| 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 | 43.8 | Very low | 41 | Very low | 239 Ų | 239 | 171.3 Ų | 171.3 | 100% | 1.177 | 84% | 0.844 | S | S | * | * | 0 | 150.5 | 0 | -79.2 | -171.5 | 170.3 | 0 | 0 | 107.8 | |||||
| 2 | L | 43.1 | Very low | 40.4 | Very low | 170 Ų | 170 | 164.5 Ų | 164.5 | 89% | 0.89 | 84% | 0.835 | S | S | * | * | trans | 64.3 | 117.7 | -153.8 | -52.3 | 164.9 | 0 | 0 | 0 | 109.1 | ||||
| 3 | Q | 34.9 | Very low | 39.9 | Very low | 191 Ų | 191 | 161.2 Ų | 161.2 | 89% | 0.893 | 84% | 0.837 | S | S | * | * | -161.3 | 158.4 | 78.3 | -111.5 | 166 | -25.8 | 0 | 0 | 112.4 | |||||
| 4 | Q | 42.2 | Very low | 39.5 | Very low | 176 Ų | 176 | 160.3 Ų | 160.3 | 82% | 0.822 | 83% | 0.833 | S | S | * | * | trans | -78.5 | 160.6 | 153 | -78.5 | -136.8 | 10.3 | 0 | 0 | 108.6 | ||||
| 5 | P | 53.9 | Low | 39.4 | Very low | 100 Ų | 100 | 159.9 Ų | 159.9 | 65% | 0.649 | 83% | 0.826 | S | S | * | * | cis | -155.7 | -160.8 | 48.8 | 45.7 | -23.3 | 0 | 0 | 0 | 117.3 | ||||
| 6 | E | 38 | Very low | 38.9 | Very low | 153 Ų | 153 | 159.9 Ų | 159.9 | 72% | 0.715 | 82% | 0.818 | S | S | * | * | trans | 71.4 | 125.8 | 153.4 | -74.2 | 179.9 | 161.2 | 0 | 0 | 121.8 | I8 | E6-I8 HydrophobicContact CB-CG1 4.49Š| ||
| 7 | L | 47.1 | Very low | 38.4 | Very low | 170 Ų | 170 | 156.9 Ų | 156.9 | 89% | 0.89 | 82% | 0.815 | S | S | * | * | trans | -137.5 | 98.4 | 148.3 | -65.7 | 173.6 | 0 | 0 | 0 | 103.9 | ||||
| 8 | I | 39.5 | Very low | 37.9 | Very low | 132 Ų | 132 | 153.2 Ų | 153.2 | 68% | 0.677 | 80% | 0.804 | S | S | * | * | 54.4 | 104.6 | 70.8 | -52.7 | -179.9 | 0 | 0 | 0 | 111.1 | E6 | E6-I8 HydrophobicContact CB-CG1 4.49Š| |||
| 9 | F | 36.2 | Very low | 37.6 | Very low | 218 Ų | 218 | 151.1 Ų | 151.1 | 96% | 0.956 | 80% | 0.804 | S | S | * | * | trans | -125.5 | 118 | 164.6 | -134.1 | -83.8 | 0 | 0 | 0 | 105.3 | ||||
| 10 | D | 35.6 | Very low | 37.6 | Very low | 146 Ų | 146 | 152.8 Ų | 152.8 | 78% | 0.781 | 81% | 0.807 | S | S | * | * | trans | -135.4 | 168.2 | -173.9 | -148.2 | -67.1 | 0 | 0 | 0 | 110.8 | ||||
| 11 | F | 36.2 | Very low | 37.5 | Very low | 189 Ų | 189 | 154.4 Ų | 154.4 | 83% | 0.829 | 81% | 0.812 | S | S | * | * | trans | -139.4 | 117.1 | -147.2 | 166.3 | -88.6 | 0 | 0 | 0 | 112.2 | ||||
| 12 | A | 34.3 | Very low | 36.9 | Very low | 90 Ų | 90 | 146.3 Ų | 146.3 | 74% | 0.744 | 79% | 0.79 | S | S | * | * | trans | -169.6 | 150.4 | 171.4 | 0 | 0 | 0 | 0 | 0 | 109.5 | ||||
| 13 | S | 33.7 | Very low | 36.4 | Very low | 122 Ų | 122 | 145.4 Ų | 145.4 | 85% | 0.853 | 78% | 0.783 | S | S | * | * | cis | -158.9 | 174.1 | -10.9 | -106.1 | 0 | 0 | 0 | 0 | 110.3 | ||||
| 14 | D | 34.1 | Very low | 36.5 | Very low | 148 Ų | 148 | 145.9 Ų | 145.9 | 79% | 0.791 | 78% | 0.783 | S | S | * | * | trans | -96.1 | -176 | -164.8 | -155.8 | -10.9 | 0 | 0 | 0 | 114.8 | ||||
| 15 | H | 38.9 | Very low | 36.1 | Very low | 155 Ų | 155 | 142.1 Ų | 142.1 | 72% | 0.718 | 78% | 0.775 | S | S | * | * | trans | 99.8 | 89 | 157.5 | -99.9 | -102.7 | 0 | 0 | 0 | 121.7 | ||||
| 16 | F | 31.5 | Very low | 35.3 | Very low | 159 Ų | 159 | 144.7 Ų | 144.7 | 70% | 0.697 | 78% | 0.784 | S | S | * | * | 75.2 | 114.6 | 110.3 | -162.5 | -87.7 | 0 | 0 | 0 | 121.8 | |||||
| 17 | S | 29.9 | Very low | 35.6 | Very low | 110 Ų | 110 | 147.2 Ų | 147.2 | 77% | 0.769 | 79% | 0.788 | S | S | * | * | -165.5 | 159 | 112.7 | -159.5 | 0 | 0 | 0 | 0 | 112.8 | |||||
| 18 | S | 29.1 | Very low | 35.7 | Very low | 89 Ų | 89 | 145.1 Ų | 145.1 | 62% | 0.622 | 79% | 0.785 | S | S | * | * | trans | -88.8 | 150.9 | -162.9 | -52.1 | 0 | 0 | 0 | 0 | 116.4 | ||||
| 19 | S | 33 | Very low | 35.7 | Very low | 114 Ų | 114 | 143 Ų | 143 | 80% | 0.797 | 79% | 0.787 | S | S | * | * | trans | -167.8 | 142.8 | 134 | -88.6 | 0 | 0 | 0 | 0 | 115.1 | ||||
| 20 | Q | 36.9 | Very low | 35.8 | Very low | 184 Ų | 184 | 139 Ų | 139 | 86% | 0.86 | 78% | 0.78 | S | S | * | * | trans | 66.1 | 104.9 | 158 | -67.4 | -173.1 | 29.7 | 0 | 0 | 121.8 | ||||
| 21 | M | 34.8 | Very low | 36 | Very low | 187 Ų | 187 | 138 Ų | 138 | 92% | 0.921 | 78% | 0.779 | S | S | * | * | 77.6 | 119.8 | 111.8 | -142.5 | 75.7 | 156.3 | 0 | 0 | 121 | |||||
| 22 | G | 32.4 | Very low | 36.6 | Very low | 69 Ų | 69 | 135.7 Ų | 135.7 | 71% | 0.711 | 78% | 0.78 | S | S | * | * | trans | 96.4 | 87.4 | 139.2 | 0 | 0 | 0 | 0 | 0 | 118.7 | ||||
| 23 | M | 32.6 | Very low | 37.7 | Very low | 151 Ų | 151 | 139.6 Ų | 139.6 | 74% | 0.744 | 78% | 0.783 | S | S | * | * | trans | -68.2 | 161.3 | 150.1 | -62.2 | -90.4 | 73.1 | 0 | 0 | 108.9 | ||||
| 24 | F | 36.3 | Very low | 38.1 | Very low | 202 Ų | 202 | 142.5 Ų | 142.5 | 89% | 0.886 | 78% | 0.783 | S | S | * | * | cis | -142.9 | 158.1 | 32 | -67.9 | -96.1 | 0 | 0 | 0 | 113.3 | ||||
| 25 | S | 34.9 | Very low | 38.5 | Very low | 96 Ų | 96 | 140.5 Ų | 140.5 | 67% | 0.671 | 78% | 0.776 | S | S | * | * | trans | -117.9 | 136.1 | 168.6 | 177.8 | 0 | 0 | 0 | 0 | 108.2 | ||||
| 26 | D | 37.3 | Very low | 38.9 | Very low | 154 Ų | 154 | 138.8 Ų | 138.8 | 82% | 0.824 | 78% | 0.779 | S | S | * | * | trans | -114.5 | 104.8 | 179.2 | -165.6 | 7.8 | 0 | 0 | 0 | 109.9 | ||||
| 27 | Y | 42.5 | Very low | 39.3 | Very low | 206 Ų | 206 | 138.9 Ų | 138.9 | 81% | 0.808 | 78% | 0.781 | S | S | * | * | trans | -151.8 | 112.4 | 179.4 | -96.4 | -82.7 | 0 | 0 | 0 | 108.8 | ||||
| 28 | P | 49.7 | Very low | 39.5 | Very low | 126 Ų | 126 | 142.9 Ų | 142.9 | 82% | 0.818 | 79% | 0.787 | S | S | * | * | trans | -80.3 | 141.9 | 174.3 | 31.6 | -33.5 | 0 | 0 | 0 | 111.5 | ||||
| 29 | A | 39.8 | Very low | 39.8 | Very low | 88 Ų | 88 | 147.3 Ų | 147.3 | 73% | 0.727 | 80% | 0.798 | S | S | * | * | trans | -147.2 | 160.8 | 174.5 | 0 | 0 | 0 | 0 | 0 | 110.3 | ||||
| 30 | V | 38.3 | Very low | 40.5 | Very low | 135 Ų | 135 | 149.4 Ų | 149.4 | 82% | 0.818 | 80% | 0.799 | S | S | * | * | trans | 72.1 | 135.1 | -178 | -168.7 | 0 | 0 | 0 | 0 | 109.9 | ||||
| 31 | V | 39.2 | Very low | 40.8 | Very low | 124 Ų | 124 | 147.8 Ų | 147.8 | 75% | 0.752 | 80% | 0.796 | S | S | * | * | cis | -132.4 | 144.5 | 47.9 | -158.7 | 0 | 0 | 0 | 0 | 114 | ||||
| 32 | V | 49 | Very low | 40.7 | Very low | 140 Ų | 140 | 145.1 Ų | 145.1 | 85% | 0.848 | 79% | 0.79 | S | S | * | * | trans | -110.2 | 120.5 | 155.8 | 174.4 | 0 | 0 | 0 | 0 | 106.2 | ||||
| 33 | E | 58.3 | Low | 40.9 | Very low | 173 Ų | 173 | 152 Ų | 152 | 81% | 0.808 | 80% | 0.796 | S | S | * | * | trans | -88.2 | 127.7 | -178.4 | -163.6 | 171.9 | 124 | 0 | 0 | 110.4 | ||||
| 34 | E | 40.7 | Very low | 41.1 | Very low | 182 Ų | 182 | 151.1 Ų | 151.1 | 85% | 0.85 | 80% | 0.8 | S | S | * | * | trans | -89.8 | 126.4 | -176.8 | -173.2 | 171.5 | -150.5 | 0 | 0 | 110.2 | P36 | E34-P36 WeakPolarHBondContact O-CD 3.33Š| ||
| 35 | V | 44.2 | Very low | 41.1 | Very low | 106 Ų | 106 | 144.9 Ų | 144.9 | 64% | 0.642 | 79% | 0.792 | S | S | * | * | trans | -96.6 | 114.6 | -170.9 | 179.2 | 0 | 0 | 0 | 0 | 111.5 | ||||
| 36 | P | 47.6 | Very low | 41.5 | Very low | 119 Ų | 119 | 148.8 Ų | 148.8 | 77% | 0.773 | 81% | 0.805 | S | S | * | * | trans | -75 | 135.8 | 171.1 | -12.4 | 29.9 | 0 | 0 | 0 | 110.9 | E34 | E34-P36 WeakPolarHBondContact O-CD 3.33Š| ||
| 37 | H | 38.1 | Very low | 41.4 | Very low | 162 Ų | 162 | 150.4 Ų | 150.4 | 75% | 0.75 | 81% | 0.809 | S | S | * | * | trans | -112.5 | 108.9 | 169 | -76.8 | 2.2 | 0 | 0 | 0 | 110.5 | ||||
| 38 | Q | 34.3 | Very low | 41 | Very low | 193 Ų | 193 | 143.4 Ų | 143.4 | 90% | 0.902 | 80% | 0.8 | S | S | * | * | trans | -172.9 | 97.4 | 150.5 | -110.2 | 157.3 | 89.2 | 0 | 0 | 112.8 | ||||
| 39 | H | 36.6 | Very low | 40.3 | Very low | 183 Ų | 183 | 147 Ų | 147 | 85% | 0.847 | 81% | 0.806 | S | S | * | * | -155.7 | 138.3 | 128.3 | -133.3 | -89.2 | 0 | 0 | 0 | 111.9 | |||||
| 40 | L | 47.1 | Very low | 39.9 | Very low | 158 Ų | 158 | 151.6 Ų | 151.6 | 83% | 0.827 | 81% | 0.812 | S | S | * | * | trans | -85.6 | 147.4 | 165 | -72 | 161.3 | 0 | 0 | 0 | 109.2 | ||||
| 41 | L | 44 | Very low | 39.7 | Very low | 150 Ų | 150 | 150.6 Ų | 150.6 | 79% | 0.785 | 81% | 0.812 | S | S | * | * | trans | 172.9 | 100.8 | 149.9 | -93.5 | 166.6 | 0 | 0 | 0 | 105.7 | ||||
| 42 | T | 32.9 | Very low | 39.2 | Very low | 131 Ų | 131 | 152.5 Ų | 152.5 | 80% | 0.804 | 81% | 0.812 | S | S | * | * | 98.1 | 149.4 | 80.5 | -69.7 | 0 | 0 | 0 | 0 | 112.1 | |||||
| 43 | Y | 36 | Very low | 38.5 | Very low | 213 Ų | 213 | 152.6 Ų | 152.6 | 84% | 0.835 | 81% | 0.813 | S | S | * | * | trans | -76.9 | 179.2 | -163.3 | -164 | -103.7 | 0 | 0 | 0 | 114.7 | ||||
| 44 | T | 37.4 | Very low | 37.2 | Very low | 133 Ų | 133 | 151.8 Ų | 151.8 | 82% | 0.816 | 81% | 0.809 | S | S | * | * | trans | 79.5 | 152.5 | -175.7 | 76.1 | 0 | 0 | 0 | 0 | 114.8 | ||||
| 45 | G | 34.5 | Very low | 36.7 | Very low | 71 Ų | 71 | 147.9 Ų | 147.9 | 73% | 0.732 | 79% | 0.794 | S | S | * | * | cis | -173 | 167.9 | -1.1 | 0 | 0 | 0 | 0 | 0 | 112.4 | M47 | G45-M47 PolarHBondContact O-N 3.5Š| ||
| 46 | L | 44.1 | Very low | 36.4 | Very low | 178 Ų | 178 | 152 Ų | 152 | 93% | 0.932 | 81% | 0.807 | S | S | * | * | trans | -61.7 | 117 | -175.9 | -73.6 | 159.7 | 0 | 0 | 0 | 114.6 | ||||
| 47 | M | 34.3 | Very low | 35.7 | Very low | 187 Ų | 187 | 153.9 Ų | 153.9 | 92% | 0.921 | 80% | 0.804 | S | S | * | * | trans | -156.2 | 155.1 | 138.9 | -69.7 | -151.7 | 83.7 | 0 | 0 | 106.4 | G45 | G45-M47 PolarHBondContact O-N 3.5Š| ||
| 48 | G | 34.9 | Very low | 35.6 | Very low | 60 Ų | 60 | 155.9 Ų | 155.9 | 62% | 0.619 | 81% | 0.814 | S | S | * | * | cis | 128 | 99.9 | 12.5 | 0 | 0 | 0 | 0 | 0 | 107.6 | ||||
| 49 | E | 35.2 | Very low | 35.5 | Very low | 201 Ų | 201 | 153.8 Ų | 153.8 | 94% | 0.939 | 81% | 0.809 | S | S | * | * | trans | -65.9 | 140.5 | -173 | -69.7 | -165.9 | 104.2 | 0 | 0 | 112.4 | ||||
| 50 | Q | 32.2 | Very low | 35.4 | Very low | 184 Ų | 184 | 153 Ų | 153 | 86% | 0.86 | 81% | 0.809 | S | S | * | * | trans | -135.1 | 104.8 | 174.3 | -175.3 | 171.9 | 60.2 | 0 | 0 | 109.2 | ||||
| 51 | S | 33.6 | Very low | 34.6 | Very low | 115 Ų | 115 | 154 Ų | 154 | 80% | 0.804 | 81% | 0.807 | S | S | * | * | trans | -103.6 | 127.5 | 164.4 | -67.5 | 0 | 0 | 0 | 0 | 108.8 | ||||
| 52 | Q | 29.1 | Very low | 34.1 | Very low | 164 Ų | 164 | 153 Ų | 153 | 77% | 0.766 | 81% | 0.807 | S | S | * | * | trans | -76.7 | 137.8 | 171.3 | -69.2 | 174.5 | -54.9 | 0 | 0 | 110.4 | ||||
| 53 | T | 32.6 | Very low | 34.3 | Very low | 141 Ų | 141 | 154.9 Ų | 154.9 | 87% | 0.865 | 81% | 0.807 | S | S | * | * | trans | -155.8 | 105.7 | 140.1 | 12 | 0 | 0 | 0 | 0 | 107.9 | ||||
| 54 | E | 31.1 | Very low | 34.9 | Very low | 156 Ų | 156 | 149 Ų | 149 | 73% | 0.729 | 80% | 0.795 | S | S | * | * | trans | -71.3 | 158.3 | 157 | -62.9 | 151.1 | 148.9 | 0 | 0 | 107.3 | ||||
| 55 | D | 31.4 | Very low | 34.6 | Very low | 100 Ų | 100 | 148.2 Ų | 148.2 | 54% | 0.535 | 79% | 0.793 | S | S | . | * | cis | -154.8 | 167.8 | 3.1 | -140 | -27 | 0 | 0 | 0 | 110.8 | H57 | D55-H57 VanDerWaalsContact CG-CE1 3.48Å; D55-H57 IonicContact OD1-CE1 3.19Å; D55-H57 PolarHBondContact OD1-CE1 3.38Å; D55-H57 IonicContact OD1-ND1 2.93Å; D55-H57 PolarHBondContact OD1-ND1 2.82Å; D55-H57 IonicContact OD1-NE2 3.37Å; D55-H57 IonicContact OD2-CE1 3.62Å; D55-H57 PolarHBondContact OD2-CE1 3.03Å; D55-H57 IonicContact OD2-NE2 2.65Å | ||
| 56 | H | 36.9 | Very low | 34.6 | Very low | 194 Ų | 194 | 153.8 Ų | 153.8 | 90% | 0.898 | 80% | 0.8 | S | S | * | * | trans | 171.5 | 108.8 | 145.2 | -96.7 | -61.5 | 0 | 0 | 0 | 109.7 | ||||
| 57 | H | 33.7 | Very low | 34.1 | Very low | 157 Ų | 157 | 150.7 Ų | 150.7 | 73% | 0.727 | 79% | 0.793 | S | S | * | * | trans | -90.1 | 142.4 | -177.9 | -32.1 | -59.6 | 0 | 0 | 0 | 113.2 | D55 | D55-H57 VanDerWaalsContact CG-CE1 3.48Å; D55-H57 IonicContact OD1-CE1 3.19Å; D55-H57 PolarHBondContact OD1-CE1 3.38Å; D55-H57 IonicContact OD1-ND1 2.93Å; D55-H57 PolarHBondContact OD1-ND1 2.82Å; D55-H57 IonicContact OD1-NE2 3.37Å; D55-H57 IonicContact OD2-CE1 3.62Å; D55-H57 PolarHBondContact OD2-CE1 3.03Å; D55-H57 IonicContact OD2-NE2 2.65Å | ||
