R115-C119 PolarHBondContact O-N 2.9Å |
| 116 | M | 76.7 | Confident | 59.4 | Low | 121 Ų | 121 | 115.8 Ų | 115.8 | 60% | 0.596 | 64% | 0.642 | S | S | * | * | H | α-helix | trans | -70.9 | -35.7 | 178 | -67.3 | -102.3 | -70.8 | 0 | 0 | 112.9 | L112 L113 C121 | L112-M116 WeakPolarHBondContact O-CG 3.29Å; L112-M116 PolarHBondContact O-N 3.28Å; L113-M116 PolarHBondContact O-N 2.89Å; M116-C121 VanDerWaalsContact SD-SG 3.67Å |
| 117 | L | 70.1 | Confident | 58 | Low | 143 Ų | 143 | 111.7 Ų | 111.7 | 75% | 0.749 | 64% | 0.644 | S | S | * | * | H | α-helix | trans | -84.6 | -35.8 | -177 | -70.1 | 166.4 | 0 | 0 | 0 | 112.9 | L113 | L113-L117 VanDerWaalsContact O-CB 3.24Å; L113-L117 WeakPolarHBondContact O-CB 3.27Å; L113-L117 WeakPolarHBondContact O-CD1 3.43Å; L113-L117 VanDerWaalsContact O-CG 3.24Å; L113-L117 WeakPolarHBondContact O-CG 3.45Å; L113-L117 PolarHBondContact O-N 3.42Å |
| 118 | N | 60.4 | Low | 56.5 | Low | 145 Ų | 145 | 112.7 Ų | 112.7 | 78% | 0.775 | 65% | 0.65 | S | S | * | * | H | α-helix | trans | -95 | -19 | 178.7 | -96.9 | 19.8 | 0 | 0 | 0 | 114.1 | C114 | C114-N118 VanDerWaalsContact O-CB 3.31Å; C114-N118 WeakPolarHBondContact O-CB 3.2Å; C114-N118 PolarHBondContact O-N 2.9Å |
| 119 | C | 56 | Low | 55.7 | Low | 85 Ų | 85 | 118.7 Ų | 118.7 | 57% | 0.574 | 68% | 0.679 | S | S | * | * | S | Bend | trans | -120.4 | 94.3 | 175.3 | -158 | 0 | 0 | 0 | 0 | 107.2 | R115 C121 | R115-C119 CarbonylContact O-C 3.55Å; R115-C119 WeakPolarHBondContact O-CA 3.11Å; R115-C119 WeakPolarHBondContact O-CB 3.37Å; R115-C119 PolarHBondContact O-N 2.9Å; C119-C121 PolarHBondContact O-N 3.41Å |
| 120 | G | 45 | Very low | 54.1 | Low | 58 Ų | 58 | 122.7 Ų | 122.7 | 60% | 0.598 | 70% | 0.704 | S | S | * | * | trans | -48.6 | 127.8 | 177.7 | 0 | 0 | 0 | 0 | 0 | 110.4 | C122 | G120-C122 PolarHBondContact O-N 3.44Š| ||
| 121 | C | 45.3 | Very low | 52 | Low | 102 Ų | 102 | 122.3 Ų | 122.3 | 69% | 0.689 | 71% | 0.708 | S | S | * | * | trans | -61.7 | 95 | -179.9 | -67.4 | 0 | 0 | 0 | 0 | 110.6 | M116 C119 | M116-C121 VanDerWaalsContact SD-SG 3.67Å; C119-C121 PolarHBondContact O-N 3.41Å | ||
| 122 | C | 43.1 | Very low | 50.2 | Low | 128 Ų | 128 | 126.1 Ų | 126.1 | 87% | 0.865 | 72% | 0.719 | S | S | * | * | trans | -91.2 | 105.4 | 164.1 | -68.6 | 0 | 0 | 0 | 0 | 108.9 | G120 | G120-C122 PolarHBondContact O-N 3.44Š| ||
| 123 | G | 39.2 | Very low | 48.1 | Very low | 70 Ų | 70 | 129.3 Ų | 129.3 | 72% | 0.722 | 73% | 0.732 | S | S | * | * | trans | 37.8 | 125.7 | 146.9 | 0 | 0 | 0 | 0 | 0 | 121.6 | ||||
| 124 | S | 42.2 | Very low | 46 | Very low | 124 Ų | 124 | 130.3 Ų | 130.3 | 87% | 0.867 | 75% | 0.747 | S | S | * | * | trans | 61.9 | 111 | 144.7 | -172.3 | 0 | 0 | 0 | 0 | 118.8 | ||||
| 125 | R | 36.6 | Very low | 44.3 | Very low | 232 Ų | 232 | 132.4 Ų | 132.4 | 88% | 0.875 | 76% | 0.762 | S | S | * | * | 175.8 | 146.7 | 113.5 | -155.5 | 167.3 | -176.1 | -173.8 | -0.1 | 111 | |||||
| 126 | E | 36.2 | Very low | 42.9 | Very low | 167 Ų | 167 | 129.2 Ų | 129.2 | 78% | 0.78 | 76% | 0.764 | S | S | * | * | trans | -20.9 | 142.2 | 174.8 | -118 | 92.4 | 174 | 0 | 0 | 118.7 | S128 | E126-S128 PolarHBondContact O-N 3.48Š| ||
| 127 | P | 39.8 | Very low | 40.7 | Very low | 131 Ų | 131 | 130.8 Ų | 130.8 | 85% | 0.851 | 78% | 0.775 | S | S | * | * | trans | -76.9 | 107.3 | 166.6 | -1.4 | 18.9 | 0 | 0 | 0 | 111 | ||||
| 128 | S | 35.1 | Very low | 38.9 | Very low | 113 Ų | 113 | 132 Ų | 132 | 79% | 0.79 | 78% | 0.776 | S | S | * | * | P | Polyproline II helix | trans | -85.9 | 123.2 | 165.3 | 56.1 | 0 | 0 | 0 | 0 | 110.6 | E126 | E126-S128 PolarHBondContact O-N 3.48Š|
| 129 | L | 41.8 | Very low | 38.1 | Very low | 161 Ų | 161 | 130.3 Ų | 130.3 | 84% | 0.843 | 77% | 0.773 | S | S | * | * | P | Polyproline II helix | trans | -57 | 145.6 | 174.4 | -60.8 | 167.7 | 0 | 0 | 0 | 112.1 | ||
| 130 | P | 38.1 | Very low | 37 | Very low | 125 Ų | 125 | 132.4 Ų | 132.4 | 81% | 0.812 | 78% | 0.784 | S | S | * | * | P | Polyproline II helix | trans | -88.6 | 121.2 | 162.8 | 30.5 | -26.5 | 0 | 0 | 0 | 111.4 | ||
| 131 | I | 30.4 | Very low | 36.4 | Very low | 136 Ų | 136 | 138.9 Ų | 138.9 | 70% | 0.697 | 80% | 0.796 | S | S | * | * | P | Polyproline II helix | trans | -68.3 | 136.2 | 167.6 | -96.3 | 156.1 | 0 | 0 | 0 | 110.5 | E133 | I131-E133 HydrophobicContact CG2-CG 3.89Å; I131-E133 VanDerWaalsContact CG2-OE1 3.23Å; I131-E133 WeakPolarHBondContact CG2-OE1 3.21Å |
| 132 | N | 32.1 | Very low | 35.7 | Very low | 141 Ų | 141 | 140 Ų | 140 | 75% | 0.754 | 80% | 0.804 | S | S | * | * | trans | -81.5 | 110.9 | 169.5 | 46.4 | -71.9 | 0 | 0 | 0 | 110.7 | ||||
| 133 | E | 31.9 | Very low | 34.9 | Very low | 173 Ų | 173 | 137.7 Ų | 137.7 | 81% | 0.808 | 80% | 0.803 | S | S | * | * | trans | -164.6 | 128.6 | 150.2 | 30.2 | -139.6 | 132.9 | 0 | 0 | 113.3 | I131 | I131-E133 HydrophobicContact CG2-CG 3.89Å; I131-E133 VanDerWaalsContact CG2-OE1 3.23Å; I131-E133 WeakPolarHBondContact CG2-OE1 3.21Å | ||
| 134 | S | 31.9 | Very low | 34.4 | Very low | 120 Ų | 120 | 138.5 Ų | 138.5 | 84% | 0.839 | 81% | 0.811 | S | S | * | * | trans | -86.4 | 134.4 | 171.6 | 159 | 0 | 0 | 0 | 0 | 108.8 | ||||
| 135 | S | 33.2 | Very low | 33.9 | Very low | 115 Ų | 115 | 140.8 Ų | 140.8 | 80% | 0.804 | 81% | 0.808 | S | S | * | * | trans | -169.9 | 128.2 | 135.2 | -165.3 | 0 | 0 | 0 | 0 | 112.3 | ||||
| 136 | T | 36.7 | Very low | 34.2 | Very low | 123 Ų | 123 | 135.3 Ų | 135.3 | 76% | 0.755 | 80% | 0.802 | S | S | * | * | trans | -49.7 | 135.6 | 160.3 | -64.4 | 0 | 0 | 0 | 0 | 112.9 | ||||
| 137 | D | 29.5 | Very low | 34.3 | Very low | 155 Ų | 155 | 130.9 Ų | 130.9 | 83% | 0.829 | 79% | 0.79 | S | S | * | * | -164.4 | 143.6 | 127.8 | -135.8 | -12.4 | 0 | 0 | 0 | 112.5 | |||||
| 138 | H | 33.1 | Very low | 34 | Very low | 168 Ų | 168 | 132.1 Ų | 132.1 | 78% | 0.778 | 79% | 0.789 | S | S | * | * | trans | -114.8 | 155.2 | 173.6 | -95 | -61.4 | 0 | 0 | 0 | 107.1 | ||||
| 139 | P | 43.3 | Very low | 33.7 | Very low | 109 Ų | 109 | 130.1 Ų | 130.1 | 71% | 0.708 | 79% | 0.786 | S | S | * | * | -157.1 | 160 | 72.2 | 38.9 | -16.2 | 0 | 0 | 0 | 119.6 | |||||
| 140 | T | 33.5 | Very low | 33.4 | Very low | 130 Ų | 130 | 131.9 Ų | 131.9 | 80% | 0.798 | 79% | 0.792 | S | S | * | * | trans | 43.8 | 137.9 | 148.1 | 54.5 | 0 | 0 | 0 | 0 | 120.8 | ||||
| 141 | K | 32.1 | Very low | 33.1 | Very low | 194 Ų | 194 | 130.1 Ų | 130.1 | 84% | 0.843 | 79% | 0.789 | S | S | * | * | cis | -176.6 | 150 | 45.7 | -161.5 | 175.7 | -179.7 | 177.9 | 0 | 112 | ||||
| 142 | S | 29.2 | Very low | 33.6 | Very low | 124 Ų | 124 | 130.6 Ų | 130.6 | 87% | 0.867 | 79% | 0.792 | S | S | * | * | trans | 74.1 | 134.2 | 161.4 | 84 | 0 | 0 | 0 | 0 | 118.1 | ||||
| 143 | G | 26.8 | Very low | 33.7 | Very low | 81 Ų | 81 | 130.5 Ų | 130.5 | 84% | 0.835 | 80% | 0.797 | S | S | * | * | cis | 171.2 | 149.3 | 0.3 | 0 | 0 | 0 | 0 | 0 | 108.6 | ||||
| 144 | G | 29 | Very low | 33.9 | Very low | 87 Ų | 87 | 128.8 Ų | 128.8 | 90% | 0.897 | 79% | 0.793 | S | S | * | * | trans | 120.1 | 98 | 165 | 0 | 0 | 0 | 0 | 0 | 115.8 | ||||
| 145 | E | 32.3 | Very low | 33.9 | Very low | 172 Ų | 172 | 128.4 Ų | 128.4 | 80% | 0.804 | 79% | 0.79 | S | S | * | * | trans | -125 | 141.5 | 153.2 | 166.5 | 163.4 | -162.1 | 0 | 0 | 105.9 | ||||
| 146 | P | 43 | Very low | 33.9 | Very low | 117 Ų | 117 | 128.7 Ų | 128.7 | 76% | 0.76 | 79% | 0.787 | S | S | * | * | -140.9 | 134.8 | 94.7 | 24 | -0.4 | 0 | 0 | 0 | 116.6 | |||||
| 147 | S | 37.2 | Very low | 33.9 | Very low | 73 Ų | 73 | 128.6 Ų | 128.6 | 51% | 0.51 | 79% | 0.79 | S | S | . | * | 65.8 | 124.2 | 118.6 | 111.9 | 0 | 0 | 0 | 0 | 122.7 | |||||
| 148 | N | 33.5 | Very low | 34.1 | Very low | 158 Ų | 158 | 127 Ų | 127 | 85% | 0.845 | 79% | 0.786 | S | S | * | * | trans | 69.8 | 120 | 131.6 | -55.8 | -29.5 | 0 | 0 | 0 | 122 | ||||
| 149 | G | 30.3 | Very low | 34.1 | Very low | 70 Ų | 70 | 125.4 Ų | 125.4 | 72% | 0.722 | 79% | 0.788 | S | S | * | * | 119.5 | 122.6 | 125.8 | 0 | 0 | 0 | 0 | 0 | 119.8 | |||||
| 150 | M | 35 | Very low | 33.3 | Very low | 198 Ų | 198 | 125.4 Ų | 125.4 | 98% | 0.975 | 79% | 0.79 | S | S | * | * | trans | 73.4 | 147.9 | 152.3 | -47.4 | -179 | 89.3 | 0 | 0 | 116.4 | ||||
| 151 | A | 30.8 | Very low | 33.6 | Very low | 89 Ų | 89 | 127.8 Ų | 127.8 | 74% | 0.736 | 80% | 0.795 | S | S | * | * | cis | -157.8 | 157.4 | 18.5 | 0 | 0 | 0 | 0 | 0 | 111.9 | ||||
| 152 | L | 42.3 | Very low | 33.6 | Very low | 145 Ų | 145 | 127.2 Ų | 127.2 | 76% | 0.759 | 80% | 0.795 | S | S | * | * | trans | -54.6 | 140.2 | 163.2 | -103.2 | 63.1 | 0 | 0 | 0 | 112.2 | ||||
| 153 | T | 34.2 | Very low | 34.1 | Very low | 140 Ų | 140 | 126.1 Ų | 126.1 | 86% | 0.859 | 79% | 0.785 | S | S | * | * | trans | -137.4 | 107.6 | 149.2 | 56 | 0 | 0 | 0 | 0 | 110.5 | ||||
| 154 | N | 36.1 | Very low | 34.3 | Very low | 137 Ų | 137 | 125.6 Ų | 125.6 | 73% | 0.733 | 78% | 0.78 | S | S | * | * | trans | -78.3 | 134.5 | 165.6 | -55.7 | -40.2 | 0 | 0 | 0 | 108.3 | ||||
| 155 | S | 30.5 | Very low | 34.5 | Very low | 112 Ų | 112 | 131.7 Ų | 131.7 | 78% | 0.783 | 78% | 0.781 | S | S | * | * | trans | -106.4 | 91 | 170.8 | 179.9 | 0 | 0 | 0 | 0 | 110.2 | ||||
| 156 | T | 34.8 | Very low | 34.6 | Very low | 121 Ų | 121 | 129.6 Ų | 129.6 | 74% | 0.742 | 78% | 0.78 | S | S | * | * | trans | -96.2 | 118.6 | 158.5 | -64.6 | 0 | 0 | 0 | 0 | 107 | V158 | T156-V158 HydrophobicContact CG2-CG2 4.22Š| ||
| 157 | C | 35.6 | Very low | 34.1 | Very low | 120 Ų | 120 | 129.8 Ų | 129.8 | 81% | 0.811 | 78% | 0.779 | S | S | * | * | trans | -119.9 | 103.5 | 167.3 | -72.9 | 0 | 0 | 0 | 0 | 109.5 | ||||
| 158 | V | 34.4 | Very low | 34.2 | Very low | 123 Ų | 123 | 135.6 Ų | 135.6 | 75% | 0.745 | 80% | 0.796 | S | S | * | * | trans | -89.5 | 162 | 160.6 | 170 | 0 | 0 | 0 | 0 | 108 | T156 | T156-V158 HydrophobicContact CG2-CG2 4.22Š| ||
| 159 | V | 33.2 | Very low | 34.7 | Very low | 133 Ų | 133 | 134.1 Ų | 134.1 | 81% | 0.806 | 80% | 0.798 | S | S | * | * | trans | 123.5 | 129.3 | 159.8 | 177.8 | 0 | 0 | 0 | 0 | 110 | ||||
| 160 | S | 26.1 | Very low | 35.2 | Very low | 109 Ų | 109 | 135.2 Ų | 135.2 | 76% | 0.762 | 80% | 0.8 | S | S | * | * | cis | -158.3 | 147 | 23.8 | -149 | 0 | 0 | 0 | 0 | 111.5 | ||||
| 161 | M | 38.6 | Very low | 35.4 | Very low | 181 Ų | 181 | 137.2 Ų | 137.2 | 89% | 0.892 | 80% | 0.797 | S | S | * | * | trans | -96.1 | 147.4 | 155.3 | -75.9 | -175.6 | 74.3 | 0 | 0 | 109.4 | ||||
| 162 | E | 33.4 | Very low | 35.8 | Very low | 181 Ų | 181 | 138.9 Ų | 138.9 | 85% | 0.846 | 80% | 0.797 | S | S | * | * | trans | -156.2 | 150.2 | 152.8 | -112.8 | -77 | 124.2 | 0 | 0 | 110 | ||||
| 163 | P | 38.7 | Very low | 35.9 | Very low | 102 Ų | 102 | 136.7 Ų | 136.7 | 66% | 0.662 | 79% | 0.792 | S | S | * | * | trans | -115 | 155.1 | -160.2 | 37.6 | -23.1 | 0 | 0 | 0 | 116.5 | ||||
| 164 | G | 31.8 | Very low | 36.5 | Very low | 70 Ų | 70 | 137 Ų | 137 | 72% | 0.722 | 79% | 0.794 | S | S | * | * | trans | 96 | 110.2 | 134.6 | 0 | 0 | 0 | 0 | 0 | 120.7 | ||||
| 165 | K | 32.1 | Very low | 37 | Very low | 215 Ų | 215 | 135.3 Ų | 135.3 | 94% | 0.935 | 79% | 0.792 | S | S | * | * | 179.7 | 154.7 | 122.6 | -95.2 | 163.8 | -171.9 | 175.8 | 0 | 112.3 | |||||
| 166 | T | 35 | Very low | 38.2 | Very low | 127 Ų | 127 | 134.7 Ų | 134.7 | 78% | 0.779 | 78% | 0.777 | S | S | * | * | trans | -96 | 167.1 | -148.8 | 46.9 | 0 | 0 | 0 | 0 | 116.6 | ||||
| 167 | T | 33.7 | Very low | 39.2 | Very low | 121 Ų | 121 | 133.8 Ų | 133.8 | 74% | 0.742 | 78% | 0.776 | S | S | * | * | trans | 104.5 | 105.8 | 147.4 | -29.3 | 0 | 0 | 0 | 0 | 117.1 | ||||
| 168 | K | 37.8 | Very low | 40.3 | Very low | 196 Ų | 196 | 135.8 Ų | 135.8 | 85% | 0.852 | 77% | 0.771 | S | S | * | * | 179.2 | 127 | 109 | -88.9 | 163.1 | -169.8 | -178.5 | 0 | 109.5 | A170 | K168-A170 PolarHBondContact O-N 3.01Š| |||
| 169 | S | 45.3 | Very low | 42 | Very low | 127 Ų | 127 | 134.1 Ų | 134.1 | 89% | 0.888 | 75% | 0.752 | S | S | * | * | trans | -65.3 | 124.2 | 175.3 | 58.5 | 0 | 0 | 0 | 0 | 110.1 | ||||
| 170 | A | 40.3 | Very low | 44 | Very low | 93 Ų | 93 | 133.9 Ų | 133.9 | 77% | 0.769 | 74% | 0.737 | S | S | * | * | trans | -108.2 | 117.8 | 162.9 | 0 | 0 | 0 | 0 | 0 | 106.8 | K168 V172 | K168-A170 PolarHBondContact O-N 3.01Å; A170-V172 PolarHBondContact O-N 2.87Å | ||
| 171 | R | 39.2 | Very low | 45.9 | Very low | 240 Ų | 240 | 137 Ų | 137 | 91% | 0.906 | 74% | 0.739 | S | S | * | * | P | Polyproline II helix | trans | -46.6 | 127 | 175.5 | -68.7 | 178.6 | -175.1 | -166.5 | 0.6 | 109.7 | P173 | R171-P173 VanDerWaalsContact O-CD 3.26Å; R171-P173 WeakPolarHBondContact O-CD 3.21Å |
| 172 | V | 38.8 | Very low | 47.7 | Very low | 124 Ų | 124 | 134.3 Ų | 134.3 | 75% | 0.752 | 73% | 0.729 | S | S | * | * | P | Polyproline II helix | trans | -64.3 | 120 | 166.3 | 178 | 0 | 0 | 0 | 0 | 107.8 | A170 T174 | A170-V172 PolarHBondContact O-N 2.87Å; V172-T174 PolarHBondContact O-N 3.22Å |
| 173 | P | 44.2 | Very low | 49.7 | Very low | 99 Ų | 99 | 128.2 Ų | 128.2 | 64% | 0.643 | 70% | 0.704 | S | S | * | * | P | Polyproline II helix | trans | -69.8 | 118.6 | 165.4 | -13.5 | 30 | 0 | 0 | 0 | 108.3 | R171 S175 | R171-P173 VanDerWaalsContact O-CD 3.26Å; R171-P173 WeakPolarHBondContact O-CD 3.21Å; P173-S175 PolarHBondContact O-N 3.34Å |
| 174 | T | 46.3 | Very low | 51.8 | Low | 147 Ų | 147 | 130.7 Ų | 130.7 | 90% | 0.902 | 70% | 0.7 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -71.8 | 31.7 | -172.9 | -25 | 0 | 0 | 0 | 0 | 114.5 | V172 | V172-T174 PolarHBondContact O-N 3.22Š|
| 175 | S | 47.5 | Very low | 53.5 | Low | 100 Ų | 100 | 134.6 Ų | 134.6 | 70% | 0.699 | 70% | 0.697 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -144.8 | 20.3 | -175.7 | 75.1 | 0 | 0 | 0 | 0 | 116.2 | P173 | P173-S175 PolarHBondContact O-N 3.34Š|
| 176 | E | 55.6 | Low | 55.5 | Low | 99 Ų | 99 | 136.7 Ų | 136.7 | 46% | 0.463 | 70% | 0.699 | S | S | . | * | trans | -133.8 | 42.9 | -172.3 | -149.6 | 81.9 | -123.5 | 0 | 0 | 113.6 | F178 R179 | E176-F178 VanDerWaalsContact C-N 3.26Å; E176-F178 PolarHBondContact O-N 3.48Å; E176-R179 VanDerWaalsContact CD-CZ 3.45Å; E176-R179 HydrophobicContact CG-CB 4.34Å; E176-R179 HydrophobicContact CG-CG 4.12Å; E176-R179 IonicContact OE1-CZ 3.13Å; E176-R179 IonicContact OE1-NE 2.67Å; E176-R179 PolarHBondContact OE1-NE 2.88Å; E176-R179 IonicContact OE1-NH2 2.97Å; E176-R179 PolarHBondContact OE1-NH2 3.47Å; E176-R179 IonicContact OE2-CZ 3.62Å; E176-R179 IonicContact OE2-NE 3.69Å; E176-R179 IonicContact OE2-NH2 2.75Å; E176-R179 PolarHBondContact OE2-NH2 2.92Å | ||
| 177 | S | 55.4 | Low | 57.5 | Low | 103 Ų | 103 | 133.1 Ų | 133.1 | 72% | 0.72 | 69% | 0.687 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -74.5 | -3.3 | -170.9 | -165.9 | 0 | 0 | 0 | 0 | 115.8 | ||
| 178 | F | 58.8 | Low | 59.5 | Low | 162 Ų | 162 | 134.6 Ų | 134.6 | 71% | 0.711 | 69% | 0.686 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -123 | 12.8 | -172.5 | -64.2 | -74.7 | 0 | 0 | 0 | 114.8 | E176 | E176-F178 VanDerWaalsContact C-N 3.26Å; E176-F178 PolarHBondContact O-N 3.48Å |
| 179 | R | 70.8 | Confident | 61.7 | Low | 88 Ų | 88 | 129.9 Ų | 129.9 | 33% | 0.332 | 67% | 0.669 | S | S | . | * | trans | -97.5 | 105.7 | 174.5 | -67.7 | -150.1 | -97 | -171.1 | -5.6 | 110.5 | E176 Q181 Y192 | E176-R179 VanDerWaalsContact CD-CZ 3.45Å; E176-R179 HydrophobicContact CG-CB 4.34Å; E176-R179 HydrophobicContact CG-CG 4.12Å; E176-R179 IonicContact OE1-CZ 3.13Å; E176-R179 IonicContact OE1-NE 2.67Å; E176-R179 PolarHBondContact OE1-NE 2.88Å; E176-R179 IonicContact OE1-NH2 2.97Å; E176-R179 PolarHBondContact OE1-NH2 3.47Å; E176-R179 IonicContact OE2-CZ 3.62Å; E176-R179 IonicContact OE2-NE 3.69Å; E176-R179 IonicContact OE2-NH2 2.75Å; E176-R179 PolarHBondContact OE2-NH2 2.92Å; R179-Q181 PolarHBondContact O-N 3.43Å; R179-Y192 HydrophobicContact CB-CD2 4.36Å; R179-Y192 HydrophobicContact CB-CE2 4.33Å; R179-Y192 HydrophobicContact CG-CD2 4.06Å; R179-Y192 HydrophobicContact CG-CE2 4.38Å; R179-Y192 HydrophobicContact CG-CG 4.24Å | ||
| 180 | Y | 75.4 | Confident | 63.3 | Low | 128 Ų | 128 | 125.9 Ų | 125.9 | 50% | 0.502 | 64% | 0.639 | S | S | . | * | trans | -86.7 | 98.9 | 178.6 | -65.6 | -80 | 0 | 0 | 0 | 109.9 | D182 V183 | Y180-D182 WeakPolarHBondContact CA-OD1 3.35Å; Y180-D182 VanDerWaalsContact CB-OD1 3.3Å; Y180-D182 WeakPolarHBondContact CB-OD1 3.38Å; Y180-D182 PolarHBondContact O-N 3.38Å; Y180-V183 HydrophobicContact CG-CG2 4.37Å; Y180-V183 PolarHBondContact O-N 2.89Å | ||
| 181 | Q | 66.4 | Low | 65.1 | Low | 173 Ų | 173 | 128.7 Ų | 128.7 | 81% | 0.808 | 64% | 0.641 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -67.6 | -13.9 | 178 | -83.9 | 173.5 | -5 | 0 | 0 | 113.5 | R179 | R179-Q181 PolarHBondContact O-N 3.43Š|
| 182 | D | 75.5 | Confident | 66.9 | Low | 125 Ų | 125 | 121 Ų | 121 | 67% | 0.668 | 61% | 0.613 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -87.3 | -13.8 | 179.3 | 55.2 | -37 | 0 | 0 | 0 | 113.6 | Y180 R184 | Y180-D182 WeakPolarHBondContact CA-OD1 3.35Å; Y180-D182 VanDerWaalsContact CB-OD1 3.3Å; Y180-D182 WeakPolarHBondContact CB-OD1 3.38Å; Y180-D182 PolarHBondContact O-N 3.38Å; D182-R184 PolarHBondContact O-N 2.92Å |
| 183 | V | 75.3 | Confident | 68.3 | Low | 53 Ų | 53 | 120.7 Ų | 120.7 | 32% | 0.321 | 61% | 0.613 | S | S | . | * | trans | -80.4 | 120.3 | 179.5 | 176.7 | 0 | 0 | 0 | 0 | 110.7 | Y180 F185 V190 | Y180-V183 HydrophobicContact CG-CG2 4.37Å; Y180-V183 PolarHBondContact O-N 2.89Å; V183-F185 HydrophobicContact CG1-CD2 4.43Å; V183-F185 HydrophobicContact CG1-CE2 3.94Å; V183-V190 HydrophobicContact CG1-CG2 4.12Å | ||
| 184 | R | 83.6 | Confident | 69.4 | Low | 155 Ų | 155 | 120.8 Ų | 120.8 | 59% | 0.585 | 61% | 0.612 | S | S | * | * | E | Extended strand (participates in β ladder) | trans | -126.9 | 130.2 | 176.6 | -60.2 | 179.3 | -177.4 | -140.6 | 4.4 | 110.6 | D182 E188 I189 | D182-R184 PolarHBondContact O-N 2.92Å; R184-E188 CarbonylContact C-O 3.54Å; R184-E188 WeakPolarHBondContact CA-O 3.16Å; R184-E188 WeakPolarHBondContact CB-O 3.46Å; R184-I189 HydrophobicContact CG-CG1 4.24Å |
| 185 | F | 65.9 | Low | 69.5 | Low | 151 Ų | 151 | 120.8 Ų | 120.8 | 66% | 0.662 | 61% | 0.606 | S | S | * | * | E | Extended strand (participates in β ladder) | trans | -99.5 | 124.2 | 167.3 | -71.3 | -85.7 | 0 | 0 | 0 | 108.2 | V183 G187 E188 V190 | V183-F185 HydrophobicContact CG1-CD2 4.43Å; V183-F185 HydrophobicContact CG1-CE2 3.94Å; F185-G187 PolarHBondContact O-N 2.83Å; F185-G187 VanDerWaalsContact O-N 3.09Å; F185-E188 PolarHBondContact N-O 3.01Å; F185-E188 PolarHBondContact O-N 3.15Å; F185-V190 HydrophobicContact CD2-CG2 3.43Å; F185-V190 VanDerWaalsContact CD2-CG2 3.43Å; F185-V190 HydrophobicContact CE2-CG2 3.73Å |
| 186 | R | 75.7 | Confident | 69.5 | Low | 260 Ų | 260 | 121.4 Ų | 121.4 | 98% | 0.981 | 61% | 0.608 | S | S | * | * | T | Hydrogen-bonded Turn | trans | 56.6 | 26.7 | -179.1 | -150.6 | -177.6 | -155.5 | -84.1 | -0.7 | 114.1 | E188 | R186-E188 VanDerWaalsContact C-N 3.35Š|
| 187 | G | 76.7 | Confident | 68.9 | Low | 51 Ų | 51 | 122.1 Ų | 122.1 | 53% | 0.526 | 62% | 0.624 | S | S | . | * | T | Hydrogen-bonded Turn | trans | 87.6 | -5.9 | -177.8 | 0 | 0 | 0 | 0 | 0 | 115.2 | F185 | F185-G187 PolarHBondContact O-N 2.83Å; F185-G187 VanDerWaalsContact O-N 3.09Å |
| 188 | E | 75.8 | Confident | 68.2 | Low | 153 Ų | 153 | 127.3 Ų | 127.3 | 72% | 0.715 | 63% | 0.633 | S | S | * | * | E | Extended strand (participates in β ladder) | trans | -96.7 | 137.4 | -179.2 | -164.9 | 171.8 | -177.5 | 0 | 0 | 111.5 | R184 F185 R186 | R184-E188 CarbonylContact C-O 3.54Å; R184-E188 WeakPolarHBondContact CA-O 3.16Å; R184-E188 WeakPolarHBondContact CB-O 3.46Å; F185-E188 PolarHBondContact N-O 3.01Å; F185-E188 PolarHBondContact O-N 3.15Å; R186-E188 VanDerWaalsContact C-N 3.35Å |
| 189 | I | 83.8 | Confident | 67.8 | Low | 97 Ų | 97 | 130.5 Ų | 130.5 | 50% | 0.497 | 64% | 0.641 | S | S | . | * | E | Extended strand (participates in β ladder) | trans | -74.3 | 132.5 | -177.9 | -61.4 | 171 | 0 | 0 | 0 | 109.2 | R184 N191 | R184-I189 HydrophobicContact CG-CG1 4.24Å; I189-N191 PolarHBondContact O-N 3.04Å |
| 190 | V | 78.8 | Confident | 66.1 | Low | 43 Ų | 43 | 132.5 Ų | 132.5 | 26% | 0.261 | 66% | 0.663 | S | S | . | * | P | Polyproline II helix | trans | -68.6 | 119.4 | 177.3 | 179.7 | 0 | 0 | 0 | 0 | 110.3 | V183 F185 Y192 | V183-V190 HydrophobicContact CG1-CG2 4.12Å; F185-V190 HydrophobicContact CD2-CG2 3.43Å; F185-V190 VanDerWaalsContact CD2-CG2 3.43Å; F185-V190 HydrophobicContact CE2-CG2 3.73Å; V190-Y192 HydrophobicContact CB-CE2 4.35Å; V190-Y192 HydrophobicContact CG1-CE1 4.13Å; V190-Y192 HydrophobicContact CG1-CE2 4.15Å |
| 191 | N | 77.8 | Confident | 64.6 | Low | 151 Ų | 151 | 138.1 Ų | 138.1 | 81% | 0.807 | 68% | 0.683 | S | S | * | * | P | Polyproline II helix | trans | -90.6 | 120.1 | 175.5 | -162.5 | 7 | 0 | 0 | 0 | 110.3 | I189 | I189-N191 PolarHBondContact O-N 3.04Š|
| 192 | Y | 76.4 | Confident | 63.4 | Low | 80 Ų | 80 | 135.3 Ų | 135.3 | 31% | 0.314 | 68% | 0.68 | S | S | . | * | P | Polyproline II helix | trans | -94.4 | 121.3 | 179.7 | -62.6 | -86.2 | 0 | 0 | 0 | 110 | R179 V190 V194 | R179-Y192 HydrophobicContact CB-CD2 4.36Å; R179-Y192 HydrophobicContact CB-CE2 4.33Å; R179-Y192 HydrophobicContact CG-CD2 4.06Å; R179-Y192 HydrophobicContact CG-CE2 4.38Å; R179-Y192 HydrophobicContact CG-CG 4.24Å; V190-Y192 HydrophobicContact CB-CE2 4.35Å; V190-Y192 HydrophobicContact CG1-CE1 4.13Å; V190-Y192 HydrophobicContact CG1-CE2 4.15Å; Y192-V194 PolarHBondContact O-N 3.37Å |
| 193 | P | 68.5 | Low | 62 | Low | 117 Ų | 117 | 135.5 Ų | 135.5 | 76% | 0.76 | 69% | 0.688 | S | S | * | * | P | Polyproline II helix | trans | -66.2 | 124 | 177.1 | 25.6 | -31.5 | 0 | 0 | 0 | 110.5 | ||
| 194 | V | 67 | Low | 60.3 | Low | 101 Ų | 101 | 137.9 Ų | 137.9 | 61% | 0.612 | 71% | 0.713 | S | S | * | * | trans | -91.2 | 111 | 176.1 | 179.2 | 0 | 0 | 0 | 0 | 108.6 | Y192 | Y192-V194 PolarHBondContact O-N 3.37Š| ||
| 195 | N | 47.9 | Very low | 58.4 | Low | 147 Ų | 147 | 140.9 Ų | 140.9 | 79% | 0.786 | 73% | 0.731 | S | S | * | * | trans | -78 | 129 | 169.5 | -71.9 | -40.7 | 0 | 0 | 0 | 109.6 | S197 | N195-S197 PolarHBondContact O-N 2.97Š| ||
| 196 | P | 48 | Very low | 57.2 | Low | 113 Ų | 113 | 137.2 Ų | 137.2 | 73% | 0.734 | 74% | 0.735 | S | S | * | * | trans | -69.1 | 120.5 | 179 | 25.9 | -31.8 | 0 | 0 | 0 | 111 | K198 | P196-K198 PolarHBondContact O-N 3.3Å; P196-K198 VanDerWaalsContact O-N 3.15Å | ||
| 197 | S | 43.4 | Very low | 55.2 | Low | 114 Ų | 114 | 134 Ų | 134 | 80% | 0.797 | 73% | 0.731 | S | S | * | * | trans | -60.7 | 108.9 | 175.1 | -177.2 | 0 | 0 | 0 | 0 | 110.9 | N195 R199 | N195-S197 PolarHBondContact O-N 2.97Å; S197-R199 PolarHBondContact O-N 2.9Å; S197-R199 VanDerWaalsContact O-N 3.17Å | ||
| 198 | K | 41.6 | Very low | 53.5 | Low | 212 Ų | 212 | 136.6 Ų | 136.6 | 92% | 0.922 | 74% | 0.741 | S | S | * | * | trans | -78.5 | 92 | 170.9 | -69 | -178.1 | -178.1 | 177.1 | 0 | 109.5 | P196 | P196-K198 PolarHBondContact O-N 3.3Å; P196-K198 VanDerWaalsContact O-N 3.15Å | ||
| 199 | R | 48.6 | Very low | 51.9 | Low | 228 Ų | 228 | 138.6 Ų | 138.6 | 86% | 0.86 | 75% | 0.751 | S | S | * | * | trans | -103.8 | 123.2 | 162.8 | -159.7 | 178.2 | -164 | 151.8 | 3.8 | 107.6 | S197 | S197-R199 PolarHBondContact O-N 2.9Å; S197-R199 VanDerWaalsContact O-N 3.17Å | ||
| 200 | T | 36.5 | Very low | 50.1 | Low | 131 Ų | 131 | 145 Ų | 145 | 80% | 0.804 | 77% | 0.769 | S | S | * | * | trans | 167.8 | 111.3 | 141 | -64.2 | 0 | 0 | 0 | 0 | 110.4 | ||||
| 201 | R | 43.1 | Very low | 48.7 | Very low | 246 Ų | 246 | 148.8 Ų | 148.8 | 93% | 0.928 | 79% | 0.794 | S | S | * | * | trans | -137.3 | 134.7 | 145 | -89.9 | -168.6 | -179.3 | 177.7 | 1.3 | 108.3 | ||||
| 202 | P | 41.9 | Very low | 47 | Very low | 113 Ų | 113 | 149.6 Ų | 149.6 | 73% | 0.734 | 80% | 0.797 | S | S | * | * | P | Polyproline II helix | trans | -85.4 | 167 | -179.2 | 35.4 | -33.3 | 0 | 0 | 0 | 112.2 | ||
| 203 | P | 45.9 | Very low | 45.4 | Very low | 129 Ų | 129 | 150.1 Ų | 150.1 | 84% | 0.838 | 81% | 0.812 | S | S | * | * | P | Polyproline II helix | trans | -86.2 | 134.1 | -172.8 | 34 | -30.7 | 0 | 0 | 0 | 111.5 | ||
| 204 | A | 38.8 | Very low | 44.1 | Very low | 104 Ų | 104 | 151.5 Ų | 151.5 | 86% | 0.86 | 81% | 0.813 | S | S | * | * | P | Polyproline II helix | trans | -103.6 | 124.8 | 168.2 | 0 | 0 | 0 | 0 | 0 | 110 | ||
| 205 | K | 44.9 | Very low | 42.6 | Very low | 218 Ų | 218 | 153.4 Ų | 153.4 | 95% | 0.948 | 83% | 0.825 | S | S | * | * | P | Polyproline II helix | trans | -76.4 | 151.5 | 171.3 | -75.7 | 178.9 | 169.9 | -177.9 | 0 | 111.1 | ||
| 206 | G | 39.2 | Very low | 42.4 | Very low | 73 Ų | 73 | 152 Ų | 152 | 75% | 0.753 | 83% | 0.827 | S | S | * | * | trans | 150.1 | 84.1 | 165.2 | 0 | 0 | 0 | 0 | 0 | 109.4 | ||||
| 207 | E | 34.9 | Very low | 42.3 | Very low | 193 Ų | 193 | 154.2 Ų | 154.2 | 90% | 0.902 | 83% | 0.832 | S | S | * | * | 73.9 | 99.4 | 86.5 | -164.2 | 159.8 | -152 | 0 | 0 | 114.3 | |||||