| 58 | E | 36.3 | Very low | 34.1 | Very low | 205 Ų | 205 | 145.2 Ų | 145.2 | 96% | 0.958 | 79% | 0.785 | S | S | * | * | trans | -140.1 | 153.3 | 138.2 | -140 | 176.1 | 111.1 | 0 | 0 | 109.2 | ||||
| 59 | L | 31.4 | Very low | 34.1 | Very low | 149 Ų | 149 | 152.1 Ų | 152.1 | 78% | 0.78 | 80% | 0.801 | S | S | * | * | trans | -137.7 | 125.1 | -150.8 | 175.9 | 158.2 | 0 | 0 | 0 | 112.4 | ||||
| 60 | L | 34.1 | Very low | 34.5 | Very low | 165 Ų | 165 | 151.3 Ų | 151.3 | 86% | 0.864 | 80% | 0.797 | S | S | * | * | trans | -163.2 | 79.4 | 164.6 | -110.1 | 165.5 | 0 | 0 | 0 | 115.9 | ||||
| 61 | K | 31.5 | Very low | 35.2 | Very low | 181 Ų | 181 | 150.2 Ų | 150.2 | 79% | 0.787 | 79% | 0.792 | S | S | * | * | 50.1 | 86.7 | 129.7 | -159.2 | 179.6 | -179.5 | -177.6 | 0 | 122.7 | |||||
| 62 | V | 33.3 | Very low | 35.9 | Very low | 127 Ų | 127 | 150.6 Ų | 150.6 | 77% | 0.77 | 79% | 0.789 | S | S | * | * | 51 | 110.8 | 110.2 | 178.7 | 0 | 0 | 0 | 0 | 121.5 | |||||
| 63 | E | 36.2 | Very low | 36.5 | Very low | 172 Ų | 172 | 150.4 Ų | 150.4 | 80% | 0.804 | 79% | 0.791 | S | S | * | * | trans | 54.7 | 167.8 | 130.8 | -66.1 | -84.2 | 92.5 | 0 | 0 | 122.5 | ||||
| 64 | P | 49.3 | Very low | 37.6 | Very low | 90 Ų | 90 | 152 Ų | 152 | 58% | 0.584 | 79% | 0.788 | S | S | * | * | cis | -143.7 | -169.2 | -41.6 | 41.3 | -23.5 | 0 | 0 | 0 | 115.8 | ||||
| 65 | C | 30.8 | Very low | 38.5 | Very low | 116 Ų | 116 | 150.7 Ų | 150.7 | 78% | 0.784 | 79% | 0.791 | S | S | * | * | trans | 78.2 | 126.8 | 150.4 | -71.1 | 0 | 0 | 0 | 0 | 122.9 | ||||
| 66 | E | 34.3 | Very low | 39.2 | Very low | 188 Ų | 188 | 154.5 Ų | 154.5 | 88% | 0.879 | 81% | 0.81 | S | S | * | * | -166 | 140.4 | 116.9 | -96.1 | 180 | 122.7 | 0 | 0 | 106.6 | |||||
| 67 | S | 33.5 | Very low | 40 | Very low | 112 Ų | 112 | 151.4 Ų | 151.4 | 78% | 0.783 | 81% | 0.805 | S | S | * | * | 67.6 | 126.6 | 56.9 | -152 | 0 | 0 | 0 | 0 | 113.5 | |||||
| 68 | G | 35.7 | Very low | 40.3 | Very low | 72 Ų | 72 | 148.8 Ų | 148.8 | 74% | 0.742 | 81% | 0.811 | S | S | * | * | cis | 140 | 105.2 | -12 | 0 | 0 | 0 | 0 | 0 | 113.6 | ||||
| 69 | E | 34.4 | Very low | 40.6 | Very low | 206 Ų | 206 | 144.2 Ų | 144.2 | 96% | 0.963 | 81% | 0.807 | S | S | * | * | trans | -157.7 | -172.2 | 169.1 | 59.8 | -173.5 | 168.4 | 0 | 0 | 112.9 | ||||
| 70 | E | 43.7 | Very low | 41.5 | Very low | 183 Ų | 183 | 144.8 Ų | 144.8 | 86% | 0.855 | 81% | 0.812 | S | S | * | * | trans | -133.4 | 169.8 | -142.4 | -165.2 | 176.4 | 148.6 | 0 | 0 | 115.8 | ||||
| 71 | E | 46.4 | Very low | 42.4 | Very low | 162 Ų | 162 | 142.4 Ų | 142.4 | 76% | 0.757 | 81% | 0.809 | S | S | * | * | trans | 92 | 161.3 | 148.1 | -127.2 | -171.8 | 165.8 | 0 | 0 | 121.7 | ||||
| 72 | T | 47.8 | Very low | 43.4 | Very low | 122 Ų | 122 | 141.6 Ų | 141.6 | 75% | 0.748 | 81% | 0.812 | S | S | * | * | trans | 80.8 | 69.3 | 170 | 65.6 | 0 | 0 | 0 | 0 | 121.1 | ||||
| 73 | M | 43.5 | Very low | 44.2 | Very low | 161 Ų | 161 | 142.6 Ų | 142.6 | 79% | 0.793 | 81% | 0.812 | S | S | * | * | 38.3 | 119.8 | 123.6 | -56.9 | 179.4 | 73.8 | 0 | 0 | 122 | |||||
| 74 | E | 53.8 | Low | 45 | Very low | 174 Ų | 174 | 141.6 Ų | 141.6 | 81% | 0.813 | 81% | 0.813 | S | S | * | * | trans | 45.3 | 113.4 | 134.6 | -56.7 | -173.3 | 159 | 0 | 0 | 121.8 | ||||
| 75 | T | 50.1 | Low | 45.1 | Very low | 128 Ų | 128 | 144.3 Ų | 144.3 | 79% | 0.785 | 82% | 0.819 | S | S | * | * | trans | -152.6 | 119.6 | 141.6 | -74 | 0 | 0 | 0 | 0 | 110.7 | ||||
| 76 | L | 46.4 | Very low | 45.6 | Very low | 180 Ų | 180 | 145.9 Ų | 145.9 | 94% | 0.942 | 82% | 0.82 | S | S | * | * | trans | -108.9 | 62.8 | 180 | -74.7 | 173.1 | 0 | 0 | 0 | 112.3 | ||||
| 77 | V | 53.3 | Low | 45.7 | Very low | 130 Ų | 130 | 142.6 Ų | 142.6 | 79% | 0.788 | 82% | 0.816 | S | S | * | * | trans | -144.4 | 105 | 173.8 | -174.2 | 0 | 0 | 0 | 0 | 111.7 | ||||
| 78 | A | 41.4 | Very low | 45.9 | Very low | 102 Ų | 102 | 143.7 Ų | 143.7 | 84% | 0.843 | 82% | 0.818 | S | S | * | * | trans | 165.5 | 87.2 | 150.1 | 0 | 0 | 0 | 0 | 0 | 110.3 | ||||
| 79 | A | 42.9 | Very low | 45.8 | Very low | 108 Ų | 108 | 147.3 Ų | 147.3 | 89% | 0.893 | 82% | 0.82 | S | S | * | * | trans | -130.7 | 17.7 | 178.4 | 0 | 0 | 0 | 0 | 0 | 113.5 | ||||
| 80 | D | 49 | Very low | 45.9 | Very low | 162 Ų | 162 | 143.2 Ų | 143.2 | 87% | 0.866 | 81% | 0.81 | S | S | * | * | S | Bend | trans | -133.2 | 16.4 | -168.3 | -150 | 26.3 | 0 | 0 | 0 | 112.9 | ||
| 81 | S | 54.3 | Low | 45.5 | Very low | 115 Ų | 115 | 143.2 Ų | 143.2 | 80% | 0.804 | 81% | 0.814 | S | S | * | * | trans | -140.8 | 50.5 | -177.4 | -58.6 | 0 | 0 | 0 | 0 | 112.7 | ||||
| 82 | L | 51.4 | Low | 44.8 | Very low | 164 Ų | 164 | 141 Ų | 141 | 86% | 0.859 | 82% | 0.817 | S | S | * | * | S | Bend | trans | -128.1 | 91.6 | 169.1 | -78.6 | 178.6 | 0 | 0 | 0 | 112.2 | ||
| 83 | L | 51.1 | Low | 44.1 | Very low | 148 Ų | 148 | 142.9 Ų | 142.9 | 78% | 0.775 | 82% | 0.821 | S | S | * | * | trans | 61.9 | 76.5 | 146.1 | -51.6 | -179.9 | 0 | 0 | 0 | 116.8 | M85 | L83-M85 PolarHBondContact O-N 3.08Š| ||
| 84 | D | 52.2 | Low | 43.8 | Very low | 151 Ų | 151 | 142.5 Ų | 142.5 | 81% | 0.807 | 82% | 0.818 | S | S | * | * | trans | -54.3 | 119.6 | 131.4 | 172.2 | 34.4 | 0 | 0 | 0 | 109 | ||||
| 85 | M | 51.8 | Low | 42.9 | Very low | 147 Ų | 147 | 141.7 Ų | 141.7 | 72% | 0.724 | 81% | 0.814 | S | S | * | * | trans | -171 | 66.6 | 173.2 | -108.5 | -84.7 | 70.4 | 0 | 0 | 110.3 | L83 | L83-M85 PolarHBondContact O-N 3.08Š| ||
| 86 | D | 41.1 | Very low | 42.1 | Very low | 148 Ų | 148 | 144.1 Ų | 144.1 | 79% | 0.791 | 82% | 0.816 | S | S | * | * | trans | -62.8 | 135.9 | 168.4 | -89.8 | -41.5 | 0 | 0 | 0 | 110.6 | ||||
| 87 | C | 35.8 | Very low | 41.3 | Very low | 119 Ų | 119 | 145.6 Ų | 145.6 | 80% | 0.804 | 81% | 0.811 | S | S | * | * | trans | -84.4 | 145.3 | -166.6 | 54.1 | 0 | 0 | 0 | 0 | 113.8 | D89 | C87-D89 PolarHBondContact O-N 3.15Š| ||
| 88 | V | 36.8 | Very low | 40.3 | Very low | 136 Ų | 136 | 144 Ų | 144 | 82% | 0.824 | 81% | 0.806 | S | S | * | * | trans | -74.9 | 106.7 | 171.2 | 177 | 0 | 0 | 0 | 0 | 109.1 | ||||
| 89 | D | 34.6 | Very low | 39.9 | Very low | 148 Ų | 148 | 148 Ų | 148 | 79% | 0.791 | 81% | 0.807 | S | S | * | * | P | Polyproline II helix | trans | -82.4 | 134.5 | 170.4 | -156.9 | -6.7 | 0 | 0 | 0 | 110.4 | C87 | C87-D89 PolarHBondContact O-N 3.15Š|
| 90 | T | 36 | Very low | 39.4 | Very low | 120 Ų | 120 | 146.7 Ų | 146.7 | 74% | 0.736 | 80% | 0.796 | S | S | * | * | P | Polyproline II helix | trans | -95.7 | 118 | -164.3 | 51.2 | 0 | 0 | 0 | 0 | 112.8 | S92 | T90-S92 PolarHBondContact O-N 3.26Š|
| 91 | L | 36.8 | Very low | 38.8 | Very low | 182 Ų | 182 | 148.3 Ų | 148.3 | 95% | 0.953 | 80% | 0.796 | S | S | * | * | P | Polyproline II helix | trans | -64.9 | 122.6 | -177.5 | -66.7 | 173.2 | 0 | 0 | 0 | 113.9 | ||
| 92 | S | 30.8 | Very low | 38 | Very low | 117 Ų | 117 | 151 Ų | 151 | 82% | 0.818 | 80% | 0.8 | S | S | * | * | trans | -165.5 | 130.5 | 158.3 | -165.6 | 0 | 0 | 0 | 0 | 107.1 | T90 | T90-S92 PolarHBondContact O-N 3.26Š| ||
| 93 | L | 33.4 | Very low | 37.6 | Very low | 160 Ų | 160 | 149.3 Ų | 149.3 | 84% | 0.838 | 80% | 0.799 | S | S | * | * | cis | -155.3 | 119.9 | 4.4 | 161 | 69.7 | 0 | 0 | 0 | 106.9 | ||||
| 94 | E | 37 | Very low | 36.9 | Very low | 153 Ų | 153 | 147.1 Ų | 147.1 | 72% | 0.715 | 80% | 0.796 | S | S | * | * | trans | -160.8 | 146.3 | 168.2 | -169.5 | 54.5 | 123.4 | 0 | 0 | 113.8 | ||||
| 95 | Q | 35 | Very low | 36.5 | Very low | 157 Ų | 157 | 147.9 Ų | 147.9 | 73% | 0.734 | 80% | 0.799 | S | S | * | * | trans | 59 | 115.8 | 163.7 | -79.2 | 151.4 | 45.4 | 0 | 0 | 121 | ||||
| 96 | H | 33.6 | Very low | 35.6 | Very low | 180 Ų | 180 | 145.7 Ų | 145.7 | 83% | 0.833 | 80% | 0.798 | S | S | * | * | trans | -73.7 | 160.4 | 178 | -72.3 | -129.6 | 0 | 0 | 0 | 114.5 | ||||
| 97 | Y | 29.8 | Very low | 35.4 | Very low | 210 Ų | 210 | 145.4 Ų | 145.4 | 82% | 0.824 | 80% | 0.796 | S | S | * | * | trans | 62.8 | 91.1 | 147.7 | -99.9 | -109.9 | 0 | 0 | 0 | 119.2 | ||||
| 98 | S | 32.4 | Very low | 35.4 | Very low | 98 Ų | 98 | 145.5 Ų | 145.5 | 69% | 0.685 | 79% | 0.793 | S | S | * | * | 32.6 | 134.7 | 126.5 | 64.5 | 0 | 0 | 0 | 0 | 121.2 | |||||
| 99 | Q | 32.8 | Very low | 35.4 | Very low | 186 Ų | 186 | 146 Ų | 146 | 87% | 0.869 | 79% | 0.79 | S | S | * | * | -173.5 | 129.4 | 97.9 | -171 | 157.2 | 46.3 | 0 | 0 | 114.5 | |||||
| 100 | A | 32.6 | Very low | 35.6 | Very low | 80 Ų | 80 | 144.8 Ų | 144.8 | 66% | 0.661 | 79% | 0.788 | S | S | * | * | trans | 55.5 | 122.2 | 151.6 | 0 | 0 | 0 | 0 | 0 | 123.8 | ||||
| 101 | F | 36.2 | Very low | 35.8 | Very low | 196 Ų | 196 | 143.3 Ų | 143.3 | 86% | 0.86 | 79% | 0.787 | S | S | * | * | trans | 51.4 | 118.8 | 134.2 | -80 | -92.8 | 0 | 0 | 0 | 122.5 | ||||
| 102 | L | 36.3 | Very low | 36.5 | Very low | 171 Ų | 171 | 140.2 Ų | 140.2 | 90% | 0.895 | 78% | 0.779 | S | S | * | * | trans | -135.7 | 146.3 | 138.3 | -76.7 | 179.1 | 0 | 0 | 0 | 110.4 | ||||
| 103 | P | 44.4 | Very low | 36.7 | Very low | 128 Ų | 128 | 141.2 Ų | 141.2 | 83% | 0.831 | 78% | 0.779 | S | S | * | * | trans | -97.9 | 179.8 | -171.9 | 39.3 | -37.4 | 0 | 0 | 0 | 114.7 | ||||
| 104 | S | 35.1 | Very low | 37.1 | Very low | 102 Ų | 102 | 140.1 Ų | 140.1 | 71% | 0.713 | 78% | 0.78 | S | S | * | * | trans | -115.8 | 142 | -172.5 | 59.7 | 0 | 0 | 0 | 0 | 115.4 | ||||
| 105 | L | 44.3 | Very low | 37 | Very low | 168 Ų | 168 | 141.1 Ų | 141.1 | 88% | 0.88 | 78% | 0.784 | S | S | * | * | trans | 67.4 | 161.3 | 150.4 | -70.7 | 170.6 | 0 | 0 | 0 | 120.8 | ||||
| 106 | S | 32.7 | Very low | 36.8 | Very low | 100 Ų | 100 | 140.1 Ų | 140.1 | 70% | 0.699 | 79% | 0.788 | S | S | * | * | trans | 69.4 | 147.6 | 173.8 | 106.5 | 0 | 0 | 0 | 0 | 116.1 | ||||
| 107 | D | 36.9 | Very low | 36.7 | Very low | 142 Ų | 142 | 137.6 Ų | 137.6 | 76% | 0.759 | 79% | 0.786 | S | S | * | * | cis | -150.3 | -170.6 | 12.9 | -107.4 | -52.6 | 0 | 0 | 0 | 112.6 | ||||
| 108 | V | 37 | Very low | 37 | Very low | 121 Ų | 121 | 134.3 Ų | 134.3 | 73% | 0.733 | 79% | 0.788 | S | S | * | * | trans | 115.4 | 89.6 | 145.5 | -173.9 | 0 | 0 | 0 | 0 | 120 | ||||
| 109 | I | 36.7 | Very low | 36.9 | Very low | 147 Ų | 147 | 135.4 Ų | 135.4 | 75% | 0.754 | 80% | 0.795 | S | S | * | * | 72.1 | 105.7 | 121.9 | -65.7 | 175.6 | 0 | 0 | 0 | 122.6 | |||||
| 110 | T | 38.6 | Very low | 37.2 | Very low | 123 Ų | 123 | 131 Ų | 131 | 76% | 0.755 | 79% | 0.79 | S | S | * | * | 79.3 | 101.7 | 122.6 | -55.1 | 0 | 0 | 0 | 0 | 124.8 | |||||
| 111 | A | 39.3 | Very low | 37.4 | Very low | 88 Ų | 88 | 135.2 Ų | 135.2 | 73% | 0.727 | 80% | 0.796 | S | S | * | * | 69.5 | -173.1 | 124.5 | 0 | 0 | 0 | 0 | 0 | 120.5 | |||||
| 112 | P | 51.8 | Low | 37.3 | Very low | 118 Ų | 118 | 128.9 Ų | 128.9 | 77% | 0.766 | 79% | 0.786 | S | S | * | * | -134.2 | 178.1 | -107.6 | 39.9 | -18.9 | 0 | 0 | 0 | 118.1 | |||||
| 113 | V | 35.9 | Very low | 37.3 | Very low | 137 Ų | 137 | 126.5 Ų | 126.5 | 83% | 0.83 | 78% | 0.778 | S | S | * | * | trans | -18.9 | 133.4 | 169.8 | -179.7 | 0 | 0 | 0 | 0 | 118.2 | ||||
| 114 | T | 40.1 | Very low | 36.8 | Very low | 138 Ų | 138 | 127 Ų | 127 | 85% | 0.847 | 78% | 0.779 | S | S | * | * | trans | -128.8 | 127 | 154.4 | 54.6 | 0 | 0 | 0 | 0 | 112.4 | ||||
| 115 | Q | 35.1 | Very low | 36.6 | Very low | 173 Ų | 173 | 125.4 Ų | 125.4 | 81% | 0.808 | 78% | 0.779 | S | S | * | * | trans | -85.8 | 153.6 | 175.4 | 65.9 | -149.8 | -32 | 0 | 0 | 113 | ||||