| 208 | S | 41.2 | Very low | 42.5 | Very low | 105 Ų | 105 | 156.5 Ų | 156.5 | 73% | 0.734 | 83% | 0.834 | S | S | * | * | trans | 48.8 | 112.7 | 141 | -160.7 | 0 | 0 | 0 | 0 | 120.1 | ||||
| 209 | Q | 41.6 | Very low | 42.4 | Very low | 196 Ų | 196 | 152.3 Ų | 152.3 | 92% | 0.916 | 83% | 0.832 | S | S | * | * | -163.7 | 149.4 | 117.8 | -103.4 | 175.8 | 31.4 | 0 | 0 | 112.2 | |||||
| 210 | R | 46.5 | Very low | 42.5 | Very low | 231 Ų | 231 | 147.9 Ų | 147.9 | 87% | 0.872 | 83% | 0.825 | S | S | * | * | trans | -65.6 | 164.4 | -166.1 | -96.7 | -177.4 | 175.2 | 95.6 | -2.5 | 115.6 | ||||
| 211 | P | 49.8 | Very low | 42.6 | Very low | 123 Ų | 123 | 148.4 Ų | 148.4 | 80% | 0.799 | 82% | 0.823 | S | S | * | * | trans | -82 | 132.7 | 179 | 33.6 | -30.4 | 0 | 0 | 0 | 111.2 | ||||
| 212 | I | 42.1 | Very low | 42.5 | Very low | 168 Ų | 168 | 142.1 Ų | 142.1 | 86% | 0.862 | 82% | 0.815 | S | S | * | * | trans | -127.6 | 133.3 | 164.5 | -59.1 | 175.4 | 0 | 0 | 0 | 108.6 | ||||
| 213 | S | 42.7 | Very low | 42.9 | Very low | 91 Ų | 91 | 147 Ų | 147 | 64% | 0.636 | 82% | 0.821 | S | S | * | * | trans | -87.9 | 145.6 | -163 | 47.2 | 0 | 0 | 0 | 0 | 114.7 | ||||
| 214 | N | 40.3 | Very low | 42.7 | Very low | 145 Ų | 145 | 147 Ų | 147 | 78% | 0.775 | 81% | 0.813 | S | S | * | * | trans | 73.1 | 141 | 141.8 | -61.1 | -36.6 | 0 | 0 | 0 | 121.5 | ||||
| 215 | T | 36.8 | Very low | 43.6 | Very low | 141 Ų | 141 | 149.5 Ų | 149.5 | 87% | 0.865 | 81% | 0.811 | S | S | * | * | trans | 89.5 | 92.2 | 156.1 | 71.3 | 0 | 0 | 0 | 0 | 118.6 | ||||
| 216 | S | 42.6 | Very low | 44 | Very low | 118 Ų | 118 | 146.2 Ų | 146.2 | 83% | 0.825 | 80% | 0.804 | S | S | * | * | trans | -155.4 | 104.5 | 131.3 | -166.5 | 0 | 0 | 0 | 0 | 109.1 | ||||
| 217 | L | 45.9 | Very low | 44.2 | Very low | 160 Ų | 160 | 149 Ų | 149 | 84% | 0.838 | 80% | 0.802 | S | S | * | * | trans | -75.4 | 137.9 | 165.4 | -75 | 171 | 0 | 0 | 0 | 107.7 | ||||
| 218 | L | 48 | Very low | 45.2 | Very low | 162 Ų | 162 | 145.6 Ų | 145.6 | 85% | 0.848 | 80% | 0.796 | S | S | * | * | trans | 75.9 | 84.3 | 165.3 | -45.4 | 177 | 0 | 0 | 0 | 116 | ||||
| 219 | S | 40.1 | Very low | 45.5 | Very low | 124 Ų | 124 | 144.5 Ų | 144.5 | 87% | 0.867 | 79% | 0.788 | S | S | * | * | trans | -131.9 | 87.8 | 140 | -165.1 | 0 | 0 | 0 | 0 | 107.3 | ||||
| 220 | N | 48.9 | Very low | 46.1 | Very low | 135 Ų | 135 | 142 Ų | 142 | 72% | 0.722 | 78% | 0.781 | S | S | * | * | trans | -73.2 | 116.1 | 160.2 | -155.2 | 38.5 | 0 | 0 | 0 | 104.8 | ||||
| 221 | D | 39.9 | Very low | 46.5 | Very low | 142 Ų | 142 | 135.2 Ų | 135.2 | 76% | 0.759 | 77% | 0.769 | S | S | * | * | trans | 166.1 | 80.7 | 153.4 | -80 | -21.7 | 0 | 0 | 0 | 110.1 | ||||
| 222 | C | 40.3 | Very low | 47 | Very low | 113 Ų | 113 | 133.6 Ų | 133.6 | 76% | 0.764 | 76% | 0.757 | S | S | * | * | trans | -160.3 | 94.1 | 142.9 | -157.3 | 0 | 0 | 0 | 0 | 107.8 | D224 | C222-D224 PolarHBondContact O-N 3.5Š| ||
| 223 | Y | 49.8 | Very low | 48.9 | Very low | 217 Ų | 217 | 129 Ų | 129 | 85% | 0.851 | 73% | 0.734 | S | S | * | * | trans | -67.3 | 81.9 | 158.7 | -76.3 | -90 | 0 | 0 | 0 | 107.2 | L225 | Y223-L225 PolarHBondContact O-N 2.92Š| ||
| 224 | D | 42.7 | Very low | 51.1 | Low | 127 Ų | 127 | 129.5 Ų | 129.5 | 68% | 0.679 | 73% | 0.733 | S | S | * | * | trans | -84.5 | 96.1 | 166.2 | -159.2 | 14.7 | 0 | 0 | 0 | 107.2 | C222 D226 | C222-D224 PolarHBondContact O-N 3.5Å; D224-D226 PolarHBondContact O-N 3.24Å | ||
| 225 | L | 57.5 | Low | 53.4 | Low | 157 Ų | 157 | 127.4 Ų | 127.4 | 82% | 0.822 | 72% | 0.722 | S | S | * | * | S | Bend | trans | -66.7 | 74.8 | 168.4 | -85.8 | 158.1 | 0 | 0 | 0 | 108.4 | Y223 | Y223-L225 PolarHBondContact O-N 2.92Š|
| 226 | D | 53 | Low | 56 | Low | 149 Ų | 149 | 123.9 Ų | 123.9 | 80% | 0.797 | 70% | 0.702 | S | S | * | * | trans | -178.1 | 55.4 | 162.5 | -92 | -29.5 | 0 | 0 | 0 | 112.7 | D224 | D224-D226 PolarHBondContact O-N 3.24Š| ||
| 227 | D | 44.1 | Very low | 58.3 | Low | 132 Ų | 132 | 122.1 Ų | 122.1 | 71% | 0.706 | 68% | 0.684 | S | S | * | * | trans | -115.1 | 102.8 | 159.3 | -170.9 | 24.2 | 0 | 0 | 0 | 109.8 | C229 | D227-C229 PolarHBondContact O-N 3.47Å; D227-C229 VanDerWaalsContact OD2-CB 3.27Å; D227-C229 WeakPolarHBondContact OD2-CB 3.3Å | ||
| 228 | P | 55.5 | Low | 60.5 | Low | 121 Ų | 121 | 118.4 Ų | 118.4 | 79% | 0.786 | 66% | 0.664 | S | S | * | * | trans | -77.3 | 58.4 | 169.1 | 35.7 | -33.5 | 0 | 0 | 0 | 108.8 | D230 | P228-D230 PolarHBondContact O-N 3.35Š| ||
| 229 | C | 48.6 | Very low | 62.5 | Low | 83 Ų | 83 | 114.2 Ų | 114.2 | 56% | 0.561 | 65% | 0.645 | S | S | * | * | trans | -82.5 | 59.9 | 164.4 | -161.8 | 0 | 0 | 0 | 0 | 108.7 | D227 S231 | D227-C229 PolarHBondContact O-N 3.47Å; D227-C229 VanDerWaalsContact OD2-CB 3.27Å; D227-C229 WeakPolarHBondContact OD2-CB 3.3Å; C229-S231 PolarHBondContact O-N 3.33Å | ||
| 230 | D | 53 | Low | 64.9 | Low | 144 Ų | 144 | 114.9 Ų | 114.9 | 77% | 0.77 | 63% | 0.632 | S | S | * | * | trans | -71.2 | 30.9 | 156.3 | -153.3 | 19.4 | 0 | 0 | 0 | 109.9 | P228 T232 | P228-D230 PolarHBondContact O-N 3.35Å; D230-T232 PolarHBondContact O-N 3.23Å | ||
| 231 | S | 54.3 | Low | 66.9 | Low | 87 Ų | 87 | 113.2 Ų | 113.2 | 61% | 0.608 | 62% | 0.619 | S | S | * | * | trans | -85.6 | 57.4 | 163.9 | 174.8 | 0 | 0 | 0 | 0 | 107.5 | C229 D233 | C229-S231 PolarHBondContact O-N 3.33Å; S231-D233 PolarHBondContact O-N 3.03Å | ||
| 232 | T | 61.7 | Low | 69.2 | Low | 89 Ų | 89 | 111.4 Ų | 111.4 | 55% | 0.546 | 61% | 0.608 | S | S | . | * | trans | -51.1 | 107.6 | 143.1 | 31.4 | 0 | 0 | 0 | 0 | 105.7 | D230 V234 | D230-T232 PolarHBondContact O-N 3.23Å; T232-V234 PolarHBondContact O-N 3.42Å | ||
| 233 | D | 81.3 | Confident | 71.2 | Confident | 73 Ų | 73 | 111.3 Ų | 111.3 | 39% | 0.39 | 60% | 0.599 | S | S | . | * | trans | -41 | 129.1 | 179 | 157.5 | 48.7 | 0 | 0 | 0 | 109.3 | S231 D235 S236 L237 | S231-D233 PolarHBondContact O-N 3.03Å; D233-D235 PolarHBondContact O-N 3.19Å; D233-D235 VanDerWaalsContact O-N 3.12Å; D233-D235 PolarHBondContact OD1-N 2.89Å; D233-D235 WeakPolarHBondContact OD2-CB 3.26Å; D233-S236 CarbonylContact O-C 3.59Å; D233-S236 WeakPolarHBondContact O-CA 3.42Å; D233-S236 VanDerWaalsContact O-CB 3.26Å; D233-S236 WeakPolarHBondContact O-CB 3.34Å; D233-S236 PolarHBondContact O-N 2.96Å; D233-S236 PolarHBondContact OD2-N 2.81Å; D233-S236 PolarHBondContact OD2-OG 3.19Å; D233-L237 PolarHBondContact O-N 3.09Å | ||
| 234 | V | 89.3 | Confident | 72.9 | Confident | 100 Ų | 100 | 105.6 Ų | 105.6 | 61% | 0.606 | 58% | 0.581 | S | S | * | * | H | α-helix | trans | -56.2 | -34.4 | -174.6 | 175.5 | 0 | 0 | 0 | 0 | 109.6 | T232 L237 I238 | T232-V234 PolarHBondContact O-N 3.42Å; V234-L237 PolarHBondContact O-N 3.33Å; V234-I238 HydrophobicContact CG1-CD1 3.75Å; V234-I238 HydrophobicContact CG1-CG1 4.29Å; V234-I238 WeakPolarHBondContact O-CB 3.46Å; V234-I238 WeakPolarHBondContact O-CD1 3.22Å; V234-I238 WeakPolarHBondContact O-CG1 3.41Å; V234-I238 PolarHBondContact O-N 2.94Å |
| 235 | D | 87.6 | Confident | 74.6 | Confident | 102 Ų | 102 | 104.6 Ų | 104.6 | 55% | 0.545 | 58% | 0.575 | S | S | . | * | H | α-helix | trans | -70.7 | -34.2 | 177.1 | -66.3 | -28.3 | 0 | 0 | 0 | 112.4 | D233 I238 T239 | D233-D235 PolarHBondContact O-N 3.19Å; D233-D235 VanDerWaalsContact O-N 3.12Å; D233-D235 PolarHBondContact OD1-N 2.89Å; D233-D235 WeakPolarHBondContact OD2-CB 3.26Å; D235-I238 PolarHBondContact O-N 2.85Å; D235-T239 VanDerWaalsContact O-CB 3.24Å; D235-T239 WeakPolarHBondContact O-CB 3.16Å; D235-T239 PolarHBondContact O-N 2.88Å; D235-T239 PolarHBondContact O-OG1 2.97Å |
| 236 | S | 91.4 | Very high | 75.3 | Confident | 66 Ų | 66 | 104.1 Ų | 104.1 | 46% | 0.462 | 56% | 0.563 | S | S | . | * | H | α-helix | trans | -66 | -38.8 | 170.3 | -62.2 | 0 | 0 | 0 | 0 | 112 | D233 K240 | D233-S236 CarbonylContact O-C 3.59Å; D233-S236 WeakPolarHBondContact O-CA 3.42Å; D233-S236 VanDerWaalsContact O-CB 3.26Å; D233-S236 WeakPolarHBondContact O-CB 3.34Å; D233-S236 PolarHBondContact O-N 2.96Å; D233-S236 PolarHBondContact OD2-N 2.81Å; D233-S236 PolarHBondContact OD2-OG 3.19Å; S236-K240 WeakPolarHBondContact O-CB 3.4Å; S236-K240 PolarHBondContact O-N 2.95Å |
| 237 | L | 91.9 | Very high | 76.2 | Confident | 82 Ų | 82 | 99.5 Ų | 99.5 | 43% | 0.429 | 55% | 0.546 | S | S | . | . | H | α-helix | trans | -69.4 | -41.4 | 174.3 | -176 | 61.8 | 0 | 0 | 0 | 111.8 | D233 V234 K240 K241 | D233-L237 PolarHBondContact O-N 3.09Å; V234-L237 PolarHBondContact O-N 3.33Å; L237-K240 PolarHBondContact O-N 2.89Å; L237-K241 HydrophobicContact CD1-CG 4.45Å; L237-K241 WeakPolarHBondContact O-CB 3.04Å; L237-K241 VanDerWaalsContact O-CG 3.29Å; L237-K241 WeakPolarHBondContact O-CG 3.36Å; L237-K241 PolarHBondContact O-N 2.83Å |
| 238 | I | 91.8 | Very high | 77.5 | Confident | 81 Ų | 81 | 98.9 Ų | 98.9 | 42% | 0.415 | 54% | 0.537 | S | S | . | . | H | α-helix | trans | -61.1 | -49.7 | 174.3 | -72.3 | 164.5 | 0 | 0 | 0 | 109.7 | V234 D235 K240 K241 L242 | V234-I238 HydrophobicContact CG1-CD1 3.75Å; V234-I238 HydrophobicContact CG1-CG1 4.29Å; V234-I238 WeakPolarHBondContact O-CB 3.46Å; V234-I238 WeakPolarHBondContact O-CD1 3.22Å; V234-I238 WeakPolarHBondContact O-CG1 3.41Å; V234-I238 PolarHBondContact O-N 2.94Å; D235-I238 PolarHBondContact O-N 2.85Å; I238-K240 VanDerWaalsContact C-N 3.34Å; I238-K240 PolarHBondContact O-N 3.29Å; I238-K241 PolarHBondContact O-N 2.67Å; I238-K241 VanDerWaalsContact O-N 3.15Å; I238-L242 HydrophobicContact CG2-CD1 3.7Å; I238-L242 HydrophobicContact CG2-CG 4.19Å; I238-L242 WeakPolarHBondContact O-CB 3.22Å; I238-L242 VanDerWaalsContact O-CG 3.27Å; I238-L242 WeakPolarHBondContact O-CG 3.39Å; I238-L242 PolarHBondContact O-N 3.13Å |
| 239 | T | 89.6 | Confident | 78.1 | Confident | 75 Ų | 75 | 99.3 Ų | 99.3 | 46% | 0.46 | 53% | 0.528 | S | S | . | . | H | α-helix | trans | -59.8 | -47.2 | 178.6 | -60 | 0 | 0 | 0 | 0 | 110.4 | D235 K241 L242 L243 | D235-T239 VanDerWaalsContact O-CB 3.24Å; D235-T239 WeakPolarHBondContact O-CB 3.16Å; D235-T239 PolarHBondContact O-N 2.88Å; D235-T239 PolarHBondContact O-OG1 2.97Å; T239-K241 VanDerWaalsContact C-N 3.32Å; T239-K241 PolarHBondContact O-N 3.22Å; T239-L242 PolarHBondContact O-N 2.85Å; T239-L243 HydrophobicContact CG2-CD1 3.81Å; T239-L243 WeakPolarHBondContact O-CB 3.26Å; T239-L243 WeakPolarHBondContact O-CD1 2.97Å; T239-L243 PolarHBondContact O-N 2.72Å |
| 240 | K | 90.9 | Very high | 79.2 | Confident | 137 Ų | 137 | 100.6 Ų | 100.6 | 60% | 0.596 | 53% | 0.526 | S | S | * | . | H | α-helix | trans | -56.7 | -45.4 | 174.9 | -179.6 | 177.9 | 175.9 | 176.3 | 0 | 111.7 | S236 L237 I238 L243 E244 | S236-K240 WeakPolarHBondContact O-CB 3.4Å; S236-K240 PolarHBondContact O-N 2.95Å; L237-K240 PolarHBondContact O-N 2.89Å; I238-K240 VanDerWaalsContact C-N 3.34Å; I238-K240 PolarHBondContact O-N 3.29Å; K240-L243 PolarHBondContact O-N 3.28Å; K240-E244 VanDerWaalsContact O-CB 3.26Å; K240-E244 WeakPolarHBondContact O-CB 3.34Å; K240-E244 PolarHBondContact O-N 3.18Å |
| 241 | K | 91.7 | Very high | 80 | Confident | 101 Ų | 101 | 99.2 Ų | 99.2 | 44% | 0.439 | 52% | 0.517 | S | S | . | . | H | α-helix | trans | -69.6 | -36.2 | 179.8 | -75.2 | -73.5 | 166.1 | -156.3 | 0 | 113 | L237 I238 T239 E244 L245 | L237-K241 HydrophobicContact CD1-CG 4.45Å; L237-K241 WeakPolarHBondContact O-CB 3.04Å; L237-K241 VanDerWaalsContact O-CG 3.29Å; L237-K241 WeakPolarHBondContact O-CG 3.36Å; L237-K241 PolarHBondContact O-N 2.83Å; I238-K241 PolarHBondContact O-N 2.67Å; I238-K241 VanDerWaalsContact O-N 3.15Å; T239-K241 VanDerWaalsContact C-N 3.32Å; T239-K241 PolarHBondContact O-N 3.22Å; K241-E244 WeakPolarHBondContact CD-OE2 3.39Å; K241-E244 WeakPolarHBondContact CE-OE2 3.35Å; K241-E244 IonicContact NZ-OE1 3.38Å; K241-E244 PolarHBondContact NZ-OE1 3.06Å; K241-E244 IonicContact NZ-OE2 2.72Å; K241-E244 PolarHBondContact NZ-OE2 3.19Å; K241-E244 PolarHBondContact O-N 2.89Å; K241-L245 WeakPolarHBondContact O-CB 3.5Å; K241-L245 VanDerWaalsContact O-CG 3.26Å; K241-L245 WeakPolarHBondContact O-CG 3.31Å; K241-L245 PolarHBondContact O-N 2.88Å |
| 242 | L | 87.4 | Confident | 80.9 | Confident | 104 Ų | 104 | 100.1 Ų | 100.1 | 55% | 0.545 | 51% | 0.512 | S | S | . | . | H | α-helix | trans | -67.2 | -41.1 | 174 | -71.5 | 173.1 | 0 | 0 | 0 | 111.5 | I238 T239 L245 Y246 | I238-L242 HydrophobicContact CG2-CD1 3.7Å; I238-L242 HydrophobicContact CG2-CG 4.19Å; I238-L242 WeakPolarHBondContact O-CB 3.22Å; I238-L242 VanDerWaalsContact O-CG 3.27Å; I238-L242 WeakPolarHBondContact O-CG 3.39Å; I238-L242 PolarHBondContact O-N 3.13Å; T239-L242 PolarHBondContact O-N 2.85Å; L242-L245 PolarHBondContact O-N 3.28Å; L242-Y246 VanDerWaalsContact O-CB 3.3Å; L242-Y246 WeakPolarHBondContact O-CB 3.24Å; L242-Y246 PolarHBondContact O-N 2.94Å |
| 243 | L | 82.8 | Confident | 81.5 | Confident | 110 Ų | 110 | 99.5 Ų | 99.5 | 58% | 0.576 | 50% | 0.503 | S | S | * | . | H | α-helix | trans | -66.8 | -40.1 | 174.3 | -92.5 | 69.9 | 0 | 0 | 0 | 111.7 | T239 K240 Y246 A247 | T239-L243 HydrophobicContact CG2-CD1 3.81Å; T239-L243 WeakPolarHBondContact O-CB 3.26Å; T239-L243 WeakPolarHBondContact O-CD1 2.97Å; T239-L243 PolarHBondContact O-N 2.72Å; K240-L243 PolarHBondContact O-N 3.28Å; L243-Y246 PolarHBondContact O-N 3.4Å; L243-A247 WeakPolarHBondContact O-CB 3.24Å; L243-A247 PolarHBondContact O-N 2.94Å |
| 244 | E | 85.3 | Confident | 81.1 | Confident | 97 Ų | 97 | 101.5 Ų | 101.5 | 45% | 0.453 | 51% | 0.513 | S | S | . | . | H | α-helix | trans | -62.6 | -44.9 | 174.7 | -172.8 | 179.7 | 174.1 | 0 | 0 | 111.2 | K240 K241 A247 F248 | K240-E244 VanDerWaalsContact O-CB 3.26Å; K240-E244 WeakPolarHBondContact O-CB 3.34Å; K240-E244 PolarHBondContact O-N 3.18Å; K241-E244 WeakPolarHBondContact CD-OE2 3.39Å; K241-E244 WeakPolarHBondContact CE-OE2 3.35Å; K241-E244 IonicContact NZ-OE1 3.38Å; K241-E244 PolarHBondContact NZ-OE1 3.06Å; K241-E244 IonicContact NZ-OE2 2.72Å; K241-E244 PolarHBondContact NZ-OE2 3.19Å; K241-E244 PolarHBondContact O-N 2.89Å; E244-A247 PolarHBondContact O-N 2.82Å; E244-F248 WeakPolarHBondContact O-CB 3.46Å; E244-F248 PolarHBondContact O-N 3.29Å |
| 245 | L | 78.3 | Confident | 80.4 | Confident | 107 Ų | 107 | 98.7 Ų | 98.7 | 56% | 0.56 | 50% | 0.5 | S | S | * | . | H | α-helix | trans | -62.2 | -42.2 | 172.5 | -76.2 | 170.5 | 0 | 0 | 0 | 112 | K241 L242 H249 | K241-L245 WeakPolarHBondContact O-CB 3.5Å; K241-L245 VanDerWaalsContact O-CG 3.26Å; K241-L245 WeakPolarHBondContact O-CG 3.31Å; K241-L245 PolarHBondContact O-N 2.88Å; L242-L245 PolarHBondContact O-N 3.28Å; L245-H249 WeakPolarHBondContact O-CB 3.31Å; L245-H249 PolarHBondContact O-N 2.68Å |
| 246 | Y | 71.8 | Confident | 79.9 | Confident | 147 Ų | 147 | 100.2 Ų | 100.2 | 58% | 0.576 | 50% | 0.502 | S | S | * | . | H | α-helix | trans | -63.9 | -45.7 | 178.7 | 177.6 | -100.8 | 0 | 0 | 0 | 112 | L242 L243 H249 Q250 | L242-Y246 VanDerWaalsContact O-CB 3.3Å; L242-Y246 WeakPolarHBondContact O-CB 3.24Å; L242-Y246 PolarHBondContact O-N 2.94Å; L243-Y246 PolarHBondContact O-N 3.4Å; Y246-H249 PolarHBondContact O-N 3.47Å; Y246-Q250 PolarHBondContact O-N 2.94Å |
| 247 | A | 71.3 | Confident | 78.6 | Confident | 52 Ų | 52 | 101 Ų | 101 | 43% | 0.43 | 51% | 0.507 | S | S | . | . | I | π-helix | trans | -64.8 | -42.6 | 177.7 | 0 | 0 | 0 | 0 | 0 | 112 | L243 E244 | L243-A247 WeakPolarHBondContact O-CB 3.24Å; L243-A247 PolarHBondContact O-N 2.94Å; E244-A247 PolarHBondContact O-N 2.82Å |
| 248 | F | 72.2 | Confident | 77.6 | Confident | 119 Ų | 119 | 100.8 Ų | 100.8 | 52% | 0.522 | 51% | 0.509 | S | S | . | . | I | π-helix | trans | -69.9 | -33.1 | 178.8 | -171.9 | -102.4 | 0 | 0 | 0 | 112.8 | E244 E252 | E244-F248 WeakPolarHBondContact O-CB 3.46Å; E244-F248 PolarHBondContact O-N 3.29Å; F248-E252 WeakPolarHBondContact CD2-OE2 3.43Å; F248-E252 WeakPolarHBondContact CE2-OE2 3.25Å; F248-E252 WeakPolarHBondContact O-CB 3.21Å |
| 249 | H | 68.3 | Low | 76.7 | Confident | 130 Ų | 130 | 101.2 Ų | 101.2 | 60% | 0.602 | 52% | 0.519 | S | S | * | . | I | π-helix | trans | -96.8 | -23.1 | -165.2 | -148.9 | 68.2 | 0 | 0 | 0 | 115.5 | L245 Y246 E253 | L245-H249 WeakPolarHBondContact O-CB 3.31Å; L245-H249 PolarHBondContact O-N 2.68Å; Y246-H249 PolarHBondContact O-N 3.47Å; H249-E253 WeakPolarHBondContact O-CB 3.39Å |
| 250 | Q | 71.6 | Confident | 76.4 | Confident | 109 Ų | 109 | 101.3 Ų | 101.3 | 51% | 0.509 | 52% | 0.517 | S | S | . | . | I | π-helix | trans | -106.7 | -48.7 | 178.5 | -73.8 | -172.3 | 16.6 | 0 | 0 | 113.1 | Y246 L254 | Y246-Q250 PolarHBondContact O-N 2.94Å; Q250-L254 WeakPolarHBondContact O-CB 3.36Å; Q250-L254 WeakPolarHBondContact O-CD1 3.47Å; Q250-L254 WeakPolarHBondContact O-CG 3.39Å; Q250-L254 PolarHBondContact O-N 3.21Å |
| 251 | I | 68.9 | Low | 76 | Confident | 116 Ų | 116 | 98.8 Ų | 98.8 | 60% | 0.595 | 52% | 0.516 | S | S | * | . | I | π-helix | trans | -72.9 | -42.4 | -175.4 | -59.7 | 175 | 0 | 0 | 0 | 110 | A255 | I251-A255 WeakPolarHBondContact O-CB 3.47Å; I251-A255 PolarHBondContact O-N 2.88Å |
| 252 | E | 74.1 | Confident | 75.8 | Confident | 105 Ų | 105 | 96.1 Ų | 96.1 | 49% | 0.491 | 51% | 0.51 | S | S | . | . | H | α-helix | trans | -73.9 | -37.9 | -177.9 | -164.8 | 161 | -171.7 | 0 | 0 | 112.6 | F248 A255 K256 | F248-E252 WeakPolarHBondContact CD2-OE2 3.43Å; F248-E252 WeakPolarHBondContact CE2-OE2 3.25Å; F248-E252 WeakPolarHBondContact O-CB 3.21Å; E252-A255 PolarHBondContact O-N 3.36Å; E252-K256 VanDerWaalsContact O-CB 3.24Å; E252-K256 WeakPolarHBondContact O-CB 3.41Å; E252-K256 PolarHBondContact O-N 2.94Å |
| 253 | E | 74.4 | Confident | 75.9 | Confident | 76 Ų | 76 | 95.8 Ų | 95.8 | 36% | 0.355 | 51% | 0.505 | S | S | . | . | H | α-helix | trans | -72 | -35.5 | 174.7 | -72.8 | -72 | 114.5 | 0 | 0 | 111.9 | H249 K256 C257 | H249-E253 WeakPolarHBondContact O-CB 3.39Å; E253-K256 PolarHBondContact O-N 2.6Å; E253-K256 WeakPolarHBondContact OE1-CD 3.38Å; E253-K256 IonicContact OE1-NZ 3.1Å; E253-K256 PolarHBondContact OE1-NZ 2.87Å; E253-K256 VanDerWaalsContact OE1-NZ 3.1Å; E253-C257 WeakPolarHBondContact O-CB 3.44Å; E253-C257 PolarHBondContact O-N 2.95Å; E253-C257 PolarHBondContact O-SG 2.85Å |
| 254 | L | 72.4 | Confident | 76.1 | Confident | 116 Ų | 116 | 97.1 Ų | 97.1 | 61% | 0.607 | 51% | 0.506 | S | S | * | . | H | α-helix | trans | -64.2 | -43.9 | 169.3 | -76.6 | 171.4 | 0 | 0 | 0 | 111.4 | Q250 K256 C257 T258 | Q250-L254 WeakPolarHBondContact O-CB 3.36Å; Q250-L254 WeakPolarHBondContact O-CD1 3.47Å; Q250-L254 WeakPolarHBondContact O-CG 3.39Å; Q250-L254 PolarHBondContact O-N 3.21Å; L254-K256 VanDerWaalsContact C-N 3.31Å; L254-K256 PolarHBondContact O-N 3.18Å; L254-C257 PolarHBondContact O-N 3.35Å; L254-T258 WeakPolarHBondContact O-CB 3.44Å; L254-T258 WeakPolarHBondContact O-CG2 3.37Å; L254-T258 PolarHBondContact O-N 3.4Å; L254-T258 PolarHBondContact O-OG1 3.4Å |
| 255 | A | 75.2 | Confident | 76.5 | Confident | 41 Ų | 41 | 100 Ų | 100 | 34% | 0.339 | 51% | 0.513 | S | S | . | . | H | α-helix | trans | -58.9 | -45.7 | 174.6 | 0 | 0 | 0 | 0 | 0 | 109.8 | I251 E252 C257 T258 S259 | I251-A255 WeakPolarHBondContact O-CB 3.47Å; I251-A255 PolarHBondContact O-N 2.88Å; E252-A255 PolarHBondContact O-N 3.36Å; A255-C257 PolarHBondContact O-N 2.98Å; A255-T258 WeakPolarHBondContact CA-OG1 3.4Å; A255-T258 CarbonylContact O-C 3.5Å; A255-T258 PolarHBondContact O-N 3.13Å; A255-T258 VanDerWaalsContact O-N 3.13Å; A255-T258 PolarHBondContact O-OG1 2.89Å; A255-T258 VanDerWaalsContact O-OG1 3.08Å; A255-S259 WeakPolarHBondContact O-CA 3.46Å; A255-S259 WeakPolarHBondContact O-CB 3.46Å; A255-S259 PolarHBondContact O-N 2.89Å; A255-S259 PolarHBondContact O-OG 3.47Å |
| 256 | K | 76.6 | Confident | 77.2 | Confident | 133 Ų | 133 | 100.9 Ų | 100.9 | 58% | 0.578 | 51% | 0.512 | S | S | * | . | H | α-helix | trans | -63.9 | -39.4 | 179.1 | -170.3 | 176.6 | 176.8 | -174.2 | 0 | 113.2 | E252 E253 L254 T258 D260 | E252-K256 VanDerWaalsContact O-CB 3.24Å; E252-K256 WeakPolarHBondContact O-CB 3.41Å; E252-K256 PolarHBondContact O-N 2.94Å; E253-K256 PolarHBondContact O-N 2.6Å; E253-K256 WeakPolarHBondContact OE1-CD 3.38Å; E253-K256 IonicContact OE1-NZ 3.1Å; E253-K256 PolarHBondContact OE1-NZ 2.87Å; E253-K256 VanDerWaalsContact OE1-NZ 3.1Å; L254-K256 VanDerWaalsContact C-N 3.31Å; L254-K256 PolarHBondContact O-N 3.18Å; K256-T258 VanDerWaalsContact C-N 3.28Å; K256-T258 PolarHBondContact O-N 3.14Å; K256-D260 PolarHBondContact O-N 3.48Å |
| 257 | C | 63.3 | Low | 78.2 | Confident | 83 Ų | 83 | 96.5 Ų | 96.5 | 56% | 0.561 | 50% | 0.5 | S | S | * | . | H | α-helix | trans | -69.7 | -24.5 | 175.4 | -65.5 | 0 | 0 | 0 | 0 | 113.1 | E253 L254 A255 | E253-C257 WeakPolarHBondContact O-CB 3.44Å; E253-C257 PolarHBondContact O-N 2.95Å; E253-C257 PolarHBondContact O-SG 2.85Å; L254-C257 PolarHBondContact O-N 3.35Å; A255-C257 PolarHBondContact O-N 2.98Å |
| 258 | T | 72.9 | Confident | 79.4 | Confident | 77 Ų | 77 | 96.9 Ų | 96.9 | 47% | 0.472 | 50% | 0.495 | S | S | . | . | H | α-helix | trans | -100 | -18.1 | 178.8 | 54.2 | 0 | 0 | 0 | 0 | 113.8 | L254 A255 K256 F263 | L254-T258 WeakPolarHBondContact O-CB 3.44Å; L254-T258 WeakPolarHBondContact O-CG2 3.37Å; L254-T258 PolarHBondContact O-N 3.4Å; L254-T258 PolarHBondContact O-OG1 3.4Å; A255-T258 WeakPolarHBondContact CA-OG1 3.4Å; A255-T258 CarbonylContact O-C 3.5Å; A255-T258 PolarHBondContact O-N 3.13Å; A255-T258 VanDerWaalsContact O-N 3.13Å; A255-T258 PolarHBondContact O-OG1 2.89Å; A255-T258 VanDerWaalsContact O-OG1 3.08Å; K256-T258 VanDerWaalsContact C-N 3.28Å; K256-T258 PolarHBondContact O-N 3.14Å; T258-F263 HydrophobicContact CG2-CE1 4.33Å; T258-F263 WeakPolarHBondContact O-CD1 3.07Å |
| 259 | S | 72.4 | Confident | 80.6 | Confident | 90 Ų | 90 | 96.5 Ų | 96.5 | 63% | 0.629 | 50% | 0.495 | S | S | * | . | H | α-helix | trans | -89.8 | -8 | 177.6 | -55.8 | 0 | 0 | 0 | 0 | 113.1 | A255 S261 | A255-S259 WeakPolarHBondContact O-CA 3.46Å; A255-S259 WeakPolarHBondContact O-CB 3.46Å; A255-S259 PolarHBondContact O-N 2.89Å; A255-S259 PolarHBondContact O-OG 3.47Å; S259-S261 PolarHBondContact O-N 2.94Å |
| 260 | D | 82.4 | Confident | 81.9 | Confident | 77 Ų | 77 | 94.5 Ų | 94.5 | 41% | 0.412 | 49% | 0.488 | S | S | . | . | trans | -59.1 | 124.4 | 173.5 | -176.6 | 1.4 | 0 | 0 | 0 | 108.9 | K256 S262 F263 F264 | K256-D260 PolarHBondContact O-N 3.48Å; D260-S262 PolarHBondContact O-N 3.41Å; D260-S262 PolarHBondContact OD1-N 3.35Å; D260-S262 WeakPolarHBondContact OD2-CB 3.49Å; D260-S262 PolarHBondContact OD2-OG 3.43Å; D260-F263 HydrophobicContact CB-CB 4.31Å; D260-F263 WeakPolarHBondContact O-CA 3.23Å; D260-F263 WeakPolarHBondContact O-CB 3.17Å; D260-F263 PolarHBondContact O-N 3.11Å; D260-F264 PolarHBondContact O-N 2.93Å; D260-F264 VanDerWaalsContact O-N 3.14Å | ||
| 261 | S | 83.2 | Confident | 83.1 | Confident | 84 Ų | 84 | 91.4 Ų | 91.4 | 59% | 0.587 | 48% | 0.478 | S | S | * | . | H | α-helix | trans | -51.1 | -27.5 | 173.3 | 67.4 | 0 | 0 | 0 | 0 | 112.7 | S259 R265 | S259-S261 PolarHBondContact O-N 2.94Å; S261-R265 WeakPolarHBondContact O-CB 3.43Å; S261-R265 PolarHBondContact O-N 3.27Å |
| 262 | S | 87.1 | Confident | 84.5 | Confident | 45 Ų | 45 | 90.3 Ų | 90.3 | 32% | 0.315 | 47% | 0.474 | S | S | . | . | H | α-helix | trans | -72.4 | -37.9 | 175.8 | 92.1 | 0 | 0 | 0 | 0 | 112.6 | D260 K266 | D260-S262 PolarHBondContact O-N 3.41Å; D260-S262 PolarHBondContact OD1-N 3.35Å; D260-S262 WeakPolarHBondContact OD2-CB 3.49Å; D260-S262 PolarHBondContact OD2-OG 3.43Å; S262-K266 WeakPolarHBondContact O-CB 3.28Å; S262-K266 VanDerWaalsContact O-CG 3.26Å; S262-K266 WeakPolarHBondContact O-CG 3.4Å; S262-K266 PolarHBondContact O-N 3.18Å |
| 263 | F | 89.9 | Confident | 85.6 | Confident | 98 Ų | 98 | 89.1 Ų | 89.1 | 43% | 0.43 | 47% | 0.47 | S | S | . | . | H | α-helix | trans | -64.7 | -52.1 | 175.4 | 178.8 | -96.3 | 0 | 0 | 0 | 109.7 | T258 D260 R265 K266 T267 | T258-F263 HydrophobicContact CG2-CE1 4.33Å; T258-F263 WeakPolarHBondContact O-CD1 3.07Å; D260-F263 HydrophobicContact CB-CB 4.31Å; D260-F263 WeakPolarHBondContact O-CA 3.23Å; D260-F263 WeakPolarHBondContact O-CB 3.17Å; D260-F263 PolarHBondContact O-N 3.11Å; F263-R265 VanDerWaalsContact C-N 3.34Å; F263-R265 PolarHBondContact O-N 2.92Å; F263-K266 PolarHBondContact O-N 3.01Å; F263-T267 WeakPolarHBondContact O-CB 3.34Å; F263-T267 PolarHBondContact O-N 3.42Å; F263-T267 PolarHBondContact O-OG1 2.98Å |
| 264 | F | 87.2 | Confident | 86.8 | Confident | 137 Ų | 137 | 86.3 Ų | 86.3 | 60% | 0.601 | 46% | 0.457 | S | S | * | . | H | α-helix | trans | -58 | -46 | 178.1 | -176.9 | -106.4 | 0 | 0 | 0 | 112.1 | D260 K266 T267 N268 | D260-F264 PolarHBondContact O-N 2.93Å; D260-F264 VanDerWaalsContact O-N 3.14Å; F264-K266 PolarHBondContact O-N 3.31Å; F264-T267 PolarHBondContact O-N 3.12Å; F264-N268 WeakPolarHBondContact CD1-ND2 3.47Å; F264-N268 WeakPolarHBondContact CE1-ND2 3.39Å; F264-N268 WeakPolarHBondContact CZ-ND2 3.24Å; F264-N268 PolarHBondContact O-N 2.9Å; F264-N268 PolarHBondContact O-ND2 3.45Å |