| 116 | V | 31.4 | Very low | 36 | Very low | 136 Ų | 136 | 122 Ų | 122 | 82% | 0.824 | 78% | 0.775 | S | S | * | * | trans | -145.9 | 131.4 | 159.3 | -177.8 | 0 | 0 | 0 | 0 | 110.1 | ||||
| 117 | T | 32.3 | Very low | 36 | Very low | 128 Ų | 128 | 124.2 Ų | 124.2 | 79% | 0.785 | 78% | 0.784 | S | S | * | * | trans | -149 | 124 | 178.2 | 31.6 | 0 | 0 | 0 | 0 | 111.9 | ||||
| 118 | V | 34.6 | Very low | 36 | Very low | 141 Ų | 141 | 123.1 Ų | 123.1 | 86% | 0.855 | 78% | 0.778 | S | S | * | * | trans | -170.5 | 153.8 | 158.9 | -105.2 | 0 | 0 | 0 | 0 | 108.5 | ||||
| 119 | S | 31.8 | Very low | 35.8 | Very low | 120 Ų | 120 | 124.7 Ų | 124.7 | 84% | 0.839 | 78% | 0.777 | S | S | * | * | cis | -143.3 | -178.2 | -0.4 | -156.5 | 0 | 0 | 0 | 0 | 111.1 | ||||
| 120 | A | 38.8 | Very low | 35.6 | Very low | 93 Ų | 93 | 121.9 Ų | 121.9 | 77% | 0.769 | 77% | 0.771 | S | S | * | * | trans | -138.2 | -160.6 | -164.3 | 0 | 0 | 0 | 0 | 0 | 115.5 | ||||
| 121 | E | 35.5 | Very low | 35.1 | Very low | 170 Ų | 170 | 124.7 Ų | 124.7 | 79% | 0.794 | 78% | 0.775 | S | S | * | * | trans | 75.9 | 137.8 | -174.1 | -163 | 59.1 | -158.8 | 0 | 0 | 115.2 | V123 | E121-V123 WeakPolarHBondContact OE1-CG2 3.31Š| ||
| 122 | G | 35.7 | Very low | 34.8 | Very low | 63 Ų | 63 | 131.3 Ų | 131.3 | 65% | 0.649 | 78% | 0.782 | S | S | * | * | cis | -146 | -155.7 | -2 | 0 | 0 | 0 | 0 | 0 | 110.6 | ||||
| 123 | V | 34.8 | Very low | 33.8 | Very low | 120 Ų | 120 | 133.7 Ų | 133.7 | 73% | 0.727 | 78% | 0.782 | S | S | * | * | cis | -156.3 | 144.7 | -0.9 | 124.6 | 0 | 0 | 0 | 0 | 106.4 | E121 | E121-V123 WeakPolarHBondContact OE1-CG2 3.31Š| ||
| 124 | V | 34.9 | Very low | 33.5 | Very low | 138 Ų | 138 | 131.6 Ų | 131.6 | 84% | 0.836 | 77% | 0.774 | S | S | * | * | trans | 34.3 | 125.5 | 162.5 | -179.3 | 0 | 0 | 0 | 0 | 118.9 | ||||
| 125 | G | 31.2 | Very low | 32.9 | Very low | 70 Ų | 70 | 132.6 Ų | 132.6 | 72% | 0.722 | 77% | 0.773 | S | S | * | * | cis | 112.8 | 152.3 | 25.8 | 0 | 0 | 0 | 0 | 0 | 110.5 | ||||
| 126 | A | 31.4 | Very low | 32.8 | Very low | 96 Ų | 96 | 133.8 Ų | 133.8 | 79% | 0.793 | 78% | 0.778 | S | S | * | * | cis | -167.1 | -167.5 | -4.3 | 0 | 0 | 0 | 0 | 0 | 109.3 | ||||
| 127 | V | 33.2 | Very low | 33.1 | Very low | 147 Ų | 147 | 136 Ų | 136 | 89% | 0.891 | 78% | 0.777 | S | S | * | * | trans | 70.6 | 150.7 | 169.4 | 158.4 | 0 | 0 | 0 | 0 | 116.8 | ||||
| 128 | D | 36.3 | Very low | 33 | Very low | 119 Ų | 119 | 138.2 Ų | 138.2 | 64% | 0.636 | 78% | 0.778 | S | S | * | * | cis | -165.9 | 169.5 | -36.5 | -174.3 | -148.6 | 0 | 0 | 0 | 108.7 | ||||
| 129 | Q | 32.8 | Very low | 33 | Very low | 153 Ų | 153 | 141.9 Ų | 141.9 | 72% | 0.715 | 78% | 0.777 | S | S | * | * | trans | 61.6 | 109 | 152.8 | -102.1 | 174.1 | 96.4 | 0 | 0 | 122.4 | ||||
| 130 | S | 31.8 | Very low | 33.3 | Very low | 89 Ų | 89 | 142 Ų | 142 | 62% | 0.622 | 78% | 0.775 | S | S | * | * | 69.2 | 130.8 | 118 | 72.7 | 0 | 0 | 0 | 0 | 124.1 | |||||
| 131 | Q | 28.8 | Very low | 33 | Very low | 181 Ų | 181 | 141.7 Ų | 141.7 | 85% | 0.846 | 77% | 0.772 | S | S | * | * | trans | 83.2 | 146.9 | 131.4 | -161.1 | 163.4 | 8.7 | 0 | 0 | 120.2 | ||||
| 132 | W | 32.8 | Very low | 32.9 | Very low | 228 Ų | 228 | 138.2 Ų | 138.2 | 86% | 0.864 | 77% | 0.772 | S | S | * | * | trans | -82.5 | 147.9 | -177.2 | -67.1 | 73.9 | 0 | 0 | 0 | 112.1 | ||||
| 133 | H | 29.9 | Very low | 33 | Very low | 168 Ų | 168 | 143.6 Ų | 143.6 | 78% | 0.778 | 78% | 0.78 | S | S | * | * | -177.4 | 145.5 | 108.2 | -94.7 | -66.8 | 0 | 0 | 0 | 114.2 | |||||
| 134 | S | 29.4 | Very low | 32.9 | Very low | 93 Ų | 93 | 146.4 Ų | 146.4 | 65% | 0.65 | 79% | 0.791 | S | S | * | * | trans | 27.3 | 128.7 | 153.3 | -61.9 | 0 | 0 | 0 | 0 | 123.5 | ||||
| 135 | L | 29.1 | Very low | 33.2 | Very low | 159 Ų | 159 | 147.6 Ų | 147.6 | 83% | 0.832 | 79% | 0.787 | S | S | * | * | trans | 63 | 108.8 | 138.7 | -65.1 | 167.6 | 0 | 0 | 0 | 119.1 | ||||
| 136 | H | 32.9 | Very low | 33.4 | Very low | 198 Ų | 198 | 149.7 Ų | 149.7 | 92% | 0.917 | 79% | 0.791 | S | S | * | * | -147.2 | 166.2 | 116.4 | -122.5 | -94.9 | 0 | 0 | 0 | 111.1 | |||||
| 137 | K | 36.2 | Very low | 33.7 | Very low | 183 Ų | 183 | 156.3 Ų | 156.3 | 80% | 0.796 | 80% | 0.795 | S | S | * | * | trans | -114 | 125.3 | -165.2 | 166.7 | -170.1 | 171.1 | -170.5 | 0 | 110.8 | ||||
| 138 | E | 31.1 | Very low | 34.1 | Very low | 173 Ų | 173 | 158.3 Ų | 158.3 | 81% | 0.808 | 79% | 0.792 | S | S | * | * | trans | -158.7 | 162.9 | 154.2 | -104.2 | -41 | 118.8 | 0 | 0 | 112.3 | ||||
| 139 | R | 35.4 | Very low | 34.3 | Very low | 218 Ų | 218 | 164.2 Ų | 164.2 | 82% | 0.823 | 81% | 0.805 | S | S | * | * | trans | -157.7 | 117.7 | -175.8 | -173.2 | -171.7 | -174 | -166.7 | 3.3 | 115.8 | ||||
| 140 | P | 38 | Very low | 34.9 | Very low | 123 Ų | 123 | 162.5 Ų | 162.5 | 80% | 0.799 | 81% | 0.81 | S | S | * | * | trans | -124.7 | 126 | 132 | 6.1 | 15.5 | 0 | 0 | 0 | 110.4 | ||||
| 141 | A | 32 | Very low | 35.8 | Very low | 87 Ų | 87 | 167.9 Ų | 167.9 | 72% | 0.719 | 82% | 0.822 | S | S | * | * | 86.2 | 78.5 | 64.9 | 0 | 0 | 0 | 0 | 0 | 114.8 | |||||
| 142 | A | 32 | Very low | 36.8 | Very low | 96 Ų | 96 | 168.5 Ų | 168.5 | 79% | 0.793 | 82% | 0.822 | S | S | * | * | trans | -159.6 | 143.6 | 151 | 0 | 0 | 0 | 0 | 0 | 113.7 | ||||
| 143 | Q | 37.8 | Very low | 37.3 | Very low | 176 Ų | 176 | 163.8 Ų | 163.8 | 82% | 0.822 | 82% | 0.821 | S | S | * | * | trans | 52.2 | 60.2 | 143.1 | -150.8 | 166.7 | 11.1 | 0 | 0 | 121 | Q145 | Q143-Q145 PolarHBondContact O-N 2.99Š| ||
| 144 | L | 33.2 | Very low | 38.1 | Very low | 180 Ų | 180 | 167.3 Ų | 167.3 | 94% | 0.942 | 83% | 0.828 | S | S | * | * | trans | -74.4 | 112.7 | 158 | -99.3 | 168 | 0 | 0 | 0 | 111.1 | ||||
| 145 | Q | 41.5 | Very low | 38.7 | Very low | 163 Ų | 163 | 171.9 Ų | 171.9 | 76% | 0.762 | 84% | 0.838 | S | S | * | * | trans | -70.4 | 129.8 | 172.9 | -66.5 | -174.6 | -1.1 | 0 | 0 | 111.3 | Q143 R147 | Q143-Q145 PolarHBondContact O-N 2.99Å; Q145-R147 PolarHBondContact O-N 3.38Å | ||
| 146 | S | 35.6 | Very low | 39.3 | Very low | 114 Ų | 114 | 174.8 Ų | 174.8 | 80% | 0.797 | 84% | 0.838 | S | S | * | * | trans | -71.1 | 99.9 | 179.9 | -174.4 | 0 | 0 | 0 | 0 | 111.7 | K148 | S146-K148 PolarHBondContact O-N 3.44Š| ||
| 147 | R | 38.1 | Very low | 39.9 | Very low | 234 Ų | 234 | 176.7 Ų | 176.7 | 88% | 0.883 | 84% | 0.837 | S | S | * | * | trans | -66.5 | 99.5 | 172.4 | -67.1 | -179.1 | 73.4 | 178.7 | 3.9 | 109.5 | Q145 R149 | Q145-R147 PolarHBondContact O-N 3.38Å; R147-R149 PolarHBondContact O-N 3.14Å; R147-R149 VanDerWaalsContact O-N 3.17Å | ||
| 148 | K | 42 | Very low | 40 | Very low | 190 Ų | 190 | 172.8 Ų | 172.8 | 83% | 0.826 | 84% | 0.839 | S | S | * | * | trans | -51.7 | 118.9 | 176 | -66.1 | 176.8 | -179.6 | 174.6 | 0 | 110 | S146 S150 | S146-K148 PolarHBondContact O-N 3.44Å; K148-S150 PolarHBondContact O-N 2.8Å | ||
| 149 | R | 40.5 | Very low | 40.6 | Very low | 243 Ų | 243 | 171 Ų | 171 | 92% | 0.917 | 83% | 0.831 | S | S | * | * | trans | -69.1 | 92.3 | 174.8 | -78 | 176.5 | 108.4 | 177.6 | 4.6 | 110 | R147 K151 | R147-R149 PolarHBondContact O-N 3.14Å; R147-R149 VanDerWaalsContact O-N 3.17Å; R149-K151 PolarHBondContact O-N 3.18Å | ||
| 150 | S | 43.8 | Very low | 41 | Very low | 117 Ų | 117 | 165 Ų | 165 | 82% | 0.818 | 82% | 0.822 | S | S | * | * | trans | -60 | 102.7 | 170.5 | -57.8 | 0 | 0 | 0 | 0 | 110.4 | K148 K152 | K148-S150 PolarHBondContact O-N 2.8Å; S150-K152 PolarHBondContact O-N 3.12Å | ||
| 151 | K | 52.1 | Low | 41.2 | Very low | 202 Ų | 202 | 165.6 Ų | 165.6 | 88% | 0.878 | 83% | 0.826 | S | S | * | * | P | Polyproline II helix | trans | -70.6 | 118 | 172.1 | -70.2 | -179.9 | 177.4 | 178.2 | 0 | 108.3 | R149 | R149-K151 PolarHBondContact O-N 3.18Š|
| 152 | K | 49.2 | Very low | 42.1 | Very low | 194 Ų | 194 | 164.9 Ų | 164.9 | 84% | 0.843 | 81% | 0.813 | S | S | * | * | P | Polyproline II helix | trans | -54.4 | 137.5 | 170.2 | -68.2 | -174.9 | 176.4 | -174.9 | 0 | 109.3 | S150 R154 | S150-K152 PolarHBondContact O-N 3.12Å; K152-R154 PolarHBondContact O-N 3.44Å |
| 153 | P | 42.7 | Very low | 42.6 | Very low | 129 Ų | 129 | 163.7 Ų | 163.7 | 84% | 0.838 | 80% | 0.797 | S | S | * | * | P | Polyproline II helix | trans | -62.3 | 131.7 | 173.7 | 27.2 | -33.5 | 0 | 0 | 0 | 109 | ||
| 154 | R | 47.6 | Very low | 42.9 | Very low | 242 Ų | 242 | 160.4 Ų | 160.4 | 91% | 0.913 | 79% | 0.785 | S | S | * | * | P | Polyproline II helix | trans | -77.8 | 133 | 170.8 | -82.5 | -169.3 | 165.4 | -168.9 | -5.9 | 109.1 | K152 R156 | K152-R154 PolarHBondContact O-N 3.44Å; R154-R156 PolarHBondContact O-N 3.48Å |
| 155 | H | 41.7 | Very low | 44.1 | Very low | 188 Ų | 188 | 153.4 Ų | 153.4 | 87% | 0.87 | 75% | 0.749 | S | S | * | * | P | Polyproline II helix | trans | -50.9 | 125.1 | 173.4 | -153.7 | -68.6 | 0 | 0 | 0 | 109.2 | R157 | H155-R157 PolarHBondContact O-N 2.96Š|
| 156 | R | 42.6 | Very low | 44.5 | Very low | 221 Ų | 221 | 154 Ų | 154 | 83% | 0.834 | 75% | 0.749 | S | S | * | * | P | Polyproline II helix | trans | -68.2 | 132.5 | 167.6 | -74.6 | -165.9 | 177.9 | -142.7 | 3.8 | 107.6 | R154 | R154-R156 PolarHBondContact O-N 3.48Š|
| 157 | R | 44.8 | Very low | 45.5 | Very low | 237 Ų | 237 | 150.7 Ų | 150.7 | 89% | 0.894 | 72% | 0.723 | S | S | * | * | P | Polyproline II helix | trans | -70 | 141.7 | 163.8 | -160.3 | 175.8 | -168.8 | 111.5 | -0.5 | 106.8 | H155 E159 | H155-R157 PolarHBondContact O-N 2.96Å; R157-E159 PolarHBondContact O-N 3.35Å |
| 158 | A | 37.4 | Very low | 46 | Very low | 102 Ų | 102 | 146.7 Ų | 146.7 | 84% | 0.843 | 71% | 0.712 | S | S | * | * | P | Polyproline II helix | trans | -57.4 | 124.3 | 174.4 | 0 | 0 | 0 | 0 | 0 | 109.1 | ||
| 159 | E | 44.6 | Very low | 46.3 | Very low | 134 Ų | 134 | 145.6 Ų | 145.6 | 63% | 0.626 | 71% | 0.708 | S | S | * | * | P | Polyproline II helix | trans | -84.2 | 125.6 | 176.5 | -170.4 | 161.6 | -170.9 | 0 | 0 | 107.9 | R157 R219 | R157-E159 PolarHBondContact O-N 3.35Å; E159-R219 IonicContact OE1-NH2 3.81Å; E159-R219 PolarHBondContact OE1-NH2 2.84Å |
| 160 | S | 44.6 | Very low | 46.5 | Very low | 93 Ų | 93 | 137.4 Ų | 137.4 | 65% | 0.65 | 68% | 0.682 | S | S | * | * | P | Polyproline II helix | trans | -64.8 | 155.1 | 176.7 | 47 | 0 | 0 | 0 | 0 | 110.7 | T162 | S160-T162 VanDerWaalsContact C-N 3.27Å; S160-T162 PolarHBondContact O-N 3.18Å |
| 161 | P | 41.9 | Very low | 46.8 | Very low | 135 Ų | 135 | 140.6 Ų | 140.6 | 88% | 0.877 | 68% | 0.681 | S | S | * | * | trans | -73.9 | 72.3 | -168.3 | 30 | -36.9 | 0 | 0 | 0 | 113.3 | ||||
| 162 | T | 49.9 | Very low | 46.6 | Very low | 72 Ų | 72 | 140.1 Ų | 140.1 | 44% | 0.442 | 68% | 0.675 | S | S | . | * | trans | -70.2 | 131.4 | 155.6 | 33.3 | 0 | 0 | 0 | 0 | 109.3 | S160 D164 | S160-T162 VanDerWaalsContact C-N 3.27Å; S160-T162 PolarHBondContact O-N 3.18Å; T162-D164 PolarHBondContact O-N 2.92Å | ||
| 163 | P | 44 | Very low | 46.7 | Very low | 71 Ų | 71 | 132.3 Ų | 132.3 | 46% | 0.461 | 64% | 0.643 | S | S | . | * | trans | -61.1 | 136.2 | -178.3 | 25.4 | -34.5 | 0 | 0 | 0 | 110.7 | I165 | P163-I165 PolarHBondContact O-N 3.01Š| ||
| 164 | D | 43.7 | Very low | 46.9 | Very low | 108 Ų | 108 | 135.9 Ų | 135.9 | 58% | 0.578 | 65% | 0.645 | S | S | * | * | trans | -77.5 | 87.9 | -178.1 | -172.6 | 33.2 | 0 | 0 | 0 | 110.7 | T162 K166 K223 | T162-D164 PolarHBondContact O-N 2.92Å; D164-K166 PolarHBondContact O-N 3.39Å; D164-K223 IonicContact OD1-NZ 3.75Å; D164-K223 PolarHBondContact OD1-NZ 2.86Å | ||