| 265 | R | 92.4 | Very high | 88 | Confident | 159 Ų | 159 | 85.9 Ų | 85.9 | 60% | 0.6 | 45% | 0.449 | S | S | * | . | H | α-helix | trans | -59.7 | -47.9 | 177.7 | -172.7 | -171.2 | -57.9 | -105.5 | -2.8 | 111.8 | S261 F263 N268 E269 | S261-R265 WeakPolarHBondContact O-CB 3.43Å; S261-R265 PolarHBondContact O-N 3.27Å; F263-R265 VanDerWaalsContact C-N 3.34Å; F263-R265 PolarHBondContact O-N 2.92Å; R265-N268 PolarHBondContact O-N 3.39Å; R265-E269 WeakPolarHBondContact CG-OE1 3.17Å; R265-E269 WeakPolarHBondContact O-CG 3.48Å; R265-E269 PolarHBondContact O-N 2.57Å |
| 266 | K | 94.1 | Very high | 89.1 | Confident | 125 Ų | 125 | 88.2 Ų | 88.2 | 54% | 0.543 | 46% | 0.456 | S | S | . | . | H | α-helix | trans | -66.7 | -39.9 | 179.9 | -75 | 176.3 | 179.6 | 174.8 | 0 | 112.4 | S262 F263 F264 N268 E269 I270 | S262-K266 WeakPolarHBondContact O-CB 3.28Å; S262-K266 VanDerWaalsContact O-CG 3.26Å; S262-K266 WeakPolarHBondContact O-CG 3.4Å; S262-K266 PolarHBondContact O-N 3.18Å; F263-K266 PolarHBondContact O-N 3.01Å; F264-K266 PolarHBondContact O-N 3.31Å; K266-N268 VanDerWaalsContact C-N 3.32Å; K266-N268 PolarHBondContact O-N 3.27Å; K266-E269 PolarHBondContact O-N 3.08Å; K266-I270 WeakPolarHBondContact O-CD1 3.45Å; K266-I270 WeakPolarHBondContact O-CG1 3.34Å; K266-I270 PolarHBondContact O-N 3.36Å |
| 267 | T | 93.4 | Very high | 90.1 | Very high | 54 Ų | 54 | 83.7 Ų | 83.7 | 33% | 0.331 | 44% | 0.437 | S | S | . | . | H | α-helix | trans | -61.3 | -43.8 | 175.8 | -60.4 | 0 | 0 | 0 | 0 | 110.3 | F263 F264 I270 S271 | F263-T267 WeakPolarHBondContact O-CB 3.34Å; F263-T267 PolarHBondContact O-N 3.42Å; F263-T267 PolarHBondContact O-OG1 2.98Å; F264-T267 PolarHBondContact O-N 3.12Å; T267-I270 PolarHBondContact O-N 2.75Å; T267-S271 PolarHBondContact O-N 2.91Å; T267-S271 PolarHBondContact O-OG 2.68Å |
| 268 | N | 94.9 | Very high | 91.8 | Very high | 60 Ų | 60 | 80 Ų | 80 | 32% | 0.321 | 41% | 0.413 | S | S | . | . | H | α-helix | trans | -65.1 | -42.1 | 175.1 | -65.9 | -13.3 | 0 | 0 | 0 | 112.4 | F264 R265 K266 I270 S271 D272 | F264-N268 WeakPolarHBondContact CD1-ND2 3.47Å; F264-N268 WeakPolarHBondContact CE1-ND2 3.39Å; F264-N268 WeakPolarHBondContact CZ-ND2 3.24Å; F264-N268 PolarHBondContact O-N 2.9Å; F264-N268 PolarHBondContact O-ND2 3.45Å; R265-N268 PolarHBondContact O-N 3.39Å; K266-N268 VanDerWaalsContact C-N 3.32Å; K266-N268 PolarHBondContact O-N 3.27Å; N268-I270 PolarHBondContact O-N 3.01Å; N268-S271 PolarHBondContact O-N 3.42Å; N268-D272 WeakPolarHBondContact O-CB 3.35Å; N268-D272 PolarHBondContact O-N 3.34Å |
| 269 | E | 97 | Very high | 92.9 | Very high | 111 Ų | 111 | 83.5 Ų | 83.5 | 52% | 0.519 | 42% | 0.424 | S | S | . | . | H | α-helix | trans | -59.3 | -36.8 | 174.8 | -75 | 171.1 | -162.4 | 0 | 0 | 111.8 | R265 K266 L273 | R265-E269 WeakPolarHBondContact CG-OE1 3.17Å; R265-E269 WeakPolarHBondContact O-CG 3.48Å; R265-E269 PolarHBondContact O-N 2.57Å; K266-E269 PolarHBondContact O-N 3.08Å; E269-L273 WeakPolarHBondContact O-CB 3.47Å; E269-L273 PolarHBondContact O-N 3.13Å |
| 270 | I | 96.6 | Very high | 94.2 | Very high | 89 Ų | 89 | 84.9 Ų | 84.9 | 46% | 0.456 | 42% | 0.424 | S | S | . | . | H | α-helix | trans | -69.9 | -45.2 | 175.3 | -67.9 | 163 | 0 | 0 | 0 | 110.6 | K266 T267 N268 L273 I274 L292 | K266-I270 WeakPolarHBondContact O-CD1 3.45Å; K266-I270 WeakPolarHBondContact O-CG1 3.34Å; K266-I270 PolarHBondContact O-N 3.36Å; T267-I270 PolarHBondContact O-N 2.75Å; N268-I270 PolarHBondContact O-N 3.01Å; I270-L273 WeakPolarHBondContact O-CB 3.2Å; I270-L273 PolarHBondContact O-N 2.75Å; I270-I274 HydrophobicContact CG2-CD1 4Å; I270-I274 WeakPolarHBondContact O-CG1 3.14Å; I270-I274 PolarHBondContact O-N 2.89Å; I270-L292 HydrophobicContact CG2-CD2 4.48Å |
| 271 | S | 96.9 | Very high | 94.8 | Very high | 43 Ų | 43 | 89.4 Ų | 89.4 | 30% | 0.301 | 44% | 0.437 | S | S | . | . | H | α-helix | trans | -58.8 | -47.8 | 175.4 | -64.9 | 0 | 0 | 0 | 0 | 111.3 | T267 N268 L273 I274 Y275 | T267-S271 PolarHBondContact O-N 2.91Å; T267-S271 PolarHBondContact O-OG 2.68Å; N268-S271 PolarHBondContact O-N 3.42Å; S271-L273 VanDerWaalsContact C-N 3.28Å; S271-L273 PolarHBondContact O-N 3.38Å; S271-I274 WeakPolarHBondContact O-CB 3.35Å; S271-I274 PolarHBondContact O-N 3.14Å; S271-I274 VanDerWaalsContact O-N 3.09Å; S271-Y275 WeakPolarHBondContact O-CD2 3.33Å; S271-Y275 PolarHBondContact O-N 2.92Å |
| 272 | D | 98 | Very high | 95.5 | Very high | 93 Ų | 93 | 92.5 Ų | 92.5 | 50% | 0.497 | 45% | 0.447 | S | S | . | . | H | α-helix | trans | -59.1 | -39.3 | 175.6 | -73.2 | -18.3 | 0 | 0 | 0 | 111.6 | N268 Y275 N276 | N268-D272 WeakPolarHBondContact O-CB 3.35Å; N268-D272 PolarHBondContact O-N 3.34Å; D272-Y275 PolarHBondContact O-N 3.05Å; D272-N276 WeakPolarHBondContact O-CB 3.06Å; D272-N276 VanDerWaalsContact O-CG 3.24Å; D272-N276 PolarHBondContact O-N 2.76Å; D272-N276 PolarHBondContact O-ND2 3.25Å |
| 273 | L | 98.1 | Very high | 95.9 | Very high | 80 Ų | 80 | 92.3 Ų | 92.3 | 42% | 0.419 | 44% | 0.442 | S | S | . | . | H | α-helix | trans | -63.3 | -43.7 | 174.5 | 176.9 | 62.4 | 0 | 0 | 0 | 111.9 | E269 I270 S271 N276 I277 L292 | E269-L273 WeakPolarHBondContact O-CB 3.47Å; E269-L273 PolarHBondContact O-N 3.13Å; I270-L273 WeakPolarHBondContact O-CB 3.2Å; I270-L273 PolarHBondContact O-N 2.75Å; S271-L273 VanDerWaalsContact C-N 3.28Å; S271-L273 PolarHBondContact O-N 3.38Å; L273-N276 PolarHBondContact O-N 2.95Å; L273-I277 HydrophobicContact CD1-CD1 3.97Å; L273-I277 HydrophobicContact CD1-CG1 4.26Å; L273-I277 HydrophobicContact CG-CD1 3.97Å; L273-I277 VanDerWaalsContact O-CG1 3.29Å; L273-I277 WeakPolarHBondContact O-CG1 3.36Å; L273-I277 PolarHBondContact O-N 2.79Å; L273-L292 HydrophobicContact CD2-CD1 3.92Å; L273-L292 HydrophobicContact CD2-CD2 4.01Å; L273-L292 HydrophobicContact CG-CD2 4.37Å |
| 274 | I | 98.1 | Very high | 96.3 | Very high | 17 Ų | 17 | 94.6 Ų | 94.6 | 9% | 0.087 | 45% | 0.454 | C | S | . | . | H | α-helix | trans | -62 | -47.7 | 176.9 | -67.1 | 165 | 0 | 0 | 0 | 109.9 | I270 S271 N276 I277 A278 E285 A288 E289 L292 | I270-I274 HydrophobicContact CG2-CD1 4Å; I270-I274 WeakPolarHBondContact O-CG1 3.14Å; I270-I274 PolarHBondContact O-N 2.89Å; S271-I274 WeakPolarHBondContact O-CB 3.35Å; S271-I274 PolarHBondContact O-N 3.14Å; S271-I274 VanDerWaalsContact O-N 3.09Å; I274-N276 VanDerWaalsContact C-N 3.35Å; I274-N276 PolarHBondContact O-N 3.29Å; I274-I277 PolarHBondContact O-N 3.39Å; I274-A278 WeakPolarHBondContact O-CB 3.37Å; I274-A278 PolarHBondContact O-N 3.1Å; I274-E285 HydrophobicContact CG2-CG 4.01Å; I274-A288 HydrophobicContact CG2-CB 4.11Å; I274-E289 HydrophobicContact CD1-CB 4.2Å; I274-E289 HydrophobicContact CD1-CG 4.04Å; I274-E289 HydrophobicContact CG2-CB 4.33Å; I274-L292 HydrophobicContact CD1-CD2 4.29Å; I274-L292 HydrophobicContact CG1-CD2 3.66Å |
| 275 | Y | 98 | Very high | 96.8 | Very high | 107 Ų | 107 | 92.6 Ų | 92.6 | 42% | 0.42 | 45% | 0.446 | S | S | . | . | H | α-helix | trans | -58.3 | -45.9 | 176 | -72.8 | -58.6 | 0 | 0 | 0 | 111.9 | S271 D272 I277 A278 Q279 E285 | S271-Y275 WeakPolarHBondContact O-CD2 3.33Å; S271-Y275 PolarHBondContact O-N 2.92Å; D272-Y275 PolarHBondContact O-N 3.05Å; Y275-I277 PolarHBondContact O-N 2.81Å; Y275-A278 PolarHBondContact O-N 3.15Å; Y275-Q279 WeakPolarHBondContact O-CB 3.09Å; Y275-Q279 VanDerWaalsContact O-CG 3.27Å; Y275-Q279 WeakPolarHBondContact O-CG 3.15Å; Y275-Q279 PolarHBondContact O-N 3.15Å; Y275-E285 HydrophobicContact CE1-CG 4.41Å; Y275-E285 WeakPolarHBondContact CE1-OE1 3.47Å; Y275-E285 VanDerWaalsContact CZ-OE1 3.28Å; Y275-E285 PolarHBondContact OH-OE1 3.37Å |
| 276 | N | 98.3 | Very high | 97 | Very high | 91 Ų | 91 | 90.6 Ų | 90.6 | 49% | 0.487 | 44% | 0.444 | S | S | . | . | H | α-helix | trans | -61.7 | -42 | 177.6 | -76.9 | -51 | 0 | 0 | 0 | 112 | D272 L273 I274 N280 | D272-N276 WeakPolarHBondContact O-CB 3.06Å; D272-N276 VanDerWaalsContact O-CG 3.24Å; D272-N276 PolarHBondContact O-N 2.76Å; D272-N276 PolarHBondContact O-ND2 3.25Å; L273-N276 PolarHBondContact O-N 2.95Å; I274-N276 VanDerWaalsContact C-N 3.35Å; I274-N276 PolarHBondContact O-N 3.29Å; N276-N280 WeakPolarHBondContact O-CB 3.13Å; N276-N280 PolarHBondContact O-N 3.45Å; N276-N280 PolarHBondContact O-ND2 3.29Å |
| 277 | I | 97.8 | Very high | 97.2 | Very high | 37 Ų | 37 | 88.7 Ų | 88.7 | 19% | 0.19 | 44% | 0.437 | C | S | . | . | H | α-helix | trans | -64.8 | -46.1 | 176.1 | -68.5 | 166.9 | 0 | 0 | 0 | 110.4 | L273 I274 Y275 Q279 N280 Y281 A288 L292 | L273-I277 HydrophobicContact CD1-CD1 3.97Å; L273-I277 HydrophobicContact CD1-CG1 4.26Å; L273-I277 HydrophobicContact CG-CD1 3.97Å; L273-I277 VanDerWaalsContact O-CG1 3.29Å; L273-I277 WeakPolarHBondContact O-CG1 3.36Å; L273-I277 PolarHBondContact O-N 2.79Å; I274-I277 PolarHBondContact O-N 3.39Å; Y275-I277 PolarHBondContact O-N 2.81Å; I277-Q279 VanDerWaalsContact C-N 3.34Å; I277-Q279 PolarHBondContact O-N 2.99Å; I277-N280 PolarHBondContact O-N 3.23Å; I277-Y281 HydrophobicContact CG2-CD2 4.11Å; I277-Y281 WeakPolarHBondContact O-CB 3.11Å; I277-Y281 WeakPolarHBondContact O-CD2 3.26Å; I277-Y281 PolarHBondContact O-N 3.42Å; I277-Y281 VanDerWaalsContact O-N 3.08Å; I277-A288 HydrophobicContact CB-CB 4.29Å; I277-A288 HydrophobicContact CG2-CB 3.91Å; I277-L292 HydrophobicContact CD1-CD1 4.33Å |
| 278 | A | 98.3 | Very high | 97.4 | Very high | 7 Ų | 7 | 86.1 Ų | 86.1 | 6% | 0.058 | 42% | 0.421 | C | S | . | . | H | α-helix | trans | -57.4 | -47.3 | 178.2 | 0 | 0 | 0 | 0 | 0 | 111.3 | I274 Y275 N282 L283 A288 | I274-A278 WeakPolarHBondContact O-CB 3.37Å; I274-A278 PolarHBondContact O-N 3.1Å; Y275-A278 PolarHBondContact O-N 3.15Å; A278-N282 CarbonylContact O-C 3.53Å; A278-N282 WeakPolarHBondContact O-CA 3.46Å; A278-N282 PolarHBondContact O-N 2.92Å; A278-L283 PolarHBondContact O-N 3.47Å; A278-A288 HydrophobicContact CB-CB 3.88Å |
| 279 | Q | 97.8 | Very high | 97.6 | Very high | 149 Ų | 149 | 86.9 Ų | 86.9 | 70% | 0.696 | 42% | 0.423 | S | S | * | . | H | α-helix | trans | -68.7 | -46.3 | 178.8 | -66.9 | -60.5 | -26.8 | 0 | 0 | 112.8 | Y275 I277 Y281 N282 | Y275-Q279 WeakPolarHBondContact O-CB 3.09Å; Y275-Q279 VanDerWaalsContact O-CG 3.27Å; Y275-Q279 WeakPolarHBondContact O-CG 3.15Å; Y275-Q279 PolarHBondContact O-N 3.15Å; I277-Q279 VanDerWaalsContact C-N 3.34Å; I277-Q279 PolarHBondContact O-N 2.99Å; Q279-Y281 PolarHBondContact O-N 3.42Å; Q279-N282 PolarHBondContact O-N 3.41Å |
| 280 | N | 97.8 | Very high | 97.6 | Very high | 120 Ų | 120 | 84.5 Ų | 84.5 | 64% | 0.642 | 42% | 0.418 | S | S | * | . | H | α-helix | trans | -65.7 | -28.9 | -176.3 | -71.7 | -27.8 | 0 | 0 | 0 | 113 | N276 I277 | N276-N280 WeakPolarHBondContact O-CB 3.13Å; N276-N280 PolarHBondContact O-N 3.45Å; N276-N280 PolarHBondContact O-ND2 3.29Å; I277-N280 PolarHBondContact O-N 3.23Å |
| 281 | Y | 96.8 | Very high | 97.7 | Very high | 171 Ų | 171 | 85.4 Ų | 85.4 | 67% | 0.671 | 42% | 0.418 | S | S | * | . | H | α-helix | trans | -113.3 | 5.6 | -177.5 | -64.7 | -80.6 | 0 | 0 | 0 | 113.4 | I277 Q279 L283 | I277-Y281 HydrophobicContact CG2-CD2 4.11Å; I277-Y281 WeakPolarHBondContact O-CB 3.11Å; I277-Y281 WeakPolarHBondContact O-CD2 3.26Å; I277-Y281 PolarHBondContact O-N 3.42Å; I277-Y281 VanDerWaalsContact O-N 3.08Å; Q279-Y281 PolarHBondContact O-N 3.42Å; Y281-L283 VanDerWaalsContact C-N 3.33Å; Y281-L283 PolarHBondContact O-N 2.98Å |
| 282 | N | 96.8 | Very high | 97.7 | Very high | 150 Ų | 150 | 85.2 Ų | 85.2 | 80% | 0.802 | 41% | 0.414 | S | S | * | . | T | Hydrogen-bonded Turn | trans | 48.4 | 51.9 | -176.3 | -168.8 | 54.3 | 0 | 0 | 0 | 112.6 | A278 Q279 | A278-N282 CarbonylContact O-C 3.53Å; A278-N282 WeakPolarHBondContact O-CA 3.46Å; A278-N282 PolarHBondContact O-N 2.92Å; Q279-N282 PolarHBondContact O-N 3.41Å |
| 283 | L | 96.8 | Very high | 97.7 | Very high | 41 Ų | 41 | 84.1 Ų | 84.1 | 22% | 0.215 | 41% | 0.41 | C | S | . | . | trans | -106.4 | 158.2 | 179 | -55.3 | 177.1 | 0 | 0 | 0 | 110.2 | A278 Y281 E287 K291 | A278-L283 PolarHBondContact O-N 3.47Å; Y281-L283 VanDerWaalsContact C-N 3.33Å; Y281-L283 PolarHBondContact O-N 2.98Å; L283-E287 HydrophobicContact CB-CB 4.44Å; L283-K291 HydrophobicContact CD1-CD 4.02Å | ||
| 284 | E | 97.6 | Very high | 97.7 | Very high | 145 Ų | 145 | 86.4 Ų | 86.4 | 68% | 0.678 | 42% | 0.419 | S | S | * | . | trans | -66.1 | 148.5 | 165.6 | -172.8 | 174.6 | 178.6 | 0 | 0 | 110.4 | Q286 E287 A288 | E284-Q286 VanDerWaalsContact C-N 3.28Å; E284-Q286 PolarHBondContact O-N 3.09Å; E284-E287 HydrophobicContact CB-CB 4.34Å; E284-E287 WeakPolarHBondContact O-CB 3.4Å; E284-E287 PolarHBondContact O-N 3.13Å; E284-A288 PolarHBondContact O-N 2.94Å | ||
| 285 | E | 96.9 | Very high | 97.6 | Very high | 95 Ų | 95 | 86.4 Ų | 86.4 | 44% | 0.444 | 42% | 0.423 | S | S | . | . | H | α-helix | trans | -54.8 | -44.1 | 179.9 | -173.7 | 173.3 | -178.3 | 0 | 0 | 111.7 | I274 Y275 E287 A288 E289 | I274-E285 HydrophobicContact CG2-CG 4.01Å; Y275-E285 HydrophobicContact CE1-CG 4.41Å; Y275-E285 WeakPolarHBondContact CE1-OE1 3.47Å; Y275-E285 VanDerWaalsContact CZ-OE1 3.28Å; Y275-E285 PolarHBondContact OH-OE1 3.37Å; E285-E287 VanDerWaalsContact C-N 3.31Å; E285-E287 PolarHBondContact O-N 3.47Å; E285-A288 PolarHBondContact O-N 3.49Å; E285-E289 WeakPolarHBondContact O-CB 3.42Å; E285-E289 PolarHBondContact O-N 2.88Å |
| 286 | Q | 97.8 | Very high | 97.6 | Very high | 118 Ų | 118 | 85.1 Ų | 85.1 | 55% | 0.551 | 43% | 0.426 | S | S | * | . | H | α-helix | trans | -64.7 | -34 | 177.4 | -164.4 | 63.2 | 56.8 | 0 | 0 | 112.7 | E284 E289 C290 | E284-Q286 VanDerWaalsContact C-N 3.28Å; E284-Q286 PolarHBondContact O-N 3.09Å; Q286-E289 PolarHBondContact NE2-OE2 3.3Å; Q286-C290 VanDerWaalsContact O-CB 3.23Å; Q286-C290 WeakPolarHBondContact O-CB 2.96Å; Q286-C290 PolarHBondContact O-N 2.86Å |
| 287 | E | 97.8 | Very high | 97.5 | Very high | 84 Ų | 84 | 85.1 Ų | 85.1 | 39% | 0.393 | 43% | 0.425 | S | S | . | . | H | α-helix | trans | -72.6 | -40.4 | 176.5 | -169.8 | -174 | 167.2 | 0 | 0 | 111.1 | L283 E284 E285 C290 K291 | L283-E287 HydrophobicContact CB-CB 4.44Å; E284-E287 HydrophobicContact CB-CB 4.34Å; E284-E287 WeakPolarHBondContact O-CB 3.4Å; E284-E287 PolarHBondContact O-N 3.13Å; E285-E287 VanDerWaalsContact C-N 3.31Å; E285-E287 PolarHBondContact O-N 3.47Å; E287-C290 PolarHBondContact O-N 3.04Å; E287-K291 HydrophobicContact CG-CD 4.5Å; E287-K291 WeakPolarHBondContact O-CB 3.26Å; E287-K291 WeakPolarHBondContact O-CG 3.37Å; E287-K291 PolarHBondContact O-N 3.3Å; E287-K291 WeakPolarHBondContact OE1-CE 3.36Å; E287-K291 IonicContact OE1-NZ 2.67Å; E287-K291 PolarHBondContact OE1-NZ 3.01Å |
| 288 | A | 98.2 | Very high | 97.4 | Very high | 0 Ų | 0 | 92.1 Ų | 92.1 | 0% | 0 | 45% | 0.449 | C | S | . | . | H | α-helix | trans | -63.5 | -44.5 | 175.2 | 0 | 0 | 0 | 0 | 0 | 111.6 | I274 I277 A278 E284 E285 K291 L292 | I274-A288 HydrophobicContact CG2-CB 4.11Å; I277-A288 HydrophobicContact CB-CB 4.29Å; I277-A288 HydrophobicContact CG2-CB 3.91Å; A278-A288 HydrophobicContact CB-CB 3.88Å; E284-A288 PolarHBondContact O-N 2.94Å; E285-A288 PolarHBondContact O-N 3.49Å; A288-K291 PolarHBondContact O-N 3.34Å; A288-L292 WeakPolarHBondContact O-CB 3.3Å; A288-L292 PolarHBondContact O-N 2.93Å |
| 289 | E | 97.9 | Very high | 97.2 | Very high | 77 Ų | 77 | 95.8 Ų | 95.8 | 36% | 0.36 | 47% | 0.467 | S | S | . | . | H | α-helix | trans | -58.6 | -51.1 | 173.3 | -174 | -165.4 | 170.1 | 0 | 0 | 110.8 | I274 E285 Q286 K291 L292 V293 | I274-E289 HydrophobicContact CD1-CB 4.2Å; I274-E289 HydrophobicContact CD1-CG 4.04Å; I274-E289 HydrophobicContact CG2-CB 4.33Å; E285-E289 WeakPolarHBondContact O-CB 3.42Å; E285-E289 PolarHBondContact O-N 2.88Å; Q286-E289 PolarHBondContact NE2-OE2 3.3Å; E289-K291 VanDerWaalsContact C-N 3.34Å; E289-K291 PolarHBondContact O-N 3.45Å; E289-L292 WeakPolarHBondContact O-CB 3.44Å; E289-L292 PolarHBondContact O-N 3.21Å; E289-L292 VanDerWaalsContact O-N 3.11Å; E289-V293 HydrophobicContact CG-CG2 4.45Å; E289-V293 WeakPolarHBondContact O-CG2 3.29Å; E289-V293 PolarHBondContact O-N 3.38Å |
| 290 | C | 97.7 | Very high | 96.9 | Very high | 61 Ų | 61 | 92.9 Ų | 92.9 | 41% | 0.412 | 46% | 0.463 | S | S | . | . | H | α-helix | trans | -57.8 | -45.4 | -179.9 | -178 | 0 | 0 | 0 | 0 | 111.8 | Q286 E287 L292 V293 H294 | Q286-C290 VanDerWaalsContact O-CB 3.23Å; Q286-C290 WeakPolarHBondContact O-CB 2.96Å; Q286-C290 PolarHBondContact O-N 2.86Å; E287-C290 PolarHBondContact O-N 3.04Å; C290-L292 PolarHBondContact O-N 2.72Å; C290-V293 PolarHBondContact O-N 2.79Å; C290-H294 WeakPolarHBondContact O-CB 3.44Å; C290-H294 PolarHBondContact O-CD2 3.44Å; C290-H294 PolarHBondContact O-N 3.28Å |
| 291 | K | 97.5 | Very high | 96.5 | Very high | 107 Ų | 107 | 92 Ų | 92 | 47% | 0.465 | 46% | 0.462 | S | S | . | . | H | α-helix | trans | -65 | -37.9 | 176.6 | -75.9 | -177.7 | -176.5 | 169.4 | 0 | 112.5 | L283 E287 A288 E289 G295 | L283-K291 HydrophobicContact CD1-CD 4.02Å; E287-K291 HydrophobicContact CG-CD 4.5Å; E287-K291 WeakPolarHBondContact O-CB 3.26Å; E287-K291 WeakPolarHBondContact O-CG 3.37Å; E287-K291 PolarHBondContact O-N 3.3Å; E287-K291 WeakPolarHBondContact OE1-CE 3.36Å; E287-K291 IonicContact OE1-NZ 2.67Å; E287-K291 PolarHBondContact OE1-NZ 3.01Å; A288-K291 PolarHBondContact O-N 3.34Å; E289-K291 VanDerWaalsContact C-N 3.34Å; E289-K291 PolarHBondContact O-N 3.45Å; K291-G295 PolarHBondContact O-N 2.87Å |
| 292 | L | 97.5 | Very high | 96.1 | Very high | 39 Ų | 39 | 91.5 Ų | 91.5 | 20% | 0.204 | 46% | 0.459 | C | S | . | . | H | α-helix | trans | -63 | -50.3 | 175.6 | 178.9 | 61.2 | 0 | 0 | 0 | 110.6 | I270 L273 I274 I277 A288 E289 C290 H294 G295 V296 | I270-L292 HydrophobicContact CG2-CD2 4.48Å; L273-L292 HydrophobicContact CD2-CD1 3.92Å; L273-L292 HydrophobicContact CD2-CD2 4.01Å; L273-L292 HydrophobicContact CG-CD2 4.37Å; I274-L292 HydrophobicContact CD1-CD2 4.29Å; I274-L292 HydrophobicContact CG1-CD2 3.66Å; I277-L292 HydrophobicContact CD1-CD1 4.33Å; A288-L292 WeakPolarHBondContact O-CB 3.3Å; A288-L292 PolarHBondContact O-N 2.93Å; E289-L292 WeakPolarHBondContact O-CB 3.44Å; E289-L292 PolarHBondContact O-N 3.21Å; E289-L292 VanDerWaalsContact O-N 3.11Å; C290-L292 PolarHBondContact O-N 2.72Å; L292-H294 PolarHBondContact O-N 3.46Å; L292-G295 WeakPolarHBondContact O-CA 3.49Å; L292-G295 PolarHBondContact O-N 2.87Å; L292-G295 VanDerWaalsContact O-N 3.13Å; L292-V296 HydrophobicContact CD1-CG2 4.44Å; L292-V296 WeakPolarHBondContact O-CG2 3.41Å; L292-V296 PolarHBondContact O-N 2.87Å |
| 293 | V | 98.1 | Very high | 95.4 | Very high | 70 Ų | 70 | 94.1 Ų | 94.1 | 42% | 0.424 | 46% | 0.463 | S | S | . | . | H | α-helix | trans | -58.7 | -48.7 | 178.3 | 172.7 | 0 | 0 | 0 | 0 | 111 | E289 C290 G295 V296 I297 | E289-V293 HydrophobicContact CG-CG2 4.45Å; E289-V293 WeakPolarHBondContact O-CG2 3.29Å; E289-V293 PolarHBondContact O-N 3.38Å; C290-V293 PolarHBondContact O-N 2.79Å; V293-G295 VanDerWaalsContact C-N 3.29Å; V293-G295 PolarHBondContact O-N 3.38Å; V293-V296 PolarHBondContact O-N 3.43Å; V293-I297 HydrophobicContact CG1-CD1 3.93Å; V293-I297 WeakPolarHBondContact O-CG1 3.3Å; V293-I297 PolarHBondContact O-N 2.88Å |
| 294 | H | 97.4 | Very high | 94.3 | Very high | 128 Ų | 128 | 96.5 Ų | 96.5 | 59% | 0.593 | 49% | 0.489 | S | S | * | . | H | α-helix | trans | -60 | -39.8 | 175.7 | -93.5 | -95.5 | 0 | 0 | 0 | 112.4 | C290 L292 I297 R298 | C290-H294 WeakPolarHBondContact O-CB 3.44Å; C290-H294 PolarHBondContact O-CD2 3.44Å; C290-H294 PolarHBondContact O-N 3.28Å; L292-H294 PolarHBondContact O-N 3.46Å; H294-I297 PolarHBondContact O-N 3.26Å; H294-R298 VanDerWaalsContact O-CB 3.31Å; H294-R298 WeakPolarHBondContact O-CB 3.44Å; H294-R298 PolarHBondContact O-N 3.18Å |
| 295 | G | 97.3 | Very high | 93.1 | Very high | 18 Ų | 18 | 99 Ų | 99 | 19% | 0.186 | 50% | 0.498 | C | S | . | . | H | α-helix | trans | -59.3 | -49.2 | 174.5 | 0 | 0 | 0 | 0 | 0 | 112 | K291 L292 V293 R298 I299 | K291-G295 PolarHBondContact O-N 2.87Å; L292-G295 WeakPolarHBondContact O-CA 3.49Å; L292-G295 PolarHBondContact O-N 2.87Å; L292-G295 VanDerWaalsContact O-N 3.13Å; V293-G295 VanDerWaalsContact C-N 3.29Å; V293-G295 PolarHBondContact O-N 3.38Å; G295-R298 PolarHBondContact O-N 3.13Å; G295-I299 VanDerWaalsContact O-CB 3.3Å; G295-I299 WeakPolarHBondContact O-CB 3.16Å; G295-I299 WeakPolarHBondContact O-CG1 3.27Å; G295-I299 PolarHBondContact O-N 3.41Å |
| 296 | V | 97 | Very high | 91.7 | Very high | 79 Ų | 79 | 104 Ų | 104 | 48% | 0.479 | 52% | 0.518 | S | S | . | . | H | α-helix | trans | -60.5 | -47.2 | 177.8 | 172.2 | 0 | 0 | 0 | 0 | 110.8 | L292 V293 I299 S300 | L292-V296 HydrophobicContact CD1-CG2 4.44Å; L292-V296 WeakPolarHBondContact O-CG2 3.41Å; L292-V296 PolarHBondContact O-N 2.87Å; V293-V296 PolarHBondContact O-N 3.43Å; V296-I299 PolarHBondContact O-N 2.67Å; V296-S300 VanDerWaalsContact O-CB 3.25Å; V296-S300 WeakPolarHBondContact O-CB 3.42Å; V296-S300 PolarHBondContact O-N 3.33Å; V296-S300 PolarHBondContact O-OG 3.36Å |
| 297 | I | 96.5 | Very high | 89.9 | Confident | 92 Ų | 92 | 108 Ų | 108 | 47% | 0.472 | 53% | 0.534 | S | S | . | . | H | α-helix | trans | -60.1 | -50.6 | 178.3 | -67.8 | 168.5 | 0 | 0 | 0 | 110.3 | V293 H294 I299 S300 T301 | V293-I297 HydrophobicContact CG1-CD1 3.93Å; V293-I297 WeakPolarHBondContact O-CG1 3.3Å; V293-I297 PolarHBondContact O-N 2.88Å; H294-I297 PolarHBondContact O-N 3.26Å; I297-I299 VanDerWaalsContact C-N 3.27Å; I297-I299 PolarHBondContact O-N 2.82Å; I297-S300 PolarHBondContact O-N 3.04Å; I297-T301 HydrophobicContact CG2-CG2 4.09Å; I297-T301 WeakPolarHBondContact O-CB 3.41Å; I297-T301 VanDerWaalsContact O-CG2 3.28Å; I297-T301 WeakPolarHBondContact O-CG2 3.22Å; I297-T301 PolarHBondContact O-N 2.96Å; I297-T301 PolarHBondContact O-OG1 3.4Å |
| 298 | R | 95.8 | Very high | 87.7 | Confident | 184 Ų | 184 | 108.5 Ų | 108.5 | 69% | 0.694 | 55% | 0.552 | S | S | * | * | H | α-helix | trans | -59 | -38.6 | 179.1 | -174.7 | 178.4 | 65.9 | 172.1 | -0.8 | 112.3 | H294 G295 R302 | H294-R298 VanDerWaalsContact O-CB 3.31Å; H294-R298 WeakPolarHBondContact O-CB 3.44Å; H294-R298 PolarHBondContact O-N 3.18Å; G295-R298 PolarHBondContact O-N 3.13Å; R298-R302 WeakPolarHBondContact O-CB 3.2Å; R298-R302 PolarHBondContact O-N 3.29Å; R298-R302 VanDerWaalsContact O-N 3.13Å |
| 299 | I | 94.4 | Very high | 85.4 | Confident | 83 Ų | 83 | 112.9 Ų | 112.9 | 43% | 0.426 | 58% | 0.583 | S | S | . | * | H | α-helix | trans | -73.9 | -34.1 | 179.3 | -72.3 | 175.1 | 0 | 0 | 0 | 112.2 | G295 V296 I297 R302 | G295-I299 VanDerWaalsContact O-CB 3.3Å; G295-I299 WeakPolarHBondContact O-CB 3.16Å; G295-I299 WeakPolarHBondContact O-CG1 3.27Å; G295-I299 PolarHBondContact O-N 3.41Å; V296-I299 PolarHBondContact O-N 2.67Å; I297-I299 VanDerWaalsContact C-N 3.27Å; I297-I299 PolarHBondContact O-N 2.82Å; I299-R302 WeakPolarHBondContact O-CG 3.24Å; I299-R302 PolarHBondContact O-NE 3.26Å; I299-R302 VanDerWaalsContact O-NE 3.15Å |
| 300 | S | 91.8 | Very high | 82.8 | Confident | 89 Ų | 89 | 116.8 Ų | 116.8 | 62% | 0.622 | 60% | 0.601 | S | S | * | * | H | α-helix | trans | -81.2 | -29.8 | -178.9 | -55.2 | 0 | 0 | 0 | 0 | 111.9 | V296 I297 | V296-S300 VanDerWaalsContact O-CB 3.25Å; V296-S300 WeakPolarHBondContact O-CB 3.42Å; V296-S300 PolarHBondContact O-N 3.33Å; V296-S300 PolarHBondContact O-OG 3.36Å; I297-S300 PolarHBondContact O-N 3.04Å |
| 301 | T | 88.9 | Confident | 80.4 | Confident | 101 Ų | 101 | 120.1 Ų | 120.1 | 62% | 0.62 | 62% | 0.622 | S | S | * | * | H | α-helix | trans | -93.5 | -17.1 | -178 | 57.1 | 0 | 0 | 0 | 0 | 113.8 | I297 K303 | I297-T301 HydrophobicContact CG2-CG2 4.09Å; I297-T301 WeakPolarHBondContact O-CB 3.41Å; I297-T301 VanDerWaalsContact O-CG2 3.28Å; I297-T301 WeakPolarHBondContact O-CG2 3.22Å; I297-T301 PolarHBondContact O-N 2.96Å; I297-T301 PolarHBondContact O-OG1 3.4Å; T301-K303 PolarHBondContact O-N 3.45Å |
| 302 | R | 88.4 | Confident | 77.7 | Confident | 161 Ų | 161 | 120 Ų | 120 | 61% | 0.608 | 63% | 0.634 | S | S | * | * | S | Bend | trans | -59.9 | 125 | 172.1 | 65.8 | -170.4 | 179.1 | -166.6 | 4.4 | 108.8 | R298 I299 A304 | R298-R302 WeakPolarHBondContact O-CB 3.2Å; R298-R302 PolarHBondContact O-N 3.29Å; R298-R302 VanDerWaalsContact O-N 3.13Å; I299-R302 WeakPolarHBondContact O-CG 3.24Å; I299-R302 PolarHBondContact O-NE 3.26Å; I299-R302 VanDerWaalsContact O-NE 3.15Å; R302-A304 PolarHBondContact O-N 3.15Å |
| 303 | K | 82 | Confident | 75 | Confident | 204 Ų | 204 | 124.8 Ų | 124.8 | 89% | 0.887 | 67% | 0.666 | S | S | * | * | trans | -61.1 | 116.9 | 168.5 | -73.1 | -156.8 | 173.6 | -175.5 | 0 | 107.8 | T301 K305 | T301-K303 PolarHBondContact O-N 3.45Å; K303-K305 PolarHBondContact O-N 3.47Å | ||
| 304 | A | 73.6 | Confident | 72.5 | Confident | 92 Ų | 92 | 124.9 Ų | 124.9 | 76% | 0.76 | 68% | 0.681 | S | S | * | * | trans | -61.9 | 99.5 | 177.2 | 0 | 0 | 0 | 0 | 0 | 108.7 | R302 K306 | R302-A304 PolarHBondContact O-N 3.15Å; A304-K306 VanDerWaalsContact C-N 3.31Å; A304-K306 PolarHBondContact O-N 2.8Å | ||