| 165 | I | 58.3 | Low | 46.7 | Very low | 33 Ų | 33 | 126.8 Ų | 126.8 | 17% | 0.169 | 63% | 0.626 | C | S | . | * | trans | -64.1 | 104.7 | 178.5 | -57.9 | 167.3 | 0 | 0 | 0 | 109 | P163 V167 V194 Y198 L220 | P163-I165 PolarHBondContact O-N 3.01Å; I165-V167 HydrophobicContact CG2-CG2 3.99Å; I165-V167 PolarHBondContact O-N 3.4Å; I165-V194 HydrophobicContact CD1-CG1 4.42Å; I165-V194 HydrophobicContact CG2-CG1 4.35Å; I165-V194 HydrophobicContact CG2-CG2 3.71Å; I165-Y198 HydrophobicContact CD1-CD2 4.2Å; I165-Y198 HydrophobicContact CD1-CE1 4.48Å; I165-Y198 HydrophobicContact CD1-CE2 3.54Å; I165-L220 HydrophobicContact CB-CD1 4.34Å; I165-L220 HydrophobicContact CD1-CD1 4.41Å; I165-L220 HydrophobicContact CG2-CD1 4.48Å | ||
| 166 | K | 49.5 | Very low | 47.1 | Very low | 176 Ų | 176 | 120.3 Ų | 120.3 | 77% | 0.765 | 61% | 0.61 | S | S | * | * | trans | -88.5 | 79 | 169.9 | -64.6 | 176.5 | -173.7 | 175.7 | 0 | 108.9 | D164 K168 | D164-K166 PolarHBondContact O-N 3.39Å; K166-K168 PolarHBondContact O-N 3.3Å | ||
| 167 | V | 56.8 | Low | 47.8 | Very low | 43 Ų | 43 | 117.3 Ų | 117.3 | 26% | 0.261 | 61% | 0.611 | S | S | . | * | trans | -49.4 | 122.3 | 168.8 | 175.8 | 0 | 0 | 0 | 0 | 107.9 | I165 K169 E187 L220 | I165-V167 HydrophobicContact CG2-CG2 3.99Å; I165-V167 PolarHBondContact O-N 3.4Å; V167-K169 PolarHBondContact O-N 3.03Å; V167-E187 HydrophobicContact CG1-CG 4.48Å; V167-L220 HydrophobicContact CG2-CD2 4.45Å | ||
| 168 | K | 48.8 | Very low | 48.7 | Very low | 151 Ų | 151 | 111 Ų | 111 | 66% | 0.657 | 60% | 0.599 | S | S | * | * | trans | -74.6 | 120.6 | -172.4 | -154.7 | 176.1 | -173.9 | 180 | 0 | 108 | K166 D170 | K166-K168 PolarHBondContact O-N 3.3Å; K168-D170 PolarHBondContact O-N 3.48Å | ||
| 169 | K | 48 | Very low | 51.1 | Low | 167 Ų | 167 | 107.4 Ų | 107.4 | 73% | 0.726 | 57% | 0.566 | S | S | * | * | trans | -72.7 | 76.8 | -176.4 | -171.5 | -166.1 | 174.5 | -174.6 | 0 | 110.6 | V167 N173 | V167-K169 PolarHBondContact O-N 3.03Å; K169-N173 HydrophobicContact CD-CB 4.37Å; K169-N173 WeakPolarHBondContact CE-O 3.09Å; K169-N173 HydrophobicContact CG-CB 3.75Å | ||
| 170 | D | 45.5 | Very low | 53.4 | Low | 71 Ų | 71 | 107.5 Ų | 107.5 | 38% | 0.38 | 56% | 0.561 | S | S | . | * | trans | -82.5 | 171.3 | -172.8 | -123 | -66.8 | 0 | 0 | 0 | 113.4 | K168 Y172 N173 | K168-D170 PolarHBondContact O-N 3.48Å; D170-Y172 PolarHBondContact O-N 3.02Å; D170-N173 PolarHBondContact O-N 3.25Å | ||
| 171 | K | 49.8 | Very low | 55.7 | Low | 184 Ų | 184 | 103.2 Ų | 103.2 | 80% | 0.8 | 53% | 0.531 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -60.8 | -14.3 | -150.4 | -64.2 | 153.9 | -165.3 | 172.2 | 0 | 116.2 | N173 | K171-N173 VanDerWaalsContact C-N 3.35Š|
| 172 | Y | 47.6 | Very low | 58.2 | Low | 192 Ų | 192 | 100.3 Ų | 100.3 | 75% | 0.753 | 50% | 0.502 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -72.6 | -22 | 174.6 | -59.8 | -77.2 | 0 | 0 | 0 | 113.7 | D170 K174 | D170-Y172 PolarHBondContact O-N 3.02Å; Y172-K174 PolarHBondContact O-N 2.73Å |
| 173 | N | 51.1 | Low | 60.3 | Low | 30 Ų | 30 | 99.8 Ų | 99.8 | 16% | 0.16 | 50% | 0.495 | C | S | . | . | T | Hydrogen-bonded Turn | trans | -76.2 | 40.5 | 179.5 | -79.9 | -74.8 | 0 | 0 | 0 | 114.4 | K169 D170 K171 E187 | K169-N173 HydrophobicContact CD-CB 4.37Å; K169-N173 WeakPolarHBondContact CE-O 3.09Å; K169-N173 HydrophobicContact CG-CB 3.75Å; D170-N173 PolarHBondContact O-N 3.25Å; K171-N173 VanDerWaalsContact C-N 3.35Å; N173-E187 PolarHBondContact ND2-OE1 3.32Å |
| 174 | K | 47.8 | Very low | 62.6 | Low | 203 Ų | 203 | 96.6 Ų | 96.6 | 88% | 0.883 | 47% | 0.474 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -85.6 | -13 | 176.5 | -158.1 | 173.2 | -178.8 | -178.4 | 0 | 113.3 | Y172 | Y172-K174 PolarHBondContact O-N 2.73Š|
| 175 | G | 41.6 | Very low | 65 | Low | 51 Ų | 51 | 91.4 Ų | 91.4 | 53% | 0.526 | 45% | 0.446 | S | S | . | . | S | Bend | trans | -109.7 | 124.8 | 166.2 | 0 | 0 | 0 | 0 | 0 | 110.5 | ||
| 176 | G | 51.3 | Low | 66.5 | Low | 52 Ų | 52 | 90.4 Ų | 90.4 | 54% | 0.536 | 44% | 0.441 | S | S | . | . | trans | -76.1 | 149.4 | -170.8 | 0 | 0 | 0 | 0 | 0 | 115.2 | T178 | G176-T178 VanDerWaalsContact C-N 3.25Å; G176-T178 PolarHBondContact O-N 3.45Å | ||
| 177 | N | 57.1 | Low | 68.4 | Low | 158 Ų | 158 | 83.5 Ų | 83.5 | 85% | 0.845 | 41% | 0.412 | S | S | * | . | S | Bend | trans | 69.8 | -7.9 | 152 | -47.7 | -10.5 | 0 | 0 | 0 | 118.2 | ||
| 178 | T | 64.6 | Low | 70 | Confident | 106 Ų | 106 | 81.6 Ų | 81.6 | 65% | 0.65 | 40% | 0.4 | S | S | * | . | trans | -120.3 | 42.9 | -175.7 | 63.9 | 0 | 0 | 0 | 0 | 114.7 | G176 | G176-T178 VanDerWaalsContact C-N 3.25Å; G176-T178 PolarHBondContact O-N 3.45Å | ||
| 179 | L | 86 | Confident | 72 | Confident | 26 Ų | 26 | 74.4 Ų | 74.4 | 14% | 0.136 | 37% | 0.369 | C | S | . | . | trans | -64.9 | 141.5 | 165.3 | -60.4 | -164.2 | 0 | 0 | 0 | 111 | E187 K225 | L179-E187 WeakPolarHBondContact CD1-OE2 3.34Å; L179-K225 PolarHBondContact O-NZ 2.93Å | ||
| 180 | Y | 93 | Very high | 73.7 | Confident | 136 Ų | 136 | 70 Ų | 70 | 53% | 0.533 | 35% | 0.351 | S | S | . | . | trans | -86 | 157 | 167.2 | -65.3 | -73.1 | 0 | 0 | 0 | 110.7 | W182 Q183 F184 W221 | Y180-W182 VanDerWaalsContact C-N 3.28Å; Y180-W182 PolarHBondContact O-N 3Å; Y180-Q183 WeakPolarHBondContact O-CB 3.41Å; Y180-Q183 PolarHBondContact O-N 2.96Å; Y180-Q183 VanDerWaalsContact O-N 3.07Å; Y180-F184 PolarHBondContact O-N 3.25Å; Y180-W221 VanDerWaalsContact C-CH2 3.49Å | ||
| 181 | L | 94.6 | Very high | 75.5 | Confident | 2 Ų | 2 | 68 Ų | 68 | 1% | 0.01 | 34% | 0.34 | C | S | . | . | H | α-helix | trans | -59.3 | -39.8 | -178.4 | 171.8 | 66.3 | 0 | 0 | 0 | 111.7 | Q183 F184 L185 W221 M235 A238 L239 Y242 | L181-Q183 VanDerWaalsContact C-N 3.28Å; L181-Q183 PolarHBondContact O-N 3.45Å; L181-F184 HydrophobicContact CD1-CD1 4.21Å; L181-F184 PolarHBondContact O-N 2.99Å; L181-L185 HydrophobicContact CD1-CD1 3.97Å; L181-L185 HydrophobicContact CD1-CD2 4.42Å; L181-L185 HydrophobicContact CD1-CG 3.96Å; L181-L185 HydrophobicContact CD2-CD1 4.43Å; L181-L185 HydrophobicContact CG-CD1 3.83Å; L181-L185 HydrophobicContact CG-CG 4.27Å; L181-L185 VanDerWaalsContact O-CG 3.27Å; L181-L185 WeakPolarHBondContact O-CG 3.23Å; L181-L185 PolarHBondContact O-N 3.33Å; L181-W221 VanDerWaalsContact CA-CH2 3.48Å; L181-W221 HydrophobicContact CB-CH2 4.05Å; L181-W221 HydrophobicContact CB-CZ2 3.61Å; L181-W221 HydrophobicContact CD1-CD2 3.82Å; L181-W221 HydrophobicContact CD1-CE3 4.37Å; L181-W221 HydrophobicContact CD1-CG 3.93Å; L181-W221 HydrophobicContact CD1-CZ2 4.28Å; L181-W221 VanDerWaalsContact N-CH2 3.32Å; L181-M235 HydrophobicContact CD1-CG 3.75Å; L181-M235 HydrophobicContact CD1-SD 3.8Å; L181-M235 HydrophobicContact CD2-CG 3.5Å; L181-M235 VanDerWaalsContact CD2-CG 3.5Å; L181-M235 HydrophobicContact CD2-SD 4.46Å; L181-M235 HydrophobicContact CG-CG 4.29Å; L181-A238 HydrophobicContact CD2-CB 3.75Å; L181-L239 HydrophobicContact CD2-CD2 3.78Å; L181-L239 HydrophobicContact CD2-CG 3.96Å; L181-L239 HydrophobicContact CG-CD2 4.47Å; L181-Y242 HydrophobicContact CB-CE2 3.94Å; L181-Y242 HydrophobicContact CD2-CE2 4.25Å; L181-Y242 HydrophobicContact CG-CE2 4.27Å; L181-Y242 PolarHBondContact N-OH 3.32Å |
| 182 | W | 94 | Very high | 76.3 | Confident | 74 Ų | 74 | 65.9 Ų | 65.9 | 28% | 0.28 | 33% | 0.327 | S | S | . | . | H | α-helix | trans | -63.2 | -34.2 | 178 | 72.1 | -98.6 | 0 | 0 | 0 | 112.6 | Y180 M186 Y242 I247 F260 | Y180-W182 VanDerWaalsContact C-N 3.28Å; Y180-W182 PolarHBondContact O-N 3Å; W182-M186 WeakPolarHBondContact O-CB 3.48Å; W182-M186 PolarHBondContact O-N 2.97Å; W182-Y242 HydrophobicContact CB-CD2 4.19Å; W182-Y242 HydrophobicContact CB-CE2 3.81Å; W182-Y242 AromaticContact CD1-CE1 3.9Å; W182-Y242 AromaticContact CD1-CZ 3.72Å; W182-Y242 HydrophobicContact CG-CE2 4.48Å; W182-I247 HydrophobicContact CB-CG2 4.03Å; W182-I247 HydrophobicContact CD2-CG2 4.25Å; W182-I247 HydrophobicContact CG-CG2 3.88Å; W182-F260 HydrophobicContact CB-CE1 4.38Å |
| 183 | Q | 92.6 | Very high | 77 | Confident | 62 Ų | 62 | 65.4 Ų | 65.4 | 29% | 0.29 | 33% | 0.331 | S | S | . | . | H | α-helix | trans | -70.2 | -45.2 | 175.9 | -64.5 | 171.9 | -43.1 | 0 | 0 | 110.8 | Y180 L181 L185 M186 E187 | Y180-Q183 WeakPolarHBondContact O-CB 3.41Å; Y180-Q183 PolarHBondContact O-N 2.96Å; Y180-Q183 VanDerWaalsContact O-N 3.07Å; L181-Q183 VanDerWaalsContact C-N 3.28Å; L181-Q183 PolarHBondContact O-N 3.45Å; Q183-L185 VanDerWaalsContact C-N 3.32Å; Q183-L185 PolarHBondContact O-N 2.92Å; Q183-M186 WeakPolarHBondContact O-CB 3.45Å; Q183-M186 PolarHBondContact O-N 2.83Å; Q183-M186 VanDerWaalsContact O-N 3.15Å; Q183-E187 WeakPolarHBondContact O-CB 3.4Å; Q183-E187 PolarHBondContact O-N 2.95Å |
| 184 | F | 93 | Very high | 77.6 | Confident | 3 Ų | 3 | 64.4 Ų | 64.4 | 1% | 0.013 | 33% | 0.326 | C | S | . | . | H | α-helix | trans | -61.5 | -38.4 | 175.6 | 168.2 | -96.7 | 0 | 0 | 0 | 112.4 | Y180 L181 E187 L188 L220 W221 H224 | Y180-F184 PolarHBondContact O-N 3.25Å; L181-F184 HydrophobicContact CD1-CD1 4.21Å; L181-F184 PolarHBondContact O-N 2.99Å; F184-E187 PolarHBondContact O-N 2.67Å; F184-L188 HydrophobicContact CE1-CD2 4.24Å; F184-L188 HydrophobicContact CZ-CD2 4.34Å; F184-L188 VanDerWaalsContact O-CB 3.23Å; F184-L188 WeakPolarHBondContact O-CB 3.19Å; F184-L188 PolarHBondContact O-N 2.89Å; F184-L220 HydrophobicContact CE2-CG 4.44Å; F184-L220 HydrophobicContact CZ-CB 4.07Å; F184-L220 HydrophobicContact CZ-CD2 4.1Å; F184-L220 HydrophobicContact CZ-CG 3.92Å; F184-W221 HydrophobicContact CB-CE3 3.68Å; F184-W221 HydrophobicContact CB-CH2 4.43Å; F184-W221 HydrophobicContact CB-CZ3 3.47Å; F184-W221 VanDerWaalsContact CB-CZ3 3.47Å; F184-W221 HydrophobicContact CD1-CB 4.14Å; F184-W221 HydrophobicContact CD1-CD2 4.16Å; F184-W221 AromaticContact CD1-CE3 3.56Å; F184-W221 HydrophobicContact CD1-CE3 3.56Å; F184-W221 HydrophobicContact CD1-CG 4.44Å; F184-W221 HydrophobicContact CD1-CZ3 4.26Å; F184-W221 AromaticContact CD2-CE3 3.99Å; F184-W221 HydrophobicContact CD2-CE3 3.99Å; F184-W221 HydrophobicContact CD2-CZ3 4.39Å; F184-W221 HydrophobicContact CE1-CB 3.7Å; F184-W221 HydrophobicContact CE1-CE3 4.2Å; F184-W221 HydrophobicContact CE1-CG 4.47Å; F184-W221 HydrophobicContact CG-CD2 4.45Å; F184-W221 AromaticContact CG-CE3 3.44Å; F184-W221 HydrophobicContact CG-CE3 3.44Å; F184-W221 VanDerWaalsContact CG-CE3 3.44Å; F184-W221 AromaticContact CG-CZ3 3.79Å; F184-W221 HydrophobicContact CG-CZ3 3.79Å; F184-W221 HydrophobicContact CZ-CB 4.2Å; F184-H224 HydrophobicContact CD2-CB 4.3Å; F184-H224 HydrophobicContact CE2-CB 4.13Å |
| 185 | L | 93.9 | Very high | 78.3 | Confident | 0 Ų | 0 | 55.8 Ų | 55.8 | 0% | 0 | 29% | 0.291 | C | S | . | . | H | α-helix | trans | -67.3 | -37.2 | 174.2 | -67.8 | 168.3 | 0 | 0 | 0 | 111.7 | L181 Q183 L189 I199 L211 V217 L239 | L181-L185 HydrophobicContact CD1-CD1 3.97Å; L181-L185 HydrophobicContact CD1-CD2 4.42Å; L181-L185 HydrophobicContact CD1-CG 3.96Å; L181-L185 HydrophobicContact CD2-CD1 4.43Å; L181-L185 HydrophobicContact CG-CD1 3.83Å; L181-L185 HydrophobicContact CG-CG 4.27Å; L181-L185 VanDerWaalsContact O-CG 3.27Å; L181-L185 WeakPolarHBondContact O-CG 3.23Å; L181-L185 PolarHBondContact O-N 3.33Å; Q183-L185 VanDerWaalsContact C-N 3.32Å; Q183-L185 PolarHBondContact O-N 2.92Å; L185-L189 WeakPolarHBondContact O-CB 3.39Å; L185-L189 WeakPolarHBondContact O-CD1 3.46Å; L185-L189 WeakPolarHBondContact O-CG 3.43Å; L185-L189 PolarHBondContact O-N 3.06Å; L185-I199 HydrophobicContact CB-CD1 4.41Å; L185-I199 HydrophobicContact CD2-CD1 3.71Å; L185-L211 HydrophobicContact CD2-CD1 4.5Å; L185-V217 HydrophobicContact CD2-CG1 3.73Å; L185-L239 HydrophobicContact CD1-CD2 3.75Å |