| 305 | K | 73.2 | Confident | 69.7 | Low | 198 Ų | 198 | 127.7 Ų | 127.7 | 86% | 0.861 | 69% | 0.694 | S | S | * | * | trans | -66.3 | 97 | 169.1 | -170.3 | 169.7 | -178.1 | 173.3 | 0 | 106.2 | K303 K307 | K303-K305 PolarHBondContact O-N 3.47Å; K305-K307 PolarHBondContact O-N 2.93Å | ||
| 306 | K | 66.3 | Low | 67.3 | Low | 199 Ų | 199 | 139.1 Ų | 139.1 | 87% | 0.865 | 73% | 0.731 | S | S | * | * | trans | -46.8 | 118.4 | 167.1 | -80.9 | -179.9 | 175.7 | 176.8 | 0 | 106.2 | A304 A308 | A304-K306 VanDerWaalsContact C-N 3.31Å; A304-K306 PolarHBondContact O-N 2.8Å; K306-A308 PolarHBondContact O-N 3.43Å | ||
| 307 | K | 61.4 | Low | 64.6 | Low | 201 Ų | 201 | 139.3 Ų | 139.3 | 87% | 0.874 | 74% | 0.742 | S | S | * | * | trans | -56.6 | 112.7 | 175.9 | -76 | -162.2 | 175 | -172.6 | 0 | 107.1 | K305 S309 | K305-K307 PolarHBondContact O-N 2.93Å; K307-S309 VanDerWaalsContact C-N 3.33Å; K307-S309 PolarHBondContact O-N 2.9Å | ||
| 308 | A | 50 | Low | 62.2 | Low | 95 Ų | 95 | 143.4 Ų | 143.4 | 79% | 0.785 | 77% | 0.765 | S | S | * | * | trans | -58.4 | 108.7 | 152.9 | 0 | 0 | 0 | 0 | 0 | 105.2 | K306 | K306-A308 PolarHBondContact O-N 3.43Š| ||
| 309 | S | 50.6 | Low | 59.3 | Low | 92 Ų | 92 | 137.3 Ų | 137.3 | 64% | 0.643 | 76% | 0.759 | S | S | * | * | trans | -55.3 | 149.4 | 162 | 179.9 | 0 | 0 | 0 | 0 | 108.1 | K307 | K307-S309 VanDerWaalsContact C-N 3.33Å; K307-S309 PolarHBondContact O-N 2.9Å | ||
| 310 | H | 43.3 | Very low | 57.2 | Low | 159 Ų | 159 | 145.6 Ų | 145.6 | 74% | 0.736 | 79% | 0.785 | S | S | * | * | trans | 98.1 | 101.6 | -177 | -51.8 | -61.4 | 0 | 0 | 0 | 116.3 | S312 | H310-S312 PolarHBondContact O-N 2.75Š| ||
| 311 | P | 46.6 | Very low | 55 | Low | 132 Ų | 132 | 148.2 Ų | 148.2 | 86% | 0.857 | 79% | 0.792 | S | S | * | * | trans | -80.1 | 90.9 | 146.9 | 32.5 | -23.5 | 0 | 0 | 0 | 107.3 | T313 | P311-T313 PolarHBondContact O-N 2.81Š| ||
| 312 | S | 41.6 | Very low | 53.1 | Low | 103 Ų | 103 | 152 Ų | 152 | 72% | 0.72 | 81% | 0.809 | S | S | * | * | trans | -78.3 | 108.9 | 159.6 | 59.4 | 0 | 0 | 0 | 0 | 107.3 | H310 | H310-S312 PolarHBondContact O-N 2.75Š| ||
| 313 | T | 40.8 | Very low | 51.2 | Low | 141 Ų | 141 | 147.2 Ų | 147.2 | 87% | 0.865 | 81% | 0.809 | S | S | * | * | trans | 5.1 | 124.3 | 146.5 | -43.6 | 0 | 0 | 0 | 0 | 115.3 | P311 | P311-T313 PolarHBondContact O-N 2.81Š| ||
| 314 | G | 46.5 | Very low | 49.9 | Very low | 72 Ų | 72 | 144.5 Ų | 144.5 | 74% | 0.742 | 81% | 0.809 | S | S | * | * | trans | -64.1 | 161.8 | -159.4 | 0 | 0 | 0 | 0 | 0 | 117.2 | ||||
| 315 | Q | 37 | Very low | 49 | Very low | 187 Ų | 187 | 147.3 Ų | 147.3 | 87% | 0.874 | 81% | 0.811 | S | S | * | * | trans | -157.3 | 116 | 144.9 | -106.9 | -178.6 | 3 | 0 | 0 | 107.4 | ||||
| 316 | R | 46.8 | Very low | 48 | Very low | 257 Ų | 257 | 143.4 Ų | 143.4 | 97% | 0.97 | 81% | 0.806 | S | S | * | * | trans | -69.5 | 121.9 | 150.9 | -76.4 | -174.7 | 177.2 | -172.4 | -0.4 | 105.9 | ||||
| 317 | A | 41.6 | Very low | 47.2 | Very low | 84 Ų | 84 | 140.7 Ų | 140.7 | 69% | 0.694 | 80% | 0.801 | S | S | * | * | trans | -148.6 | 121.9 | 154.1 | 0 | 0 | 0 | 0 | 0 | 108.6 | G319 | A317-G319 PolarHBondContact O-N 2.97Š| ||
| 318 | N | 45.2 | Very low | 46.9 | Very low | 178 Ų | 178 | 134.6 Ų | 134.6 | 95% | 0.952 | 78% | 0.784 | S | S | * | * | trans | -41 | 125.8 | 165.5 | -131.4 | -13.5 | 0 | 0 | 0 | 110.8 | ||||
| 319 | G | 36 | Very low | 47.3 | Very low | 56 Ų | 56 | 133.3 Ų | 133.3 | 58% | 0.577 | 78% | 0.78 | S | S | * | * | trans | -147.4 | 101.6 | 176.3 | 0 | 0 | 0 | 0 | 0 | 109.6 | A317 N321 | A317-G319 PolarHBondContact O-N 2.97Å; G319-N321 PolarHBondContact O-OD1 3.16Å | ||
| 320 | R | 49.3 | Very low | 47.5 | Very low | 257 Ų | 257 | 135.1 Ų | 135.1 | 97% | 0.97 | 78% | 0.782 | S | S | * | * | trans | -65.2 | 122.6 | 160.5 | -82.2 | 165.2 | 132.1 | 163.8 | -5.5 | 107.6 | ||||
| 321 | N | 45.8 | Very low | 48.1 | Very low | 144 Ų | 144 | 134.9 Ų | 134.9 | 77% | 0.77 | 78% | 0.781 | S | S | * | * | trans | -143.2 | 98.6 | 164.2 | 38.8 | -42.1 | 0 | 0 | 0 | 108.2 | G319 G323 | G319-N321 PolarHBondContact O-OD1 3.16Å; N321-G323 PolarHBondContact O-N 2.98Å | ||
| 322 | D | 50.3 | Low | 48.7 | Very low | 181 Ų | 181 | 135 Ų | 135 | 97% | 0.968 | 78% | 0.78 | S | S | * | * | trans | -44.9 | 119.1 | 155.8 | -96.7 | -43.2 | 0 | 0 | 0 | 109.2 | ||||
| 323 | G | 48.4 | Very low | 49.4 | Very low | 59 Ų | 59 | 138.3 Ų | 138.3 | 61% | 0.608 | 79% | 0.786 | S | S | * | * | trans | -172.3 | 100.1 | 179.7 | 0 | 0 | 0 | 0 | 0 | 107.2 | N321 L325 | N321-G323 PolarHBondContact O-N 2.98Å; G323-L325 PolarHBondContact O-N 3.4Å; G323-L325 VanDerWaalsContact O-N 3.12Å | ||
| 324 | T | 53.4 | Low | 49.9 | Very low | 147 Ų | 147 | 137.1 Ų | 137.1 | 90% | 0.902 | 78% | 0.779 | S | S | * | * | trans | -38 | 112.1 | -177.2 | -37.8 | 0 | 0 | 0 | 0 | 111.7 | ||||
| 325 | L | 54.3 | Low | 50.1 | Low | 151 Ų | 151 | 141.4 Ų | 141.4 | 79% | 0.791 | 78% | 0.779 | S | S | * | * | trans | -63.9 | 139.9 | 172 | -72.5 | 162.6 | 0 | 0 | 0 | 108.8 | G323 D327 | G323-L325 PolarHBondContact O-N 3.4Å; G323-L325 VanDerWaalsContact O-N 3.12Å; L325-D327 PolarHBondContact O-N 3.3Å | ||
| 326 | P | 52.6 | Low | 50.9 | Low | 116 Ų | 116 | 138 Ų | 138 | 75% | 0.753 | 77% | 0.771 | S | S | * | * | trans | -65.9 | 109.7 | 161.8 | 27.9 | -29.2 | 0 | 0 | 0 | 107 | S328 | P326-S328 PolarHBondContact O-N 3.27Š| ||
| 327 | D | 50.7 | Low | 50.9 | Low | 142 Ų | 142 | 135 Ų | 135 | 76% | 0.759 | 77% | 0.765 | S | S | * | * | trans | -61.2 | 81 | 167 | 179.6 | 16.2 | 0 | 0 | 0 | 108.5 | L325 G329 | L325-D327 PolarHBondContact O-N 3.3Å; D327-G329 VanDerWaalsContact C-N 3.27Å; D327-G329 PolarHBondContact O-N 3.27Å; D327-G329 VanDerWaalsContact O-N 3.15Å | ||
| 328 | S | 53.7 | Low | 51.4 | Low | 74 Ų | 74 | 139.5 Ų | 139.5 | 52% | 0.517 | 77% | 0.774 | S | S | . | * | trans | -80.7 | 81.8 | 170.4 | 161.7 | 0 | 0 | 0 | 0 | 106.5 | P326 N330 | P326-S328 PolarHBondContact O-N 3.27Å; S328-N330 VanDerWaalsContact C-N 3.32Å; S328-N330 PolarHBondContact O-N 2.67Å; S328-N330 PolarHBondContact O-OD1 3.21Å | ||
| 329 | G | 58 | Low | 51.1 | Low | 68 Ų | 68 | 136.1 Ų | 136.1 | 70% | 0.701 | 77% | 0.765 | S | S | * | * | trans | -55.5 | 84.1 | -179.5 | 0 | 0 | 0 | 0 | 0 | 114.3 | D327 | D327-G329 VanDerWaalsContact C-N 3.27Å; D327-G329 PolarHBondContact O-N 3.27Å; D327-G329 VanDerWaalsContact O-N 3.15Å | ||
| 330 | N | 56.5 | Low | 51.7 | Low | 130 Ų | 130 | 139.2 Ų | 139.2 | 70% | 0.695 | 78% | 0.778 | S | S | * | * | trans | -139.8 | 22.5 | 173.3 | 67.6 | 8.7 | 0 | 0 | 0 | 113.9 | S328 | S328-N330 VanDerWaalsContact C-N 3.32Å; S328-N330 PolarHBondContact O-N 2.67Å; S328-N330 PolarHBondContact O-OD1 3.21Å | ||
| 331 | E | 55.3 | Low | 51.8 | Low | 153 Ų | 153 | 135 Ų | 135 | 72% | 0.715 | 78% | 0.775 | S | S | * | * | trans | -111.1 | 18.4 | -176.8 | 51.6 | -162.9 | 147 | 0 | 0 | 115.2 | M333 | E331-M333 PolarHBondContact O-N 3.48Š| ||
| 332 | T | 58.8 | Low | 52.2 | Low | 136 Ų | 136 | 133 Ų | 133 | 83% | 0.834 | 77% | 0.771 | S | S | * | * | S | Bend | trans | -82.2 | 110.3 | 167 | 9 | 0 | 0 | 0 | 0 | 110.5 | ||
| 333 | M | 56.7 | Low | 52.7 | Low | 171 Ų | 171 | 131 Ų | 131 | 84% | 0.842 | 77% | 0.766 | S | S | * | * | S | Bend | trans | 100.4 | 51.5 | 166.6 | -54.3 | -147.6 | -52.4 | 0 | 0 | 119.5 | E331 | E331-M333 PolarHBondContact O-N 3.48Š|
| 334 | T | 51.8 | Low | 53.2 | Low | 117 Ų | 117 | 133 Ų | 133 | 72% | 0.718 | 77% | 0.768 | S | S | * | * | S | Bend | trans | -123.9 | 2.2 | 158.8 | 51.4 | 0 | 0 | 0 | 0 | 116.1 | ||
| 335 | Q | 50.6 | Low | 53.9 | Low | 162 Ų | 162 | 133.2 Ų | 133.2 | 76% | 0.757 | 76% | 0.759 | S | S | * | * | S | Bend | trans | -122.3 | 74.4 | 177.5 | -82.4 | 85 | -2.1 | 0 | 0 | 111.8 | ||
| 336 | T | 52.9 | Low | 54.7 | Low | 114 Ų | 114 | 132 Ų | 132 | 70% | 0.699 | 76% | 0.758 | S | S | * | * | trans | -148.8 | -8.1 | 163.7 | -34.5 | 0 | 0 | 0 | 0 | 115.9 | M338 | T336-M338 PolarHBondContact O-N 2.98Š| ||
| 337 | F | 46.6 | Very low | 55.7 | Low | 194 Ų | 194 | 133.6 Ų | 133.6 | 85% | 0.851 | 75% | 0.753 | S | S | * | * | S | Bend | trans | -87.5 | 13.5 | -172.7 | -70.1 | -71.8 | 0 | 0 | 0 | 116.7 | ||
| 338 | M | 51.5 | Low | 56.9 | Low | 179 Ų | 179 | 133.5 Ų | 133.5 | 88% | 0.882 | 76% | 0.756 | S | S | * | * | S | Bend | trans | -129.6 | 43.4 | -175.2 | -66.3 | -78.6 | 109.8 | 0 | 0 | 114 | T336 | T336-M338 PolarHBondContact O-N 2.98Š|
| 339 | S | 40.2 | Very low | 58.1 | Low | 108 Ų | 108 | 135.6 Ų | 135.6 | 76% | 0.755 | 77% | 0.771 | S | S | * | * | trans | -153.8 | 110.2 | 159.3 | -76.8 | 0 | 0 | 0 | 0 | 110 | ||||
| 340 | S | 48.3 | Very low | 59.4 | Low | 121 Ų | 121 | 141 Ų | 141 | 85% | 0.846 | 78% | 0.778 | S | S | * | * | trans | -69.4 | 146.8 | 164.7 | -52.9 | 0 | 0 | 0 | 0 | 109.7 | ||||
| 341 | D | 51.4 | Low | 60.8 | Low | 169 Ų | 169 | 139.6 Ų | 139.6 | 90% | 0.904 | 77% | 0.768 | S | S | * | * | S | Bend | trans | 84.6 | 43.3 | 173.4 | -69.9 | -12.9 | 0 | 0 | 0 | 120.5 | ||
| 342 | S | 54.8 | Low | 62.4 | Low | 100 Ų | 100 | 135.4 Ų | 135.4 | 70% | 0.699 | 75% | 0.753 | S | S | * | * | trans | -150 | 118.5 | 146.2 | 62.7 | 0 | 0 | 0 | 0 | 111.4 | P344 | S342-P344 WeakPolarHBondContact O-CD 3.38Š| ||
| 343 | V | 60.9 | Low | 63.8 | Low | 141 Ų | 141 | 134.3 Ų | 134.3 | 86% | 0.855 | 75% | 0.748 | S | S | * | * | trans | -54.3 | 118.1 | 167.4 | -179.9 | 0 | 0 | 0 | 0 | 107.6 | E345 | V343-E345 PolarHBondContact O-N 3.22Å; V343-E345 VanDerWaalsContact O-N 3.13Å | ||
| 344 | P | 58.8 | Low | 65.1 | Low | 100 Ų | 100 | 130.1 Ų | 130.1 | 65% | 0.649 | 74% | 0.735 | S | S | * | * | trans | -69.5 | 115.5 | 179.8 | 24.6 | -29 | 0 | 0 | 0 | 108.8 | S342 V346 | S342-P344 WeakPolarHBondContact O-CD 3.38Å; P344-V346 VanDerWaalsContact C-N 3.34Å; P344-V346 PolarHBondContact O-N 3.18Å | ||
| 345 | E | 68.1 | Low | 67 | Low | 151 Ų | 151 | 128.2 Ų | 128.2 | 71% | 0.706 | 72% | 0.72 | S | S | * | * | trans | -66 | 95.5 | 168.7 | -170.8 | -172.8 | 177.2 | 0 | 0 | 107.9 | V343 K347 | V343-E345 PolarHBondContact O-N 3.22Å; V343-E345 VanDerWaalsContact O-N 3.13Å; E345-K347 HydrophobicContact CG-CG 4.31Å; E345-K347 PolarHBondContact O-N 3.41Å; E345-K347 WeakPolarHBondContact OE1-CE 3.48Å; E345-K347 IonicContact OE1-NZ 3.5Å; E345-K347 WeakPolarHBondContact OE2-CE 3.39Å; E345-K347 IonicContact OE2-NZ 3.21Å; E345-K347 PolarHBondContact OE2-NZ 3.39Å | ||
| 346 | V | 70 | Confident | 68.7 | Low | 127 Ų | 127 | 126.2 Ų | 126.2 | 77% | 0.77 | 71% | 0.711 | S | S | * | * | trans | -70.9 | 98.7 | 177.5 | 178.9 | 0 | 0 | 0 | 0 | 108.3 | P344 | P344-V346 VanDerWaalsContact C-N 3.34Å; P344-V346 PolarHBondContact O-N 3.18Å | ||
| 347 | K | 74.2 | Confident | 70.4 | Confident | 149 Ų | 149 | 126 Ų | 126 | 65% | 0.648 | 71% | 0.705 | S | S | * | * | trans | -87 | 112.5 | 170.3 | -65.6 | -176.6 | -177.4 | 174.5 | 0 | 108.8 | E345 S349 | E345-K347 HydrophobicContact CG-CG 4.31Å; E345-K347 PolarHBondContact O-N 3.41Å; E345-K347 WeakPolarHBondContact OE1-CE 3.48Å; E345-K347 IonicContact OE1-NZ 3.5Å; E345-K347 WeakPolarHBondContact OE2-CE 3.39Å; E345-K347 IonicContact OE2-NZ 3.21Å; E345-K347 PolarHBondContact OE2-NZ 3.39Å; K347-S349 PolarHBondContact O-N 3.27Å | ||
| 348 | V | 76 | Confident | 72.2 | Confident | 139 Ų | 139 | 119.4 Ų | 119.4 | 84% | 0.842 | 69% | 0.687 | S | S | * | * | P | Polyproline II helix | trans | -66.5 | 126.2 | 168.3 | -109.7 | 0 | 0 | 0 | 0 | 108.4 | ||
| 349 | S | 78.1 | Confident | 73.8 | Confident | 118 Ų | 118 | 117 Ų | 117 | 83% | 0.825 | 67% | 0.668 | S | S | * | * | P | Polyproline II helix | trans | -61.6 | 146.8 | 177.7 | -55.7 | 0 | 0 | 0 | 0 | 111.2 | K347 | K347-S349 PolarHBondContact O-N 3.27Š|
| 350 | E | 86.8 | Confident | 75.8 | Confident | 182 Ų | 182 | 120.3 Ų | 120.3 | 85% | 0.85 | 67% | 0.668 | S | S | * | * | P | Polyproline II helix | trans | -61.3 | 140.4 | 173.1 | -66.4 | -173.1 | 172.7 | 0 | 0 | 110.3 | T352 | E350-T352 PolarHBondContact O-N 2.98Š|
| 351 | Q | 84.6 | Confident | 77.5 | Confident | 101 Ų | 101 | 121.4 Ų | 121.4 | 47% | 0.472 | 66% | 0.662 | S | S | . | * | P | Polyproline II helix | trans | -64.5 | 121.8 | -177.4 | -172.1 | -150.7 | -58.4 | 0 | 0 | 110.6 | D355 | Q351-D355 HydrophobicContact CG-CB 3.89Š|
| 352 | T | 88.6 | Confident | 79 | Confident | 65 Ų | 65 | 122.2 Ų | 122.2 | 40% | 0.399 | 65% | 0.652 | S | S | . | * | P | Polyproline II helix | trans | -82.5 | 160.2 | 178.2 | 70 | 0 | 0 | 0 | 0 | 111.7 | E350 S354 D355 E356 | E350-T352 PolarHBondContact O-N 2.98Å; T352-S354 PolarHBondContact O-N 2.87Å; T352-D355 WeakPolarHBondContact CB-OD2 3.47Å; T352-D355 PolarHBondContact N-OD2 2.73Å; T352-D355 WeakPolarHBondContact O-CB 3.48Å; T352-D355 PolarHBondContact O-N 2.86Å; T352-D355 PolarHBondContact OG1-N 3Å; T352-D355 PolarHBondContact OG1-OD2 3.26Å; T352-E356 PolarHBondContact O-N 3.2Å |
| 353 | P | 87.9 | Confident | 79.4 | Confident | 113 Ų | 113 | 122.9 Ų | 122.9 | 73% | 0.734 | 66% | 0.655 | S | S | * | * | H | α-helix | trans | -58.2 | -27.7 | 172.5 | -23.7 | 33.4 | 0 | 0 | 0 | 113.1 | E356 L357 | P353-E356 PolarHBondContact O-N 3Å; P353-L357 PolarHBondContact O-N 3.27Å; P353-L357 VanDerWaalsContact O-N 3.13Å |
| 354 | S | 85.8 | Confident | 79.4 | Confident | 83 Ų | 83 | 126.9 Ų | 126.9 | 58% | 0.58 | 66% | 0.656 | S | S | * | * | H | α-helix | trans | -66.8 | -41 | 174.5 | -175 | 0 | 0 | 0 | 0 | 111.8 | T352 E356 L357 A358 | T352-S354 PolarHBondContact O-N 2.87Å; S354-E356 PolarHBondContact O-N 3.12Å; S354-L357 PolarHBondContact O-N 2.88Å; S354-A358 WeakPolarHBondContact O-CB 3.37Å; S354-A358 PolarHBondContact O-N 3.29Å |
| 355 | D | 90.1 | Very high | 79.2 | Confident | 76 Ų | 76 | 125 Ų | 125 | 41% | 0.406 | 65% | 0.654 | S | S | . | * | H | α-helix | trans | -65.7 | -30.3 | 177.3 | -56 | -44.4 | 0 | 0 | 0 | 111.8 | Q351 T352 R359 | Q351-D355 HydrophobicContact CG-CB 3.89Å; T352-D355 WeakPolarHBondContact CB-OD2 3.47Å; T352-D355 PolarHBondContact N-OD2 2.73Å; T352-D355 WeakPolarHBondContact O-CB 3.48Å; T352-D355 PolarHBondContact O-N 2.86Å; T352-D355 PolarHBondContact OG1-N 3Å; T352-D355 PolarHBondContact OG1-OD2 3.26Å; D355-R359 WeakPolarHBondContact O-CG 3.26Å; D355-R359 PolarHBondContact O-N 2.82Å; D355-R359 PolarHBondContact O-NE 2.89Å |
| 356 | E | 88.1 | Confident | 78.6 | Confident | 120 Ų | 120 | 123.3 Ų | 123.3 | 56% | 0.561 | 66% | 0.659 | S | S | * | * | H | α-helix | trans | -70 | -46.3 | 173.4 | -165 | 161.1 | -178.8 | 0 | 0 | 112.3 | T352 P353 S354 A358 R359 K360 | T352-E356 PolarHBondContact O-N 3.2Å; P353-E356 PolarHBondContact O-N 3Å; S354-E356 PolarHBondContact O-N 3.12Å; E356-A358 VanDerWaalsContact C-N 3.31Å; E356-A358 PolarHBondContact O-N 3.37Å; E356-R359 PolarHBondContact O-N 3.35Å; E356-K360 PolarHBondContact O-N 3.15Å |
| 357 | L | 87.4 | Confident | 77.8 | Confident | 111 Ų | 111 | 128.4 Ų | 128.4 | 58% | 0.581 | 66% | 0.664 | S | S | * | * | H | α-helix | trans | -58.5 | -44.9 | 175.5 | -176.8 | 67 | 0 | 0 | 0 | 111 | P353 S354 R359 K360 M361 | P353-L357 PolarHBondContact O-N 3.27Å; P353-L357 VanDerWaalsContact O-N 3.13Å; S354-L357 PolarHBondContact O-N 2.88Å; L357-R359 VanDerWaalsContact C-N 3.33Å; L357-R359 PolarHBondContact O-N 2.91Å; L357-K360 PolarHBondContact O-N 2.92Å; L357-K360 VanDerWaalsContact O-N 3.16Å; L357-M361 WeakPolarHBondContact O-CG 3.26Å; L357-M361 PolarHBondContact O-N 3.35Å |
| 358 | A | 85.3 | Confident | 76.2 | Confident | 55 Ų | 55 | 128.1 Ų | 128.1 | 46% | 0.455 | 68% | 0.675 | S | S | . | * | H | α-helix | trans | -61.5 | -38.5 | 178.5 | 0 | 0 | 0 | 0 | 0 | 112.7 | S354 E356 M361 | S354-A358 WeakPolarHBondContact O-CB 3.37Å; S354-A358 PolarHBondContact O-N 3.29Å; E356-A358 VanDerWaalsContact C-N 3.31Å; E356-A358 PolarHBondContact O-N 3.37Å; A358-M361 PolarHBondContact O-N 3.14Å |
| 359 | R | 84.7 | Confident | 74.7 | Confident | 128 Ų | 128 | 127.5 Ų | 127.5 | 48% | 0.483 | 68% | 0.677 | S | S | . | * | H | α-helix | trans | -69.6 | -35.6 | 175.1 | -74.9 | -176 | -63.1 | 157.4 | 15.2 | 112.2 | D355 E356 L357 M361 R362 | D355-R359 WeakPolarHBondContact O-CG 3.26Å; D355-R359 PolarHBondContact O-N 2.82Å; D355-R359 PolarHBondContact O-NE 2.89Å; E356-R359 PolarHBondContact O-N 3.35Å; L357-R359 VanDerWaalsContact C-N 3.33Å; L357-R359 PolarHBondContact O-N 2.91Å; R359-M361 VanDerWaalsContact C-N 3.34Å; R359-R362 PolarHBondContact O-N 3.06Å |
| 360 | K | 82.9 | Confident | 72.8 | Confident | 177 Ų | 177 | 127.1 Ų | 127.1 | 77% | 0.77 | 68% | 0.675 | S | S | * | * | H | α-helix | trans | -71.1 | -26.3 | 176.9 | -168.2 | 174.2 | 179.9 | 178.9 | 0 | 113.4 | E356 L357 R362 | E356-K360 PolarHBondContact O-N 3.15Å; L357-K360 PolarHBondContact O-N 2.92Å; L357-K360 VanDerWaalsContact O-N 3.16Å; K360-R362 PolarHBondContact O-N 3.26Å |
| 361 | M | 82.8 | Confident | 70.9 | Confident | 145 Ų | 145 | 126.3 Ų | 126.3 | 71% | 0.714 | 68% | 0.675 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -70.4 | -14.5 | 173.4 | -72.2 | -59.8 | -61.9 | 0 | 0 | 113.4 | L357 A358 R359 P363 | L357-M361 WeakPolarHBondContact O-CG 3.26Å; L357-M361 PolarHBondContact O-N 3.35Å; A358-M361 PolarHBondContact O-N 3.14Å; R359-M361 VanDerWaalsContact C-N 3.34Å; M361-P363 WeakPolarHBondContact O-CD 3.27Å |
| 362 | R | 83.4 | Confident | 68.7 | Low | 185 Ų | 185 | 129.8 Ų | 129.8 | 70% | 0.698 | 70% | 0.696 | S | S | * | * | S | Bend | trans | -81.7 | 123.4 | 174.2 | -62.7 | -172.3 | -172.8 | -174.5 | 2.5 | 109.2 | R359 K360 Y364 G365 | R359-R362 PolarHBondContact O-N 3.06Å; K360-R362 PolarHBondContact O-N 3.26Å; R362-Y364 PolarHBondContact O-N 3.39Å; R362-G365 PolarHBondContact O-N 2.9Å |
| 363 | P | 63.3 | Low | 66.5 | Low | 115 Ų | 115 | 133.3 Ų | 133.3 | 75% | 0.747 | 71% | 0.712 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -64.8 | 5.7 | -171.5 | 19.9 | -29.3 | 0 | 0 | 0 | 116.6 | M361 | M361-P363 WeakPolarHBondContact O-CD 3.27Š|
| 364 | Y | 60 | Low | 63.9 | Low | 225 Ų | 225 | 135.9 Ų | 135.9 | 88% | 0.882 | 71% | 0.712 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -141.9 | 33.5 | 179.4 | -63.5 | -77.5 | 0 | 0 | 0 | 114 | R362 | R362-Y364 PolarHBondContact O-N 3.39Š|
| 365 | G | 55.3 | Low | 61.3 | Low | 59 Ų | 59 | 139.7 Ų | 139.7 | 61% | 0.608 | 72% | 0.72 | S | S | * | * | trans | -89 | -3.3 | -175.2 | 0 | 0 | 0 | 0 | 0 | 117.6 | R362 | R362-G365 PolarHBondContact O-N 2.9Š| ||
| 366 | S | 55.9 | Low | 58.7 | Low | 116 Ų | 116 | 142.6 Ų | 142.6 | 81% | 0.811 | 74% | 0.741 | S | S | * | * | trans | -108.9 | 87.5 | -179.2 | -79.2 | 0 | 0 | 0 | 0 | 111.4 | ||||
| 367 | R | 52.3 | Low | 56.2 | Low | 234 Ų | 234 | 142.8 Ų | 142.8 | 88% | 0.883 | 75% | 0.75 | S | S | * | * | S | Bend | trans | 154.7 | 97 | 141.2 | -88.2 | 164.3 | 154.9 | -143.7 | -6.7 | 109.5 | ||
| 368 | T | 41 | Very low | 53.8 | Low | 143 Ų | 143 | 146.7 Ų | 146.7 | 88% | 0.877 | 77% | 0.765 | S | S | * | * | 167.8 | 92.7 | 126.5 | 48.4 | 0 | 0 | 0 | 0 | 107.8 | |||||
| 369 | S | 44.7 | Very low | 51.2 | Low | 126 Ų | 126 | 151.2 Ų | 151.2 | 88% | 0.881 | 78% | 0.782 | S | S | * | * | trans | -115.1 | 96.2 | 159.6 | -60.7 | 0 | 0 | 0 | 0 | 106.5 | ||||
| 370 | S | 38.8 | Very low | 49.2 | Very low | 111 Ų | 111 | 151.7 Ų | 151.7 | 78% | 0.776 | 80% | 0.799 | S | S | * | * | trans | -146.1 | 96.7 | 163.1 | -54.7 | 0 | 0 | 0 | 0 | 108.2 | ||||
| 371 | L | 45.8 | Very low | 47 | Very low | 164 Ų | 164 | 146.2 Ų | 146.2 | 86% | 0.859 | 79% | 0.793 | S | S | * | * | trans | 34.7 | 105.2 | 143.9 | -63.3 | 165 | 0 | 0 | 0 | 117.4 | ||||
| 372 | L | 38.4 | Very low | 44.9 | Very low | 175 Ų | 175 | 146.2 Ų | 146.2 | 92% | 0.916 | 80% | 0.801 | S | S | * | * | trans | -138.7 | 109.7 | 137.2 | -74.9 | -178.5 | 0 | 0 | 0 | 109.7 | ||||
| 373 | L | 42.8 | Very low | 42.8 | Very low | 138 Ų | 138 | 144.4 Ų | 144.4 | 72% | 0.723 | 81% | 0.806 | S | S | * | * | trans | -54.5 | 170.1 | 156.7 | -173.1 | 66.5 | 0 | 0 | 0 | 110.1 | ||||
| 374 | F | 32.5 | Very low | 41.9 | Very low | 167 Ų | 167 | 145 Ų | 145 | 73% | 0.732 | 81% | 0.812 | S | S | * | * | trans | 86.9 | 136.4 | 175 | -49.4 | -73.1 | 0 | 0 | 0 | 114.3 | ||||
| 375 | E | 31.2 | Very low | 41.3 | Very low | 163 Ų | 163 | 139.4 Ų | 139.4 | 76% | 0.762 | 81% | 0.806 | S | S | * | * | cis | -170.5 | 142.9 | -13.2 | -174.3 | 159.7 | 162.3 | 0 | 0 | 103.5 | V377 | E375-V377 PolarHBondContact O-N 3.3Š| ||
| 376 | T | 37 | Very low | 41.1 | Very low | 137 Ų | 137 | 140.4 Ų | 140.4 | 84% | 0.84 | 82% | 0.817 | S | S | * | * | trans | -68.5 | 113.5 | -177.8 | 47.2 | 0 | 0 | 0 | 0 | 111.4 | ||||
| 377 | V | 35.6 | Very low | 40.7 | Very low | 125 Ų | 125 | 138.3 Ų | 138.3 | 76% | 0.758 | 81% | 0.806 | S | S | * | * | trans | -139.5 | 112.9 | 156.8 | -179.6 | 0 | 0 | 0 | 0 | 108.9 | E375 | E375-V377 PolarHBondContact O-N 3.3Š| ||
| 378 | H | 36.1 | Very low | 40.6 | Very low | 192 Ų | 192 | 133.2 Ų | 133.2 | 89% | 0.889 | 80% | 0.804 | S | S | * | * | trans | -63.5 | 126.6 | 161.3 | -85 | -88 | 0 | 0 | 0 | 108.7 | ||||
| 379 | D | 30.1 | Very low | 40.8 | Very low | 151 Ų | 151 | 134.3 Ų | 134.3 | 81% | 0.807 | 80% | 0.803 | S | S | * | * | trans | -147.5 | 123.1 | 148.7 | -139.1 | -15.9 | 0 | 0 | 0 | 112.3 | ||||
| 380 | T | 42.7 | Very low | 41.3 | Very low | 137 Ų | 137 | 136 Ų | 136 | 84% | 0.84 | 80% | 0.801 | S | S | * | * | trans | -79.6 | 116.1 | 173 | 33.9 | 0 | 0 | 0 | 0 | 108.8 | ||||
| 381 | G | 36.4 | Very low | 41.9 | Very low | 63 Ų | 63 | 137.8 Ų | 137.8 | 65% | 0.649 | 80% | 0.801 | S | S | * | * | trans | 175.7 | 65.8 | 175.7 | 0 | 0 | 0 | 0 | 0 | 112.9 | N383 | G381-N383 VanDerWaalsContact C-N 3.25Å; G381-N383 PolarHBondContact O-N 3.35Å | ||
| 382 | T | 40.1 | Very low | 41.9 | Very low | 144 Ų | 144 | 137.6 Ų | 137.6 | 88% | 0.883 | 80% | 0.8 | S | S | * | * | trans | -71.4 | 82.3 | 169.4 | 48.1 | 0 | 0 | 0 | 0 | 110.4 | ||||
| 383 | N | 38.4 | Very low | 42 | Very low | 148 Ų | 148 | 139.4 Ų | 139.4 | 79% | 0.791 | 80% | 0.796 | S | S | * | * | trans | -114.9 | 78.1 | 162 | -54.6 | -1.3 | 0 | 0 | 0 | 107 | G381 S385 | G381-N383 VanDerWaalsContact C-N 3.25Å; G381-N383 PolarHBondContact O-N 3.35Å; N383-S385 PolarHBondContact O-N 2.85Å | ||
| 384 | S | 44.5 | Very low | 41.7 | Very low | 126 Ų | 126 | 142.3 Ų | 142.3 | 88% | 0.881 | 83% | 0.825 | S | S | * | * | trans | -60.8 | 104.2 | 174.8 | 170.5 | 0 | 0 | 0 | 0 | 110.5 | ||||
| 385 | S | 46.8 | Very low | 42.2 | Very low | 108 Ų | 108 | 141.1 Ų | 141.1 | 76% | 0.755 | 83% | 0.83 | S | S | * | * | trans | -125.8 | 105.1 | 157.5 | 170.8 | 0 | 0 | 0 | 0 | 107.4 | N383 A387 | N383-S385 PolarHBondContact O-N 2.85Å; S385-A387 PolarHBondContact O-N 3.17Å; S385-A387 VanDerWaalsContact O-N 3.14Å | ||
| 386 | G | 52.7 | Low | 42.8 | Very low | 81 Ų | 81 | 139.9 Ų | 139.9 | 84% | 0.835 | 83% | 0.833 | S | S | * | * | trans | -67.4 | 106.4 | 177.6 | 0 | 0 | 0 | 0 | 0 | 111.4 | ||||
| 387 | A | 46.5 | Very low | 43.1 | Very low | 72 Ų | 72 | 140.1 Ų | 140.1 | 60% | 0.595 | 83% | 0.833 | S | S | * | * | trans | -152.6 | 120.2 | 159 | 0 | 0 | 0 | 0 | 0 | 108.8 | S385 L389 | S385-A387 PolarHBondContact O-N 3.17Å; S385-A387 VanDerWaalsContact O-N 3.14Å; A387-L389 PolarHBondContact O-N 3.32Å | ||
| 388 | P | 50.2 | Low | 43.5 | Very low | 127 Ų | 127 | 140.9 Ų | 140.9 | 83% | 0.825 | 84% | 0.838 | S | S | * | * | trans | -76.9 | 111.6 | 171.9 | 29.4 | -29.3 | 0 | 0 | 0 | 109.1 | L390 | P388-L390 PolarHBondContact O-N 3.31Š| ||
| 389 | L | 45.9 | Very low | 44 | Very low | 165 Ų | 165 | 137.8 Ų | 137.8 | 86% | 0.864 | 83% | 0.834 | S | S | * | * | trans | -75.3 | 111.5 | 169 | -70.1 | 177.2 | 0 | 0 | 0 | 108.8 | A387 I391 | A387-L389 PolarHBondContact O-N 3.32Å; L389-I391 PolarHBondContact O-N 3.33Å | ||
| 390 | L | 54.1 | Low | 44.9 | Very low | 161 Ų | 161 | 136.9 Ų | 136.9 | 84% | 0.843 | 84% | 0.836 | S | S | * | * | trans | -61.2 | 120.6 | 167 | -68.1 | 169.5 | 0 | 0 | 0 | 108.7 | P388 L392 | P388-L390 PolarHBondContact O-N 3.31Å; L390-L392 PolarHBondContact O-N 3.32Å; L390-L392 VanDerWaalsContact O-N 3.17Å | ||
| 391 | I | 52.6 | Low | 45.1 | Very low | 150 Ų | 150 | 136.9 Ų | 136.9 | 77% | 0.769 | 84% | 0.836 | S | S | * | * | trans | -72.5 | 104.5 | 167.3 | -61 | 173.2 | 0 | 0 | 0 | 106.7 | L389 Y393 | L389-I391 PolarHBondContact O-N 3.33Å; I391-Y393 HydrophobicContact CG2-CD2 4.43Å; I391-Y393 PolarHBondContact O-N 3.17Å | ||
| 392 | L | 45.1 | Very low | 45.8 | Very low | 159 Ų | 159 | 142.5 Ų | 142.5 | 83% | 0.832 | 85% | 0.85 | S | S | * | * | trans | -69.4 | 111.5 | 168.8 | -101.6 | 151.3 | 0 | 0 | 0 | 108.8 | L390 | L390-L392 PolarHBondContact O-N 3.32Å; L390-L392 VanDerWaalsContact O-N 3.17Å | ||
| 393 | Y | 40.7 | Very low | 46.2 | Very low | 214 Ų | 214 | 142.4 Ų | 142.4 | 84% | 0.839 | 85% | 0.847 | S | S | * | * | trans | -84.7 | 108.5 | 152.7 | -94.3 | -92.7 | 0 | 0 | 0 | 107.6 | I391 | I391-Y393 HydrophobicContact CG2-CD2 4.43Å; I391-Y393 PolarHBondContact O-N 3.17Å | ||
| 394 | C | 37.2 | Very low | 46.9 | Very low | 198 Ų | 198 | 141.9 Ų | 141.9 | 100% | 1.338 | 85% | 0.852 | S | S | * | * | trans | 169.7 | 0 | 141.1 | -92.9 | 0 | 0 | 0 | 0 | 109.6 |
Retrieved 394 of 394 residues in 243.4 ms
(Link to these results)