| 186 | M | 90.8 | Very high | 80 | Confident | 12 Ų | 12 | 56.4 Ų | 56.4 | 6% | 0.059 | 29% | 0.286 | C | S | . | . | H | α-helix | trans | -66.9 | -39.9 | 174.5 | -160.5 | 74.6 | 85.8 | 0 | 0 | 112.2 | W182 Q183 L189 Q190 W201 F260 L263 M267 | W182-M186 WeakPolarHBondContact O-CB 3.48Å; W182-M186 PolarHBondContact O-N 2.97Å; Q183-M186 WeakPolarHBondContact O-CB 3.45Å; Q183-M186 PolarHBondContact O-N 2.83Å; Q183-M186 VanDerWaalsContact O-N 3.15Å; M186-L189 PolarHBondContact O-N 3.39Å; M186-Q190 PolarHBondContact O-N 3.45Å; M186-Q190 PolarHBondContact O-NE2 2.73Å; M186-W201 HydrophobicContact SD-CH2 4.28Å; M186-W201 HydrophobicContact SD-CZ2 4.5Å; M186-F260 HydrophobicContact CB-CZ 4.29Å; M186-F260 HydrophobicContact CE-CD1 3.51Å; M186-F260 HydrophobicContact CE-CD2 3.84Å; M186-F260 HydrophobicContact CE-CE1 3.43Å; M186-F260 VanDerWaalsContact CE-CE1 3.43Å; M186-F260 HydrophobicContact CE-CE2 3.76Å; M186-F260 HydrophobicContact CE-CG 3.72Å; M186-F260 HydrophobicContact CE-CZ 3.56Å; M186-F260 HydrophobicContact SD-CD2 4.06Å; M186-F260 HydrophobicContact SD-CE1 4.25Å; M186-F260 HydrophobicContact SD-CE2 3.63Å; M186-F260 HydrophobicContact SD-CZ 3.74Å; M186-L263 HydrophobicContact CE-CD2 4.24Å; M186-L263 HydrophobicContact SD-CD2 4.44Å; M186-M267 HydrophobicContact CG-CE 3.68Å; M186-M267 HydrophobicContact CG-SD 4.2Å; M186-M267 HydrophobicContact SD-CE 3.53Å; M186-M267 VanDerWaalsContact SD-CE 3.53Å; M186-M267 HydrophobicContact SD-SD 3.48Å |
| 187 | E | 89 | Confident | 81.7 | Confident | 31 Ų | 31 | 61.6 Ų | 61.6 | 15% | 0.145 | 29% | 0.29 | C | S | . | . | H | α-helix | trans | -65 | -45.7 | 174.5 | -173.3 | 174.6 | -142.5 | 0 | 0 | 110.7 | V167 N173 L179 Q183 F184 L189 Q190 D191 | V167-E187 HydrophobicContact CG1-CG 4.48Å; N173-E187 PolarHBondContact ND2-OE1 3.32Å; L179-E187 WeakPolarHBondContact CD1-OE2 3.34Å; Q183-E187 WeakPolarHBondContact O-CB 3.4Å; Q183-E187 PolarHBondContact O-N 2.95Å; F184-E187 PolarHBondContact O-N 2.67Å; E187-L189 PolarHBondContact O-N 3.25Å; E187-Q190 WeakPolarHBondContact O-CB 3.3Å; E187-Q190 PolarHBondContact O-N 2.76Å; E187-D191 PolarHBondContact O-N 2.83Å |
| 188 | L | 90.6 | Very high | 83.3 | Confident | 2 Ų | 2 | 55.3 Ų | 55.3 | 1% | 0.01 | 25% | 0.254 | C | S | . | . | H | α-helix | trans | -63.6 | -25.6 | 176 | -167.3 | 65.3 | 0 | 0 | 0 | 113.4 | F184 Q190 V194 C195 I199 V217 L220 | F184-L188 HydrophobicContact CE1-CD2 4.24Å; F184-L188 HydrophobicContact CZ-CD2 4.34Å; F184-L188 VanDerWaalsContact O-CB 3.23Å; F184-L188 WeakPolarHBondContact O-CB 3.19Å; F184-L188 PolarHBondContact O-N 2.89Å; L188-Q190 VanDerWaalsContact C-N 3.31Å; L188-V194 HydrophobicContact CD1-CB 4.41Å; L188-V194 HydrophobicContact CD1-CG1 3.6Å; L188-C195 PolarHBondContact O-SG 2.99Å; L188-I199 HydrophobicContact CB-CG2 4.29Å; L188-I199 HydrophobicContact CD2-CB 4.39Å; L188-I199 HydrophobicContact CD2-CG2 3.89Å; L188-I199 HydrophobicContact CG-CG2 3.73Å; L188-V217 HydrophobicContact CD2-CG1 4.21Å; L188-V217 HydrophobicContact CD2-CG2 4.19Å; L188-L220 HydrophobicContact CD1-CD2 3.46Å; L188-L220 VanDerWaalsContact CD1-CD2 3.46Å; L188-L220 HydrophobicContact CD2-CD2 4.3Å |
| 189 | L | 89.4 | Confident | 84.7 | Confident | 1 Ų | 1 | 50.2 Ų | 50.2 | 1% | 0.005 | 22% | 0.223 | C | C | . | . | T | Hydrogen-bonded Turn | trans | -82.7 | -0.2 | 173.3 | -80.7 | 162.7 | 0 | 0 | 0 | 114 | L185 M186 E187 I199 W201 F209 F260 M267 | L185-L189 WeakPolarHBondContact O-CB 3.39Å; L185-L189 WeakPolarHBondContact O-CD1 3.46Å; L185-L189 WeakPolarHBondContact O-CG 3.43Å; L185-L189 PolarHBondContact O-N 3.06Å; M186-L189 PolarHBondContact O-N 3.39Å; E187-L189 PolarHBondContact O-N 3.25Å; L189-I199 HydrophobicContact CD1-CD1 3.98Å; L189-I199 HydrophobicContact CD1-CG1 4.4Å; L189-I199 HydrophobicContact CD2-CB 4.46Å; L189-I199 HydrophobicContact CD2-CD1 4.4Å; L189-I199 HydrophobicContact CD2-CG1 4Å; L189-I199 HydrophobicContact CD2-CG2 3.87Å; L189-I199 HydrophobicContact CG-CD1 3.98Å; L189-I199 HydrophobicContact CG-CG1 4.14Å; L189-I199 HydrophobicContact CG-CG2 3.91Å; L189-W201 HydrophobicContact CB-CZ2 3.72Å; L189-W201 HydrophobicContact CD1-CH2 3.89Å; L189-W201 HydrophobicContact CD1-CZ2 3.74Å; L189-W201 HydrophobicContact CD1-CZ3 4.38Å; L189-W201 HydrophobicContact CD2-CD2 4.08Å; L189-W201 HydrophobicContact CD2-CG 4.19Å; L189-W201 HydrophobicContact CD2-CZ2 4.26Å; L189-W201 HydrophobicContact CG-CZ2 4.11Å; L189-W201 PolarHBondContact O-NE1 2.84Å; L189-F209 HydrophobicContact CD1-CB 3.8Å; L189-F209 HydrophobicContact CD1-CD1 4.25Å; L189-F209 HydrophobicContact CD1-CD2 4.03Å; L189-F209 HydrophobicContact CD1-CG 3.78Å; L189-F209 HydrophobicContact CD2-CB 4.23Å; L189-F260 HydrophobicContact CD1-CE2 4.04Å; L189-M267 HydrophobicContact CB-CE 4.38Å |
| 190 | Q | 85.5 | Confident | 84.9 | Confident | 75 Ų | 75 | 53.4 Ų | 53.4 | 35% | 0.35 | 24% | 0.236 | S | C | . | . | T | Hydrogen-bonded Turn | trans | -106 | -14.7 | 171.7 | -70.7 | 162.3 | 83.5 | 0 | 0 | 113 | M186 E187 L188 R192 M267 I270 | M186-Q190 PolarHBondContact O-N 3.45Å; M186-Q190 PolarHBondContact O-NE2 2.73Å; E187-Q190 WeakPolarHBondContact O-CB 3.3Å; E187-Q190 PolarHBondContact O-N 2.76Å; L188-Q190 VanDerWaalsContact C-N 3.31Å; Q190-R192 PolarHBondContact O-N 2.84Å; Q190-R192 VanDerWaalsContact O-N 3.12Å; Q190-M267 HydrophobicContact CG-CE 3.54Å; Q190-I270 WeakPolarHBondContact O-CD1 3.33Å |
| 191 | D | 81.8 | Confident | 84.9 | Confident | 27 Ų | 27 | 48.1 Ų | 48.1 | 14% | 0.144 | 22% | 0.215 | C | C | . | . | trans | -75.7 | 97.7 | 176.9 | -91.6 | -28.3 | 0 | 0 | 0 | 111.1 | E187 Q193 V194 C195 | E187-D191 PolarHBondContact O-N 2.83Å; D191-Q193 PolarHBondContact O-N 3.33Å; D191-V194 HydrophobicContact CB-CB 3.79Å; D191-V194 HydrophobicContact CB-CG2 3.73Å; D191-V194 PolarHBondContact O-N 2.92Å; D191-C195 PolarHBondContact O-N 2.85Å; D191-C195 VanDerWaalsContact O-N 3.14Å | ||
| 192 | R | 66.2 | Low | 84.8 | Confident | 141 Ų | 141 | 51.4 Ų | 51.4 | 53% | 0.532 | 24% | 0.235 | S | C | . | . | T | Hydrogen-bonded Turn | trans | -49.4 | -31 | 175.1 | -68 | -140.1 | 173.1 | -160.6 | -6 | 113.6 | Q190 I270 | Q190-R192 PolarHBondContact O-N 2.84Å; Q190-R192 VanDerWaalsContact O-N 3.12Å; R192-I270 HydrophobicContact CB-CG2 4.4Å; R192-I270 HydrophobicContact CG-CB 4.38Å; R192-I270 HydrophobicContact CG-CD1 3.79Å; R192-I270 HydrophobicContact CG-CG1 3.82Å; R192-I270 HydrophobicContact CG-CG2 3.7Å |
| 193 | Q | 62.8 | Low | 84.7 | Confident | 182 Ų | 182 | 50.8 Ų | 50.8 | 85% | 0.85 | 24% | 0.237 | S | C | * | . | T | Hydrogen-bonded Turn | trans | -84.4 | -5 | -177 | -55.3 | -60.9 | 90.6 | 0 | 0 | 114.4 | D191 | D191-Q193 PolarHBondContact O-N 3.33Š|
| 194 | V | 63.6 | Low | 84.5 | Confident | 9 Ų | 9 | 49 Ų | 49 | 6% | 0.055 | 23% | 0.231 | C | C | . | . | T | Hydrogen-bonded Turn | trans | -126.9 | -33.8 | -165.9 | -171.6 | 0 | 0 | 0 | 0 | 111.6 | I165 L188 D191 R197 Y198 | I165-V194 HydrophobicContact CD1-CG1 4.42Å; I165-V194 HydrophobicContact CG2-CG1 4.35Å; I165-V194 HydrophobicContact CG2-CG2 3.71Å; L188-V194 HydrophobicContact CD1-CB 4.41Å; L188-V194 HydrophobicContact CD1-CG1 3.6Å; D191-V194 HydrophobicContact CB-CB 3.79Å; D191-V194 HydrophobicContact CB-CG2 3.73Å; D191-V194 PolarHBondContact O-N 2.92Å; V194-R197 PolarHBondContact O-N 3.41Å; V194-R197 VanDerWaalsContact O-N 3.15Å; V194-Y198 HydrophobicContact CG1-CD2 3.5Å; V194-Y198 VanDerWaalsContact CG1-CD2 3.5Å; V194-Y198 HydrophobicContact CG1-CE2 4.17Å; V194-Y198 HydrophobicContact CG1-CG 4.31Å; V194-Y198 WeakPolarHBondContact O-CD2 3.41Å; V194-Y198 PolarHBondContact O-N 3.26Å |
| 195 | C | 62.5 | Low | 84.2 | Confident | 22 Ų | 22 | 56 Ų | 56 | 15% | 0.149 | 26% | 0.264 | C | S | . | . | T | Hydrogen-bonded Turn | trans | -66.4 | 144.6 | 151.5 | -64.6 | 0 | 0 | 0 | 0 | 109.1 | L188 D191 I199 | L188-C195 PolarHBondContact O-SG 2.99Å; D191-C195 PolarHBondContact O-N 2.85Å; D191-C195 VanDerWaalsContact O-N 3.14Å; C195-I199 WeakPolarHBondContact CA-O 3.31Å; C195-I199 PolarHBondContact SG-O 2.97Å; C195-I199 VanDerWaalsContact SG-O 3.38Å |
| 196 | P | 77.9 | Confident | 84 | Confident | 64 Ų | 64 | 57.8 Ų | 57.8 | 42% | 0.416 | 28% | 0.278 | S | S | . | . | T | Hydrogen-bonded Turn | cis | -90.8 | 3.3 | -3.2 | 36.4 | -36.3 | 0 | 0 | 0 | 114.3 | Y198 I199 K200 V212 | P196-Y198 VanDerWaalsContact C-N 3.32Å; P196-Y198 PolarHBondContact O-N 2.87Å; P196-I199 CarbonylContact C-O 3.58Å; P196-K200 HydrophobicContact CB-CB 4.06Å; P196-K200 HydrophobicContact CB-CD 4.11Å; P196-V212 WeakPolarHBondContact O-CG2 3.36Å |
| 197 | R | 86.3 | Confident | 84.1 | Confident | 161 Ų | 161 | 57.2 Ų | 57.2 | 61% | 0.608 | 28% | 0.275 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -66.1 | -27.2 | -165.6 | -171.8 | 173.3 | -171.6 | 173.2 | 4.8 | 114.8 | V194 | V194-R197 PolarHBondContact O-N 3.41Å; V194-R197 VanDerWaalsContact O-N 3.15Å |
| 198 | Y | 90.5 | Very high | 84.4 | Confident | 25 Ų | 25 | 57.4 Ų | 57.4 | 10% | 0.098 | 28% | 0.277 | C | S | . | . | S | Bend | trans | -118.4 | -44.9 | -173.5 | -61.6 | -76.6 | 0 | 0 | 0 | 112.7 | I165 V194 P196 V212 N213 A216 V217 | I165-Y198 HydrophobicContact CD1-CD2 4.2Å; I165-Y198 HydrophobicContact CD1-CE1 4.48Å; I165-Y198 HydrophobicContact CD1-CE2 3.54Å; V194-Y198 HydrophobicContact CG1-CD2 3.5Å; V194-Y198 VanDerWaalsContact CG1-CD2 3.5Å; V194-Y198 HydrophobicContact CG1-CE2 4.17Å; V194-Y198 HydrophobicContact CG1-CG 4.31Å; V194-Y198 WeakPolarHBondContact O-CD2 3.41Å; V194-Y198 PolarHBondContact O-N 3.26Å; P196-Y198 VanDerWaalsContact C-N 3.32Å; P196-Y198 PolarHBondContact O-N 2.87Å; Y198-V212 PolarHBondContact O-N 3.2Å; Y198-N213 HydrophobicContact CD1-CB 4.38Å; Y198-N213 PolarHBondContact O-N 3.46Å; Y198-A216 HydrophobicContact CD1-CB 3.5Å; Y198-A216 VanDerWaalsContact CD1-CB 3.5Å; Y198-A216 HydrophobicContact CE1-CB 3.56Å; Y198-V217 VanDerWaalsContact O-CG2 3.3Å; Y198-V217 WeakPolarHBondContact O-CG2 3.46Å |
| 199 | I | 93.9 | Very high | 84.6 | Confident | 0 Ų | 0 | 57.3 Ų | 57.3 | 0% | 0 | 28% | 0.277 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -142 | 155.3 | 176.1 | -159.1 | 167.1 | 0 | 0 | 0 | 107 | L185 L188 L189 C195 P196 F209 K210 L211 | L185-I199 HydrophobicContact CB-CD1 4.41Å; L185-I199 HydrophobicContact CD2-CD1 3.71Å; L188-I199 HydrophobicContact CB-CG2 4.29Å; L188-I199 HydrophobicContact CD2-CB 4.39Å; L188-I199 HydrophobicContact CD2-CG2 3.89Å; L188-I199 HydrophobicContact CG-CG2 3.73Å; L189-I199 HydrophobicContact CD1-CD1 3.98Å; L189-I199 HydrophobicContact CD1-CG1 4.4Å; L189-I199 HydrophobicContact CD2-CB 4.46Å; L189-I199 HydrophobicContact CD2-CD1 4.4Å; L189-I199 HydrophobicContact CD2-CG1 4Å; L189-I199 HydrophobicContact CD2-CG2 3.87Å; L189-I199 HydrophobicContact CG-CD1 3.98Å; L189-I199 HydrophobicContact CG-CG1 4.14Å; L189-I199 HydrophobicContact CG-CG2 3.91Å; C195-I199 WeakPolarHBondContact CA-O 3.31Å; C195-I199 PolarHBondContact SG-O 2.97Å; C195-I199 VanDerWaalsContact SG-O 3.38Å; P196-I199 CarbonylContact C-O 3.58Å; I199-F209 HydrophobicContact CD1-CD2 3.8Å; I199-F209 HydrophobicContact CD1-CE2 4.08Å; I199-F209 HydrophobicContact CG1-CD2 4.11Å; I199-K210 CarbonylContact C-O 3.55Å; I199-K210 WeakPolarHBondContact CA-O 3.41Å; I199-K210 WeakPolarHBondContact CG1-O 3.42Å; I199-L211 HydrophobicContact CD1-CD1 3.67Å; I199-L211 HydrophobicContact CD1-CG 4.24Å; I199-L211 HydrophobicContact CG1-CD1 3.98Å; I199-L211 HydrophobicContact CG1-CG 4.33Å |
| 200 | K | 92.3 | Very high | 84.8 | Confident | 92 Ų | 92 | 61.1 Ų | 61.1 | 40% | 0.4 | 29% | 0.293 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -153.1 | 160.4 | 169.6 | 70 | 168.7 | -168 | 162 | 0 | 111.9 | P196 F209 K210 V212 | P196-K200 HydrophobicContact CB-CB 4.06Å; P196-K200 HydrophobicContact CB-CD 4.11Å; K200-F209 CarbonylContact O-C 3.6Å; K200-F209 VanDerWaalsContact O-CA 3.31Å; K200-F209 WeakPolarHBondContact O-CA 3.39Å; K200-F209 WeakPolarHBondContact O-CB 3.23Å; K200-K210 PolarHBondContact N-O 3.28Å; K200-K210 PolarHBondContact O-N 3.46Å; K200-V212 HydrophobicContact CD-CG2 4.39Å; K200-V212 HydrophobicContact CG-CG2 3.9Å |
| 201 | W | 92.5 | Very high | 85.3 | Confident | 25 Ų | 25 | 57.6 Ų | 57.6 | 10% | 0.095 | 28% | 0.277 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -67.4 | 142.3 | 162.5 | -64 | 105.9 | 0 | 0 | 0 | 110.6 | M186 L189 P204 F209 F260 L263 M267 | M186-W201 HydrophobicContact SD-CH2 4.28Å; M186-W201 HydrophobicContact SD-CZ2 4.5Å; L189-W201 HydrophobicContact CB-CZ2 3.72Å; L189-W201 HydrophobicContact CD1-CH2 3.89Å; L189-W201 HydrophobicContact CD1-CZ2 3.74Å; L189-W201 HydrophobicContact CD1-CZ3 4.38Å; L189-W201 HydrophobicContact CD2-CD2 4.08Å; L189-W201 HydrophobicContact CD2-CG 4.19Å; L189-W201 HydrophobicContact CD2-CZ2 4.26Å; L189-W201 HydrophobicContact CG-CZ2 4.11Å; L189-W201 PolarHBondContact O-NE1 2.84Å; W201-P204 HydrophobicContact CB-CB 4.4Å; W201-P204 HydrophobicContact CB-CG 3.9Å; W201-P204 HydrophobicContact CD2-CB 4.49Å; W201-P204 HydrophobicContact CG-CB 4.29Å; W201-P204 HydrophobicContact CG-CG 4.26Å; W201-F209 HydrophobicContact CE3-CB 3.93Å; W201-F209 HydrophobicContact CZ3-CB 4.05Å; W201-F209 HydrophobicContact CZ3-CD1 4.28Å; W201-F260 AromaticContact CH2-CD2 3.87Å; W201-F260 HydrophobicContact CH2-CD2 3.87Å; W201-F260 AromaticContact CH2-CE2 3.94Å; W201-F260 HydrophobicContact CH2-CE2 3.94Å; W201-F260 HydrophobicContact CZ3-CD2 4.15Å; W201-F260 HydrophobicContact CZ3-CE2 4.45Å; W201-L263 HydrophobicContact CH2-CD2 3.95Å; W201-L263 HydrophobicContact CZ3-CD2 4.35Å; W201-M267 HydrophobicContact CH2-CE 4.45Å; W201-M267 HydrophobicContact CH2-SD 4.09Å; W201-M267 HydrophobicContact CZ2-CE 3.61Å; W201-M267 HydrophobicContact CZ2-SD 3.64Å |
| 202 | T | 92.6 | Very high | 86 | Confident | 72 Ų | 72 | 59.9 Ų | 59.9 | 44% | 0.442 | 29% | 0.291 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -103.4 | -43.6 | 166.4 | -53.2 | 0 | 0 | 0 | 0 | 109 | I208 | T202-I208 PolarHBondContact N-O 3.03Å |
| 203 | D | 91.2 | Very high | 87.4 | Confident | 61 Ų | 61 | 56.3 Ų | 56.3 | 33% | 0.326 | 28% | 0.283 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -138.5 | 108.4 | 167.8 | -179.7 | -20.7 | 0 | 0 | 0 | 107.3 | Q205 A206 G207 I208 | D203-Q205 VanDerWaalsContact C-N 3.33Å; D203-Q205 WeakPolarHBondContact OD1-CA 3.34Å; D203-Q205 PolarHBondContact OD1-N 2.89Å; D203-A206 HydrophobicContact CB-CB 4.11Å; D203-A206 VanDerWaalsContact CG-CB 3.48Å; D203-A206 PolarHBondContact OD1-N 3.09Å; D203-A206 VanDerWaalsContact OD2-CB 3.23Å; D203-A206 WeakPolarHBondContact OD2-CB 3.39Å; D203-G207 PolarHBondContact O-N 3.23Å; D203-I208 HydrophobicContact CB-CB 4.14Å; D203-I208 HydrophobicContact CB-CD1 4.32Å; D203-I208 HydrophobicContact CB-CG1 4.44Å; D203-I208 PolarHBondContact N-O 2.93Å; D203-I208 PolarHBondContact O-N 3.44Å |
| 204 | P | 87.5 | Confident | 88.9 | Confident | 24 Ų | 24 | 48.7 Ų | 48.7 | 16% | 0.156 | 25% | 0.25 | C | C | . | . | T | Hydrogen-bonded Turn | trans | -66.3 | -32.7 | 178.9 | -15.8 | 27.9 | 0 | 0 | 0 | 113.2 | W201 G207 L263 Y269 T271 | W201-P204 HydrophobicContact CB-CB 4.4Å; W201-P204 HydrophobicContact CB-CG 3.9Å; W201-P204 HydrophobicContact CD2-CB 4.49Å; W201-P204 HydrophobicContact CG-CB 4.29Å; W201-P204 HydrophobicContact CG-CG 4.26Å; P204-G207 PolarHBondContact O-N 3.25Å; P204-L263 WeakPolarHBondContact O-CD1 3.28Å; P204-Y269 HydrophobicContact CB-CD1 3.53Å; P204-Y269 HydrophobicContact CB-CD2 4.34Å; P204-Y269 HydrophobicContact CB-CE1 4.14Å; P204-Y269 HydrophobicContact CB-CG 3.66Å; P204-Y269 WeakPolarHBondContact O-CE1 3.45Å; P204-T271 HydrophobicContact CG-CG2 4.06Å |
| 205 | Q | 87.8 | Confident | 90.5 | Very high | 151 Ų | 151 | 56.1 Ų | 56.1 | 71% | 0.706 | 28% | 0.281 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -77.9 | -42.7 | -174.8 | -61.5 | -62.3 | -29.5 | 0 | 0 | 111.3 | D203 G207 | D203-Q205 VanDerWaalsContact C-N 3.33Å; D203-Q205 WeakPolarHBondContact OD1-CA 3.34Å; D203-Q205 PolarHBondContact OD1-N 2.89Å; Q205-G207 PolarHBondContact O-N 3.32Å |
| 206 | A | 90.5 | Very high | 92 | Very high | 36 Ų | 36 | 56.1 Ų | 56.1 | 30% | 0.298 | 28% | 0.283 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -77.3 | -3.6 | 171.9 | 0 | 0 | 0 | 0 | 0 | 113.3 | D203 I208 Q259 | D203-A206 HydrophobicContact CB-CB 4.11Å; D203-A206 VanDerWaalsContact CG-CB 3.48Å; D203-A206 PolarHBondContact OD1-N 3.09Å; D203-A206 VanDerWaalsContact OD2-CB 3.23Å; D203-A206 WeakPolarHBondContact OD2-CB 3.39Å; A206-I208 VanDerWaalsContact C-N 3.32Å; A206-I208 HydrophobicContact CB-CD1 3.89Å; A206-I208 HydrophobicContact CB-CG1 3.93Å; A206-I208 PolarHBondContact O-N 3.25Å; A206-Q259 VanDerWaalsContact O-CG 3.24Å; A206-Q259 WeakPolarHBondContact O-CG 3.48Å; A206-Q259 PolarHBondContact O-NE2 3.5Å |
| 207 | G | 92.1 | Very high | 92.9 | Very high | 0 Ų | 0 | 53 Ų | 53 | 0% | 0 | 26% | 0.263 | C | S | . | . | T | Hydrogen-bonded Turn | trans | 70.9 | 23.1 | 179.8 | 0 | 0 | 0 | 0 | 0 | 114.6 | D203 P204 Q205 Q259 F260 | D203-G207 PolarHBondContact O-N 3.23Å; P204-G207 PolarHBondContact O-N 3.25Å; Q205-G207 PolarHBondContact O-N 3.32Å; G207-Q259 CarbonylContact O-C 3.55Å; G207-Q259 WeakPolarHBondContact O-CA 3.22Å; G207-F260 PolarHBondContact O-N 2.83Å |
| 208 | I | 94.4 | Very high | 93.4 | Very high | 35 Ų | 35 | 45.4 Ų | 45.4 | 18% | 0.179 | 23% | 0.234 | C | C | . | . | E | Extended strand (participates in β ladder) | trans | -90.7 | 122.9 | -177.1 | -54.1 | 173.2 | 0 | 0 | 0 | 109.7 | T202 D203 A206 V251 V257 Y258 Q259 | T202-I208 PolarHBondContact N-O 3.03Å; D203-I208 HydrophobicContact CB-CB 4.14Å; D203-I208 HydrophobicContact CB-CD1 4.32Å; D203-I208 HydrophobicContact CB-CG1 4.44Å; D203-I208 PolarHBondContact N-O 2.93Å; D203-I208 PolarHBondContact O-N 3.44Å; A206-I208 VanDerWaalsContact C-N 3.32Å; A206-I208 HydrophobicContact CB-CD1 3.89Å; A206-I208 HydrophobicContact CB-CG1 3.93Å; A206-I208 PolarHBondContact O-N 3.25Å; I208-V251 HydrophobicContact CG2-CG2 4.13Å; I208-V257 HydrophobicContact CG2-CG1 3.49Å; I208-V257 VanDerWaalsContact CG2-CG1 3.49Å; I208-Y258 CarbonylContact C-O 3.59Å; I208-Y258 WeakPolarHBondContact CA-O 3.27Å; I208-Q259 HydrophobicContact CG1-CB 4.12Å; I208-Q259 HydrophobicContact CG1-CG 3.85Å |
| 209 | F | 95.1 | Very high | 93.6 | Very high | 0 Ų | 0 | 50.8 Ų | 50.8 | 0% | 0 | 25% | 0.254 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -128.9 | 156.3 | 179.7 | 66.5 | -86.7 | 0 | 0 | 0 | 112.3 | L189 I199 K200 W201 L211 L248 V257 Y258 F260 | L189-F209 HydrophobicContact CD1-CB 3.8Å; L189-F209 HydrophobicContact CD1-CD1 4.25Å; L189-F209 HydrophobicContact CD1-CD2 4.03Å; L189-F209 HydrophobicContact CD1-CG 3.78Å; L189-F209 HydrophobicContact CD2-CB 4.23Å; I199-F209 HydrophobicContact CD1-CD2 3.8Å; I199-F209 HydrophobicContact CD1-CE2 4.08Å; I199-F209 HydrophobicContact CG1-CD2 4.11Å; K200-F209 CarbonylContact O-C 3.6Å; K200-F209 VanDerWaalsContact O-CA 3.31Å; K200-F209 WeakPolarHBondContact O-CA 3.39Å; K200-F209 WeakPolarHBondContact O-CB 3.23Å; W201-F209 HydrophobicContact CE3-CB 3.93Å; W201-F209 HydrophobicContact CZ3-CB 4.05Å; W201-F209 HydrophobicContact CZ3-CD1 4.28Å; F209-L211 HydrophobicContact CD2-CD1 3.9Å; F209-L211 HydrophobicContact CE2-CD1 3.65Å; F209-L248 HydrophobicContact CE1-CD2 3.7Å; F209-L248 HydrophobicContact CZ-CD1 4.32Å; F209-L248 HydrophobicContact CZ-CD2 3.83Å; F209-V257 WeakPolarHBondContact O-CA 3.41Å; F209-Y258 HydrophobicContact CD2-CD2 4.44Å; F209-Y258 AromaticContact CE2-CD2 3.9Å; F209-Y258 HydrophobicContact CE2-CD2 3.9Å; F209-Y258 HydrophobicContact CE2-CG 4.23Å; F209-Y258 HydrophobicContact CZ-CD2 4.32Å; F209-Y258 HydrophobicContact CZ-CG 4.18Å; F209-Y258 PolarHBondContact N-O 3.38Å; F209-Y258 PolarHBondContact O-N 2.94Å; F209-F260 AromaticContact CD1-CD2 3.58Å; F209-F260 HydrophobicContact CD1-CD2 3.58Å; F209-F260 AromaticContact CD1-CE2 3.47Å; F209-F260 HydrophobicContact CD1-CE2 3.47Å; F209-F260 VanDerWaalsContact CD1-CE2 3.47Å; F209-F260 HydrophobicContact CD1-CZ 4.41Å; F209-F260 AromaticContact CE1-CD2 3.39Å; F209-F260 HydrophobicContact CE1-CD2 3.39Å; F209-F260 HydrophobicContact CE1-CE1 4.4Å; F209-F260 AromaticContact CE1-CE2 3.19Å; F209-F260 HydrophobicContact CE1-CE2 3.19Å; F209-F260 HydrophobicContact CE1-CG 4.1Å; F209-F260 AromaticContact CE1-CZ 3.75Å; F209-F260 HydrophobicContact CE1-CZ 3.75Å; F209-F260 HydrophobicContact CG-CE2 4.38Å; F209-F260 HydrophobicContact CZ-CD2 4.47Å; F209-F260 AromaticContact CZ-CE2 3.92Å; F209-F260 HydrophobicContact CZ-CE2 3.92Å; F209-F260 HydrophobicContact CZ-CZ 4.08Å |
| 210 | K | 95.1 | Very high | 93.6 | Very high | 81 Ų | 81 | 51.7 Ų | 51.7 | 35% | 0.352 | 26% | 0.259 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -123.2 | 129.4 | 179.6 | -173.2 | 165.8 | -170.3 | 171.9 | 0 | 111.2 | I199 K200 V212 L256 V257 | I199-K210 CarbonylContact C-O 3.55Å; I199-K210 WeakPolarHBondContact CA-O 3.41Å; I199-K210 WeakPolarHBondContact CG1-O 3.42Å; K200-K210 PolarHBondContact N-O 3.28Å; K200-K210 PolarHBondContact O-N 3.46Å; K210-V212 PolarHBondContact O-N 2.92Å; K210-L256 WeakPolarHBondContact CA-O 3.36Å; K210-V257 HydrophobicContact CB-CG2 4Å; K210-V257 HydrophobicContact CD-CG2 3.76Å; K210-V257 HydrophobicContact CG-CG2 3.74Å |
| 211 | L | 95.9 | Very high | 93.7 | Very high | 1 Ų | 1 | 48 Ų | 48 | 1% | 0.005 | 24% | 0.243 | C | C | . | . | E | Extended strand (participates in β ladder) | trans | -77.2 | 103.8 | 165.8 | -86.9 | 67.8 | 0 | 0 | 0 | 108.2 | L185 I199 F209 V217 M235 L256 Y258 | L185-L211 HydrophobicContact CD2-CD1 4.5Å; I199-L211 HydrophobicContact CD1-CD1 3.67Å; I199-L211 HydrophobicContact CD1-CG 4.24Å; I199-L211 HydrophobicContact CG1-CD1 3.98Å; I199-L211 HydrophobicContact CG1-CG 4.33Å; F209-L211 HydrophobicContact CD2-CD1 3.9Å; F209-L211 HydrophobicContact CE2-CD1 3.65Å; L211-V217 HydrophobicContact CD2-CB 4.33Å; L211-V217 HydrophobicContact CD2-CG1 4.06Å; L211-V217 HydrophobicContact CG-CG1 4.42Å; L211-V217 HydrophobicContact CG-CG2 4.36Å; L211-M235 HydrophobicContact CD2-CE 3.73Å; L211-L256 HydrophobicContact CB-CB 4.22Å; L211-L256 PolarHBondContact N-O 3.47Å; L211-Y258 HydrophobicContact CD1-CD2 3.98Å; L211-Y258 HydrophobicContact CD1-CE2 3.9Å |
| 212 | V | 94.8 | Very high | 93.9 | Very high | 75 Ų | 75 | 47 Ų | 47 | 46% | 0.455 | 24% | 0.239 | S | C | . | . | S | Bend | trans | -72.7 | -40.7 | 179.6 | -178.9 | 0 | 0 | 0 | 0 | 110.7 | P196 Y198 K200 K210 | P196-V212 WeakPolarHBondContact O-CG2 3.36Å; Y198-V212 PolarHBondContact O-N 3.2Å; K200-V212 HydrophobicContact CD-CG2 4.39Å; K200-V212 HydrophobicContact CG-CG2 3.9Å; K210-V212 PolarHBondContact O-N 2.92Å |
| 213 | N | 95.3 | Very high | 93.9 | Very high | 67 Ų | 67 | 49.5 Ų | 49.5 | 36% | 0.358 | 24% | 0.244 | S | C | . | . | trans | -129.4 | 81.9 | 175.4 | -169.4 | -28.3 | 0 | 0 | 0 | 110.9 | Y198 K215 A216 V217 | Y198-N213 HydrophobicContact CD1-CB 4.38Å; Y198-N213 PolarHBondContact O-N 3.46Å; N213-K215 VanDerWaalsContact C-N 3.27Å; N213-K215 PolarHBondContact O-N 2.9Å; N213-A216 HydrophobicContact CB-CB 4.16Å; N213-A216 PolarHBondContact O-N 3.15Å; N213-A216 VanDerWaalsContact O-N 3.09Å; N213-A216 WeakPolarHBondContact OD1-CB 3.43Å; N213-A216 PolarHBondContact OD1-N 3.45Å; N213-V217 WeakPolarHBondContact O-CG2 3.41Å; N213-V217 PolarHBondContact O-N 3.38Å | ||
| 214 | S | 96.1 | Very high | 93.8 | Very high | 21 Ų | 21 | 50.2 Ų | 50.2 | 15% | 0.147 | 25% | 0.245 | C | C | . | . | H | α-helix | trans | -56.1 | -35.8 | -178.2 | 58.1 | 0 | 0 | 0 | 0 | 114.3 | A218 | S214-A218 WeakPolarHBondContact O-CB 3.45Å; S214-A218 PolarHBondContact O-N 3.44Å |
| 215 | K | 96.2 | Very high | 94.1 | Very high | 166 Ų | 166 | 53.1 Ų | 53.1 | 72% | 0.722 | 26% | 0.255 | S | S | * | . | H | α-helix | trans | -63.9 | -44.7 | 175.8 | -67.3 | -178.1 | 179.7 | 178.2 | 0 | 111.4 | N213 A218 R219 | N213-K215 VanDerWaalsContact C-N 3.27Å; N213-K215 PolarHBondContact O-N 2.9Å; K215-A218 PolarHBondContact O-N 2.97Å; K215-R219 PolarHBondContact O-N 2.72Å |
| 216 | A | 94.8 | Very high | 94.3 | Very high | 21 Ų | 21 | 52.6 Ų | 52.6 | 17% | 0.174 | 26% | 0.257 | C | S | . | . | H | α-helix | trans | -76.5 | -35.4 | -179.3 | 0 | 0 | 0 | 0 | 0 | 113 | Y198 N213 A218 R219 L220 | Y198-A216 HydrophobicContact CD1-CB 3.5Å; Y198-A216 VanDerWaalsContact CD1-CB 3.5Å; Y198-A216 HydrophobicContact CE1-CB 3.56Å; N213-A216 HydrophobicContact CB-CB 4.16Å; N213-A216 PolarHBondContact O-N 3.15Å; N213-A216 VanDerWaalsContact O-N 3.09Å; N213-A216 WeakPolarHBondContact OD1-CB 3.43Å; N213-A216 PolarHBondContact OD1-N 3.45Å; A216-A218 VanDerWaalsContact C-N 3.29Å; A216-A218 PolarHBondContact O-N 3.05Å; A216-R219 PolarHBondContact O-N 3.31Å; A216-L220 WeakPolarHBondContact O-CB 3.24Å; A216-L220 PolarHBondContact O-N 3.05Å |
| 217 | V | 95.6 | Very high | 94.5 | Very high | 0 Ų | 0 | 56.8 Ų | 56.8 | 0% | 0 | 27% | 0.269 | C | S | . | . | H | α-helix | trans | -58.8 | -42.5 | 169.6 | 174.2 | 0 | 0 | 0 | 0 | 110.5 | L185 L188 Y198 L211 N213 L220 W221 M235 | L185-V217 HydrophobicContact CD2-CG1 3.73Å; L188-V217 HydrophobicContact CD2-CG1 4.21Å; L188-V217 HydrophobicContact CD2-CG2 4.19Å; Y198-V217 VanDerWaalsContact O-CG2 3.3Å; Y198-V217 WeakPolarHBondContact O-CG2 3.46Å; L211-V217 HydrophobicContact CD2-CB 4.33Å; L211-V217 HydrophobicContact CD2-CG1 4.06Å; L211-V217 HydrophobicContact CG-CG1 4.42Å; L211-V217 HydrophobicContact CG-CG2 4.36Å; N213-V217 WeakPolarHBondContact O-CG2 3.41Å; N213-V217 PolarHBondContact O-N 3.38Å; V217-L220 PolarHBondContact O-N 2.79Å; V217-W221 WeakPolarHBondContact O-CB 3.42Å; V217-W221 PolarHBondContact O-N 3.07Å; V217-M235 HydrophobicContact CG1-CE 4.07Å; V217-M235 HydrophobicContact CG1-SD 4.2Å |
| 218 | A | 96.8 | Very high | 94.5 | Very high | 0 Ų | 0 | 61.9 Ų | 61.9 | 0% | 0 | 30% | 0.302 | C | S | . | . | H | α-helix | trans | -65.1 | -40.7 | 174.7 | 0 | 0 | 0 | 0 | 0 | 113.2 | S214 K215 A216 L220 W221 G222 M230 N231 M235 | S214-A218 WeakPolarHBondContact O-CB 3.45Å; S214-A218 PolarHBondContact O-N 3.44Å; K215-A218 PolarHBondContact O-N 2.97Å; A216-A218 VanDerWaalsContact C-N 3.29Å; A216-A218 PolarHBondContact O-N 3.05Å; A218-L220 VanDerWaalsContact C-N 3.33Å; A218-L220 PolarHBondContact O-N 2.86Å; A218-W221 PolarHBondContact O-N 3.05Å; A218-G222 PolarHBondContact O-N 2.96Å; A218-M230 WeakPolarHBondContact O-CG 3.44Å; A218-N231 VanDerWaalsContact CB-C 3.43Å; A218-M235 HydrophobicContact CB-SD 4.08Å |
| 219 | R | 95.4 | Very high | 94.5 | Very high | 138 Ų | 138 | 66.9 Ų | 66.9 | 52% | 0.521 | 33% | 0.329 | S | S | . | . | H | α-helix | trans | -59.5 | -41.8 | 171.3 | -77.5 | -175.2 | 70.9 | -161.5 | 1.7 | 111.9 | E159 K215 A216 G222 K223 | E159-R219 IonicContact OE1-NH2 3.81Å; E159-R219 PolarHBondContact OE1-NH2 2.84Å; K215-R219 PolarHBondContact O-N 2.72Å; A216-R219 PolarHBondContact O-N 3.31Å; R219-G222 CarbonylContact O-C 3.55Å; R219-G222 WeakPolarHBondContact O-CA 3.44Å; R219-G222 PolarHBondContact O-N 3.37Å; R219-K223 PolarHBondContact O-N 3.48Å |
| 220 | L | 94.3 | Very high | 94.6 | Very high | 19 Ų | 19 | 68.2 Ų | 68.2 | 10% | 0.099 | 34% | 0.336 | C | S | . | . | H | α-helix | trans | -70.7 | -40.4 | -177.7 | -164.4 | 67.4 | 0 | 0 | 0 | 111.5 | I165 V167 F184 L188 A216 V217 A218 G222 K223 H224 | I165-L220 HydrophobicContact CB-CD1 4.34Å; I165-L220 HydrophobicContact CD1-CD1 4.41Å; I165-L220 HydrophobicContact CG2-CD1 4.48Å; V167-L220 HydrophobicContact CG2-CD2 4.45Å; F184-L220 HydrophobicContact CE2-CG 4.44Å; F184-L220 HydrophobicContact CZ-CB 4.07Å; F184-L220 HydrophobicContact CZ-CD2 4.1Å; F184-L220 HydrophobicContact CZ-CG 3.92Å; L188-L220 HydrophobicContact CD1-CD2 3.46Å; L188-L220 VanDerWaalsContact CD1-CD2 3.46Å; L188-L220 HydrophobicContact CD2-CD2 4.3Å; A216-L220 WeakPolarHBondContact O-CB 3.24Å; A216-L220 PolarHBondContact O-N 3.05Å; V217-L220 PolarHBondContact O-N 2.79Å; A218-L220 VanDerWaalsContact C-N 3.33Å; A218-L220 PolarHBondContact O-N 2.86Å; L220-G222 VanDerWaalsContact C-N 3.29Å; L220-G222 PolarHBondContact O-N 3.45Å; L220-K223 HydrophobicContact CD1-CD 4.48Å; L220-K223 WeakPolarHBondContact O-CB 3.47Å; L220-K223 PolarHBondContact O-N 3.04Å; L220-H224 PolarHBondContact O-N 3.48Å |
| 221 | W | 94.9 | Very high | 94.7 | Very high | 16 Ų | 16 | 67.8 Ų | 67.8 | 6% | 0.061 | 34% | 0.337 | C | S | . | . | H | α-helix | trans | -60.5 | -38.5 | 168 | 178.1 | -129.2 | 0 | 0 | 0 | 112.1 | Y180 L181 F184 V217 A218 H224 K225 M230 M235 | Y180-W221 VanDerWaalsContact C-CH2 3.49Å; L181-W221 VanDerWaalsContact CA-CH2 3.48Å; L181-W221 HydrophobicContact CB-CH2 4.05Å; L181-W221 HydrophobicContact CB-CZ2 3.61Å; L181-W221 HydrophobicContact CD1-CD2 3.82Å; L181-W221 HydrophobicContact CD1-CE3 4.37Å; L181-W221 HydrophobicContact CD1-CG 3.93Å; L181-W221 HydrophobicContact CD1-CZ2 4.28Å; L181-W221 VanDerWaalsContact N-CH2 3.32Å; F184-W221 HydrophobicContact CB-CE3 3.68Å; F184-W221 HydrophobicContact CB-CH2 4.43Å; F184-W221 HydrophobicContact CB-CZ3 3.47Å; F184-W221 VanDerWaalsContact CB-CZ3 3.47Å; F184-W221 HydrophobicContact CD1-CB 4.14Å; F184-W221 HydrophobicContact CD1-CD2 4.16Å; F184-W221 AromaticContact CD1-CE3 3.56Å; F184-W221 HydrophobicContact CD1-CE3 3.56Å; F184-W221 HydrophobicContact CD1-CG 4.44Å; F184-W221 HydrophobicContact CD1-CZ3 4.26Å; F184-W221 AromaticContact CD2-CE3 3.99Å; F184-W221 HydrophobicContact CD2-CE3 3.99Å; F184-W221 HydrophobicContact CD2-CZ3 4.39Å; F184-W221 HydrophobicContact CE1-CB 3.7Å; F184-W221 HydrophobicContact CE1-CE3 4.2Å; F184-W221 HydrophobicContact CE1-CG 4.47Å; F184-W221 HydrophobicContact CG-CD2 4.45Å; F184-W221 AromaticContact CG-CE3 3.44Å; F184-W221 HydrophobicContact CG-CE3 3.44Å; F184-W221 VanDerWaalsContact CG-CE3 3.44Å; F184-W221 AromaticContact CG-CZ3 3.79Å; F184-W221 HydrophobicContact CG-CZ3 3.79Å; F184-W221 HydrophobicContact CZ-CB 4.2Å; V217-W221 WeakPolarHBondContact O-CB 3.42Å; V217-W221 PolarHBondContact O-N 3.07Å; A218-W221 PolarHBondContact O-N 3.05Å; W221-H224 HydrophobicContact CE3-CB 4.49Å; W221-H224 PolarHBondContact O-N 2.86Å; W221-K225 HydrophobicContact CD2-CD 4.47Å; W221-K225 HydrophobicContact CD2-CG 4.17Å; W221-K225 HydrophobicContact CE3-CD 4.45Å; W221-K225 HydrophobicContact CE3-CG 4Å; W221-K225 HydrophobicContact CH2-CD 3.45Å; W221-K225 VanDerWaalsContact CH2-CD 3.45Å; W221-K225 HydrophobicContact CH2-CG 3.86Å; W221-K225 HydrophobicContact CZ2-CD 3.4Å; W221-K225 HydrophobicContact CZ2-CG 3.99Å; W221-K225 HydrophobicContact CZ3-CD 3.98Å; W221-K225 HydrophobicContact CZ3-CG 3.83Å; W221-K225 PolarHBondContact O-N 3.49Å; W221-M230 HydrophobicContact CG-CG 4.45Å; W221-M235 HydrophobicContact CB-SD 4.24Å; W221-M235 HydrophobicContact CG-SD 4.36Å |
| 222 | G | 94.7 | Very high | 94.8 | Very high | 2 Ų | 2 | 70 Ų | 70 | 2% | 0.021 | 35% | 0.346 | C | S | . | . | H | α-helix | trans | -60.2 | -47.5 | 171.1 | 0 | 0 | 0 | 0 | 0 | 113.2 | A218 R219 L220 H224 K225 N226 K227 | A218-G222 PolarHBondContact O-N 2.96Å; R219-G222 CarbonylContact O-C 3.55Å; R219-G222 WeakPolarHBondContact O-CA 3.44Å; R219-G222 PolarHBondContact O-N 3.37Å; L220-G222 VanDerWaalsContact C-N 3.29Å; L220-G222 PolarHBondContact O-N 3.45Å; G222-H224 VanDerWaalsContact C-N 3.35Å; G222-H224 PolarHBondContact O-N 2.83Å; G222-K225 PolarHBondContact O-N 2.83Å; G222-N226 CarbonylContact O-C 3.56Å; G222-N226 WeakPolarHBondContact O-CA 3.27Å; G222-N226 PolarHBondContact O-N 2.95Å; G222-K227 CarbonylContact C-O 3.57Å; G222-K227 WeakPolarHBondContact CA-O 3.35Å; G222-K227 PolarHBondContact O-N 3.42Å |
| 223 | K | 92.8 | Very high | 94.9 | Very high | 125 Ų | 125 | 70.9 Ų | 70.9 | 54% | 0.543 | 35% | 0.345 | S | S | . | . | H | α-helix | trans | -57.4 | -47.4 | 173.7 | -167.9 | -178.8 | -177.3 | -175.4 | 0 | 110.2 | D164 R219 L220 N226 | D164-K223 IonicContact OD1-NZ 3.75Å; D164-K223 PolarHBondContact OD1-NZ 2.86Å; R219-K223 PolarHBondContact O-N 3.48Å; L220-K223 HydrophobicContact CD1-CD 4.48Å; L220-K223 WeakPolarHBondContact O-CB 3.47Å; L220-K223 PolarHBondContact O-N 3.04Å; K223-N226 PolarHBondContact O-N 3.22Å |
| 224 | H | 90.9 | Very high | 94.9 | Very high | 76 Ų | 76 | 71.4 Ų | 71.4 | 35% | 0.352 | 35% | 0.351 | S | S | . | . | H | α-helix | trans | -62.4 | -45.1 | 179.2 | -174.8 | 101.7 | 0 | 0 | 0 | 113.1 | F184 L220 W221 G222 | F184-H224 HydrophobicContact CD2-CB 4.3Å; F184-H224 HydrophobicContact CE2-CB 4.13Å; L220-H224 PolarHBondContact O-N 3.48Å; W221-H224 HydrophobicContact CE3-CB 4.49Å; W221-H224 PolarHBondContact O-N 2.86Å; G222-H224 VanDerWaalsContact C-N 3.35Å; G222-H224 PolarHBondContact O-N 2.83Å |
| 225 | K | 91.8 | Very high | 95 | Very high | 85 Ų | 85 | 70.5 Ų | 70.5 | 37% | 0.37 | 34% | 0.344 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -89.7 | 7.8 | 179.4 | -64 | -143.4 | 72.1 | 140.9 | 0 | 115 | L179 W221 G222 K227 | L179-K225 PolarHBondContact O-NZ 2.93Å; W221-K225 HydrophobicContact CD2-CD 4.47Å; W221-K225 HydrophobicContact CD2-CG 4.17Å; W221-K225 HydrophobicContact CE3-CD 4.45Å; W221-K225 HydrophobicContact CE3-CG 4Å; W221-K225 HydrophobicContact CH2-CD 3.45Å; W221-K225 VanDerWaalsContact CH2-CD 3.45Å; W221-K225 HydrophobicContact CH2-CG 3.86Å; W221-K225 HydrophobicContact CZ2-CD 3.4Å; W221-K225 HydrophobicContact CZ2-CG 3.99Å; W221-K225 HydrophobicContact CZ3-CD 3.98Å; W221-K225 HydrophobicContact CZ3-CG 3.83Å; W221-K225 PolarHBondContact O-N 3.49Å; G222-K225 PolarHBondContact O-N 2.83Å; K225-K227 VanDerWaalsContact C-N 3.27Å; K225-K227 HydrophobicContact CB-CG 4.34Å; K225-K227 PolarHBondContact O-N 2.93Å |
| 226 | N | 93 | Very high | 95 | Very high | 140 Ų | 140 | 62.7 Ų | 62.7 | 75% | 0.749 | 31% | 0.311 | S | S | * | . | T | Hydrogen-bonded Turn | trans | 49.1 | 47.2 | -173 | -157.4 | 7.9 | 0 | 0 | 0 | 112.9 | G222 K223 | G222-N226 CarbonylContact O-C 3.56Å; G222-N226 WeakPolarHBondContact O-CA 3.27Å; G222-N226 PolarHBondContact O-N 2.95Å; K223-N226 PolarHBondContact O-N 3.22Å |
| 227 | K | 94 | Very high | 95.1 | Very high | 124 Ų | 124 | 69 Ų | 69 | 54% | 0.539 | 33% | 0.33 | S | S | . | . | trans | -121.5 | 92.4 | 176.2 | -68 | -58 | -175.7 | -177 | 0 | 109 | G222 K225 D229 M230 | G222-K227 CarbonylContact C-O 3.57Å; G222-K227 WeakPolarHBondContact CA-O 3.35Å; G222-K227 PolarHBondContact O-N 3.42Å; K225-K227 VanDerWaalsContact C-N 3.27Å; K225-K227 HydrophobicContact CB-CG 4.34Å; K225-K227 PolarHBondContact O-N 2.93Å; K227-D229 VanDerWaalsContact C-N 3.29Å; K227-D229 PolarHBondContact O-N 2.93Å; K227-M230 HydrophobicContact CB-CB 4.37Å; K227-M230 HydrophobicContact CB-CE 4.12Å; K227-M230 HydrophobicContact CG-CE 4.46Å; K227-M230 VanDerWaalsContact O-CB 3.27Å; K227-M230 WeakPolarHBondContact O-CB 3.32Å; K227-M230 PolarHBondContact O-N 3.38Å | ||
| 228 | P | 92.1 | Very high | 95.2 | Very high | 107 Ų | 107 | 70.5 Ų | 70.5 | 70% | 0.695 | 34% | 0.342 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -65.2 | -32.4 | -175 | 25.8 | -33.4 | 0 | 0 | 0 | 112.7 | M230 | P228-M230 PolarHBondContact O-N 2.65Å; P228-M230 VanDerWaalsContact O-N 3.16Å |
| 229 | D | 95.3 | Very high | 95.2 | Very high | 140 Ų | 140 | 70.5 Ų | 70.5 | 75% | 0.749 | 34% | 0.342 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -79.3 | 10.3 | -178.6 | -39.5 | -73.8 | 0 | 0 | 0 | 113.6 | K227 N231 | K227-D229 VanDerWaalsContact C-N 3.29Å; K227-D229 PolarHBondContact O-N 2.93Å; D229-N231 PolarHBondContact O-N 3.37Å; D229-N231 PolarHBondContact O-ND2 3.39Å |
| 230 | M | 97.1 | Very high | 95.2 | Very high | 29 Ų | 29 | 69.1 Ų | 69.1 | 14% | 0.143 | 34% | 0.337 | C | S | . | . | trans | -68.1 | 116.6 | -179.7 | -173.5 | 63.1 | 67.4 | 0 | 0 | 111.1 | A218 W221 K227 P228 T234 M235 | A218-M230 WeakPolarHBondContact O-CG 3.44Å; W221-M230 HydrophobicContact CG-CG 4.45Å; K227-M230 HydrophobicContact CB-CB 4.37Å; K227-M230 HydrophobicContact CB-CE 4.12Å; K227-M230 HydrophobicContact CG-CE 4.46Å; K227-M230 VanDerWaalsContact O-CB 3.27Å; K227-M230 WeakPolarHBondContact O-CB 3.32Å; K227-M230 PolarHBondContact O-N 3.38Å; P228-M230 PolarHBondContact O-N 2.65Å; P228-M230 VanDerWaalsContact O-N 3.16Å; M230-T234 HydrophobicContact SD-CG2 4.2Å; M230-M235 HydrophobicContact SD-CB 4.18Å | ||
| 231 | N | 97.6 | Very high | 95.4 | Very high | 72 Ų | 72 | 75.3 Ų | 75.3 | 39% | 0.385 | 36% | 0.36 | S | S | . | . | trans | -122.8 | 168.7 | 178.4 | 65.6 | 74.5 | 0 | 0 | 0 | 110.8 | A218 D229 E233 T234 M235 | A218-N231 VanDerWaalsContact CB-C 3.43Å; D229-N231 PolarHBondContact O-N 3.37Å; D229-N231 PolarHBondContact O-ND2 3.39Å; N231-E233 VanDerWaalsContact C-N 3.33Å; N231-E233 PolarHBondContact O-N 3.24Å; N231-E233 WeakPolarHBondContact OD1-CA 3.49Å; N231-E233 PolarHBondContact OD1-N 2.96Å; N231-T234 PolarHBondContact ND2-OG1 3.26Å; N231-T234 PolarHBondContact O-N 2.99Å; N231-T234 PolarHBondContact OD1-N 3.29Å; N231-T234 PolarHBondContact OD1-OG1 3.23Å; N231-M235 WeakPolarHBondContact O-CB 3.19Å; N231-M235 PolarHBondContact O-N 3.26Å | ||
| 232 | Y | 97.5 | Very high | 95.4 | Very high | 48 Ų | 48 | 75.2 Ų | 75.2 | 19% | 0.188 | 36% | 0.36 | C | S | . | . | H | α-helix | trans | -64.2 | -31.7 | -177.2 | 171 | -98.7 | 0 | 0 | 0 | 113.4 | M235 G236 L239 L256 Y258 | Y232-M235 HydrophobicContact CD2-CE 3.94Å; Y232-M235 HydrophobicContact CE2-CE 4.46Å; Y232-G236 WeakPolarHBondContact O-CA 3.47Å; Y232-G236 PolarHBondContact O-N 3.36Å; Y232-L239 HydrophobicContact CE2-CD1 4.32Å; Y232-L256 HydrophobicContact CE1-CD2 4.13Å; Y232-L256 HydrophobicContact CE2-CD2 3.73Å; Y232-L256 WeakPolarHBondContact OH-CD2 3.23Å; Y232-Y258 PolarHBondContact OH-OH 2.97Å |
| 233 | E | 96.8 | Very high | 95.4 | Very high | 92 Ų | 92 | 78.5 Ų | 78.5 | 43% | 0.43 | 37% | 0.372 | S | S | . | . | H | α-helix | trans | -71.3 | -38.6 | 178.3 | -73.2 | -49.7 | 128.7 | 0 | 0 | 112.6 | N231 R237 R240 | N231-E233 VanDerWaalsContact C-N 3.33Å; N231-E233 PolarHBondContact O-N 3.24Å; N231-E233 WeakPolarHBondContact OD1-CA 3.49Å; N231-E233 PolarHBondContact OD1-N 2.96Å; E233-R237 WeakPolarHBondContact O-CG 3.32Å; E233-R237 PolarHBondContact O-N 3.29Å; E233-R240 IonicContact OE2-NH1 3.41Å; E233-R240 PolarHBondContact OE2-NH1 3.24Å; E233-R240 IonicContact OE2-NH2 2.92Å |
| 234 | T | 96.6 | Very high | 95.5 | Very high | 78 Ų | 78 | 80.7 Ų | 80.7 | 48% | 0.479 | 39% | 0.385 | S | S | . | . | H | α-helix | trans | -65.9 | -49.1 | 172.5 | -53.5 | 0 | 0 | 0 | 0 | 111.1 | M230 N231 G236 R237 | M230-T234 HydrophobicContact SD-CG2 4.2Å; N231-T234 PolarHBondContact ND2-OG1 3.26Å; N231-T234 PolarHBondContact O-N 2.99Å; N231-T234 PolarHBondContact OD1-N 3.29Å; N231-T234 PolarHBondContact OD1-OG1 3.23Å; T234-G236 VanDerWaalsContact C-N 3.29Å; T234-G236 PolarHBondContact O-N 3.14Å; T234-R237 WeakPolarHBondContact O-CB 3.45Å; T234-R237 PolarHBondContact O-N 3.42Å |
| 235 | M | 96.8 | Very high | 95.7 | Very high | 3 Ų | 3 | 84.9 Ų | 84.9 | 2% | 0.015 | 40% | 0.397 | C | S | . | . | H | α-helix | trans | -61.6 | -38.5 | 176.8 | -171.8 | -174.6 | 82 | 0 | 0 | 111.9 | L181 L211 V217 A218 W221 M230 N231 Y232 R237 A238 L239 | L181-M235 HydrophobicContact CD1-CG 3.75Å; L181-M235 HydrophobicContact CD1-SD 3.8Å; L181-M235 HydrophobicContact CD2-CG 3.5Å; L181-M235 VanDerWaalsContact CD2-CG 3.5Å; L181-M235 HydrophobicContact CD2-SD 4.46Å; L181-M235 HydrophobicContact CG-CG 4.29Å; L211-M235 HydrophobicContact CD2-CE 3.73Å; V217-M235 HydrophobicContact CG1-CE 4.07Å; V217-M235 HydrophobicContact CG1-SD 4.2Å; A218-M235 HydrophobicContact CB-SD 4.08Å; W221-M235 HydrophobicContact CB-SD 4.24Å; W221-M235 HydrophobicContact CG-SD 4.36Å; M230-M235 HydrophobicContact SD-CB 4.18Å; N231-M235 WeakPolarHBondContact O-CB 3.19Å; N231-M235 PolarHBondContact O-N 3.26Å; Y232-M235 HydrophobicContact CD2-CE 3.94Å; Y232-M235 HydrophobicContact CE2-CE 4.46Å; M235-R237 PolarHBondContact O-N 3.03Å; M235-A238 WeakPolarHBondContact O-CB 3.38Å; M235-A238 PolarHBondContact O-N 3.43Å; M235-L239 HydrophobicContact CE-CD1 4.34Å; M235-L239 PolarHBondContact O-N 3.27Å |
| 236 | G | 97 | Very high | 95.8 | Very high | 2 Ų | 2 | 82.7 Ų | 82.7 | 2% | 0.021 | 40% | 0.399 | C | S | . | . | H | α-helix | trans | -67.7 | -15.7 | 178.8 | 0 | 0 | 0 | 0 | 0 | 114.2 | Y232 T234 R240 | Y232-G236 WeakPolarHBondContact O-CA 3.47Å; Y232-G236 PolarHBondContact O-N 3.36Å; T234-G236 VanDerWaalsContact C-N 3.29Å; T234-G236 PolarHBondContact O-N 3.14Å; G236-R240 WeakPolarHBondContact O-CD 3.39Å; G236-R240 VanDerWaalsContact O-CG 3.22Å; G236-R240 WeakPolarHBondContact O-CG 3.1Å; G236-R240 PolarHBondContact O-N 3.16Å; G236-R240 VanDerWaalsContact O-N 3.08Å |
| 237 | R | 97.3 | Very high | 95.9 | Very high | 154 Ų | 154 | 77.9 Ų | 77.9 | 58% | 0.581 | 37% | 0.372 | S | S | * | . | H | α-helix | trans | -66.7 | -43.9 | 165.8 | -59.1 | -59.2 | 170 | 134.4 | -4.9 | 110.7 | E233 T234 M235 L239 R240 Y241 | E233-R237 WeakPolarHBondContact O-CG 3.32Å; E233-R237 PolarHBondContact O-N 3.29Å; T234-R237 WeakPolarHBondContact O-CB 3.45Å; T234-R237 PolarHBondContact O-N 3.42Å; M235-R237 PolarHBondContact O-N 3.03Å; R237-L239 VanDerWaalsContact C-N 3.34Å; R237-L239 PolarHBondContact O-N 3.34Å; R237-R240 PolarHBondContact O-N 3.25Å; R237-Y241 HydrophobicContact CB-CE2 4.3Å; R237-Y241 WeakPolarHBondContact O-CD2 3.48Å; R237-Y241 PolarHBondContact O-N 3.29Å |
| 238 | A | 96.1 | Very high | 96 | Very high | 30 Ų | 30 | 72 Ų | 72 | 25% | 0.248 | 35% | 0.347 | C | S | . | . | H | α-helix | trans | -63.7 | -38.6 | 176 | 0 | 0 | 0 | 0 | 0 | 112.3 | L181 M235 Y241 Y242 | L181-A238 HydrophobicContact CD2-CB 3.75Å; M235-A238 WeakPolarHBondContact O-CB 3.38Å; M235-A238 PolarHBondContact O-N 3.43Å; A238-Y241 PolarHBondContact O-N 2.96Å; A238-Y242 HydrophobicContact CB-CE2 4.5Å; A238-Y242 VanDerWaalsContact O-CD2 3.28Å; A238-Y242 WeakPolarHBondContact O-CD2 3.43Å; A238-Y242 VanDerWaalsContact O-CG 3.27Å; A238-Y242 PolarHBondContact O-N 3.38Å; A238-Y242 VanDerWaalsContact O-N 3.1Å |
| 239 | L | 96.8 | Very high | 96.2 | Very high | 1 Ų | 1 | 69.9 Ų | 69.9 | 1% | 0.005 | 33% | 0.33 | C | S | . | . | H | α-helix | trans | -60.2 | -47.4 | 172.2 | -62.9 | 178.3 | 0 | 0 | 0 | 112.1 | L181 L185 Y232 M235 R237 Y241 Y242 Y243 L248 Y258 | L181-L239 HydrophobicContact CD2-CD2 3.78Å; L181-L239 HydrophobicContact CD2-CG 3.96Å; L181-L239 HydrophobicContact CG-CD2 4.47Å; L185-L239 HydrophobicContact CD1-CD2 3.75Å; Y232-L239 HydrophobicContact CE2-CD1 4.32Å; M235-L239 HydrophobicContact CE-CD1 4.34Å; M235-L239 PolarHBondContact O-N 3.27Å; R237-L239 VanDerWaalsContact C-N 3.34Å; R237-L239 PolarHBondContact O-N 3.34Å; L239-Y241 VanDerWaalsContact C-N 3.31Å; L239-Y241 PolarHBondContact O-N 3.22Å; L239-Y242 HydrophobicContact CD2-CD2 4.34Å; L239-Y242 WeakPolarHBondContact O-CB 3.11Å; L239-Y242 PolarHBondContact O-N 2.99Å; L239-Y243 WeakPolarHBondContact O-CD1 3.4Å; L239-Y243 WeakPolarHBondContact O-CE1 3.33Å; L239-Y243 PolarHBondContact O-N 3.37Å; L239-L248 HydrophobicContact CD2-CD1 3.66Å; L239-Y258 HydrophobicContact CB-CE1 4.33Å; L239-Y258 HydrophobicContact CD1-CE1 3.95Å; L239-Y258 HydrophobicContact CD1-CE2 4.32Å |
| 240 | R | 96.6 | Very high | 96.2 | Very high | 108 Ų | 108 | 67.6 Ų | 67.6 | 41% | 0.408 | 31% | 0.313 | S | S | . | . | H | α-helix | trans | -59.6 | -38.4 | 176 | -70.4 | 164 | 177.1 | 123.5 | -11.8 | 112.2 | E233 G236 R237 Y242 Y243 | E233-R240 IonicContact OE2-NH1 3.41Å; E233-R240 PolarHBondContact OE2-NH1 3.24Å; E233-R240 IonicContact OE2-NH2 2.92Å; G236-R240 WeakPolarHBondContact O-CD 3.39Å; G236-R240 VanDerWaalsContact O-CG 3.22Å; G236-R240 WeakPolarHBondContact O-CG 3.1Å; G236-R240 PolarHBondContact O-N 3.16Å; G236-R240 VanDerWaalsContact O-N 3.08Å; R237-R240 PolarHBondContact O-N 3.25Å; R240-Y242 VanDerWaalsContact C-N 3.29Å; R240-Y242 PolarHBondContact O-N 3.35Å; R240-Y243 HydrophobicContact CB-CE2 4.4Å; R240-Y243 HydrophobicContact CG-CE2 4.13Å; R240-Y243 WeakPolarHBondContact O-CB 3.2Å; R240-Y243 PolarHBondContact O-N 2.97Å |
| 241 | Y | 96.9 | Very high | 96.2 | Very high | 149 Ų | 149 | 67.4 Ų | 67.4 | 58% | 0.584 | 31% | 0.314 | S | S | * | . | H | α-helix | trans | -68.2 | -23.5 | 173.4 | -68.8 | -55.6 | 0 | 0 | 0 | 113.8 | R237 A238 L239 Y243 R245 | R237-Y241 HydrophobicContact CB-CE2 4.3Å; R237-Y241 WeakPolarHBondContact O-CD2 3.48Å; R237-Y241 PolarHBondContact O-N 3.29Å; A238-Y241 PolarHBondContact O-N 2.96Å; L239-Y241 VanDerWaalsContact C-N 3.31Å; L239-Y241 PolarHBondContact O-N 3.22Å; Y241-Y243 VanDerWaalsContact C-N 3.32Å; Y241-R245 WeakPolarHBondContact O-CG 3.37Å; Y241-R245 PolarHBondContact O-N 3.08Å |
| 242 | Y | 96.4 | Very high | 96 | Very high | 15 Ų | 15 | 70.7 Ų | 70.7 | 6% | 0.059 | 33% | 0.327 | C | S | . | . | H | α-helix | trans | -74.9 | -20.2 | 175.9 | -64.1 | -32.9 | 0 | 0 | 0 | 113.4 | L181 W182 A238 L239 R240 G246 I247 L248 | L181-Y242 HydrophobicContact CB-CE2 3.94Å; L181-Y242 HydrophobicContact CD2-CE2 4.25Å; L181-Y242 HydrophobicContact CG-CE2 4.27Å; L181-Y242 PolarHBondContact N-OH 3.32Å; W182-Y242 HydrophobicContact CB-CD2 4.19Å; W182-Y242 HydrophobicContact CB-CE2 3.81Å; W182-Y242 AromaticContact CD1-CE1 3.9Å; W182-Y242 AromaticContact CD1-CZ 3.72Å; W182-Y242 HydrophobicContact CG-CE2 4.48Å; A238-Y242 HydrophobicContact CB-CE2 4.5Å; A238-Y242 VanDerWaalsContact O-CD2 3.28Å; A238-Y242 WeakPolarHBondContact O-CD2 3.43Å; A238-Y242 VanDerWaalsContact O-CG 3.27Å; A238-Y242 PolarHBondContact O-N 3.38Å; A238-Y242 VanDerWaalsContact O-N 3.1Å; L239-Y242 HydrophobicContact CD2-CD2 4.34Å; L239-Y242 WeakPolarHBondContact O-CB 3.11Å; L239-Y242 PolarHBondContact O-N 2.99Å; R240-Y242 VanDerWaalsContact C-N 3.29Å; R240-Y242 PolarHBondContact O-N 3.35Å; Y242-G246 PolarHBondContact O-N 3.41Å; Y242-I247 HydrophobicContact CD1-CB 4.41Å; Y242-I247 HydrophobicContact CD1-CD1 4Å; Y242-I247 HydrophobicContact CE1-CD1 4.44Å; Y242-I247 HydrophobicContact CG-CB 4.42Å; Y242-I247 HydrophobicContact CG-CG2 4.44Å; Y242-I247 PolarHBondContact O-N 3.38Å; Y242-L248 HydrophobicContact CD2-CD1 3.87Å; Y242-L248 HydrophobicContact CD2-CG 4.38Å; Y242-L248 HydrophobicContact CG-CD1 4.46Å; Y242-L248 PolarHBondContact O-N 3.03Å |
| 243 | Y | 95.1 | Very high | 95.9 | Very high | 71 Ų | 71 | 72.4 Ų | 72.4 | 28% | 0.278 | 36% | 0.359 | S | S | . | . | H | α-helix | trans | -63.9 | -56.8 | 171 | -49.6 | -19.3 | 0 | 0 | 0 | 111.2 | L239 R240 Y241 R245 G246 L248 K250 Y258 | L239-Y243 WeakPolarHBondContact O-CD1 3.4Å; L239-Y243 WeakPolarHBondContact O-CE1 3.33Å; L239-Y243 PolarHBondContact O-N 3.37Å; R240-Y243 HydrophobicContact CB-CE2 4.4Å; R240-Y243 HydrophobicContact CG-CE2 4.13Å; R240-Y243 WeakPolarHBondContact O-CB 3.2Å; R240-Y243 PolarHBondContact O-N 2.97Å; Y241-Y243 VanDerWaalsContact C-N 3.32Å; Y243-R245 PolarHBondContact O-N 2.72Å; Y243-R245 VanDerWaalsContact O-N 3.1Å; Y243-G246 PolarHBondContact O-N 3.27Å; Y243-L248 VanDerWaalsContact CA-O 3.23Å; Y243-L248 WeakPolarHBondContact CA-O 3.47Å; Y243-L248 HydrophobicContact CD1-CB 4.47Å; Y243-L248 WeakPolarHBondContact CD1-O 3.38Å; Y243-K250 HydrophobicContact CD1-CB 4.39Å; Y243-K250 HydrophobicContact CD2-CB 4.38Å; Y243-K250 HydrophobicContact CE1-CB 3.96Å; Y243-K250 HydrophobicContact CE2-CB 3.94Å; Y243-K250 HydrophobicContact CE2-CD 4.27Å; Y243-K250 HydrophobicContact CE2-CG 4.48Å; Y243-Y258 HydrophobicContact CE1-CD1 4.15Å; Y243-Y258 HydrophobicContact CE1-CE1 4.35Å; Y243-Y258 WeakPolarHBondContact OH-CE1 3.49Å |
| 244 | Q | 94.4 | Very high | 95.8 | Very high | 171 Ų | 171 | 72.9 Ų | 72.9 | 80% | 0.799 | 36% | 0.361 | S | S | * | . | H | α-helix | trans | -64.2 | -18.3 | -179.7 | -67 | 175.7 | -32 | 0 | 0 | 113.2 | ||
| 245 | R | 94.5 | Very high | 95.8 | Very high | 164 Ų | 164 | 79.8 Ų | 79.8 | 62% | 0.619 | 38% | 0.379 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -95.5 | -0.1 | 176 | -69.5 | -174 | 63.8 | -170.2 | -2.9 | 114 | Y241 Y243 I247 | Y241-R245 WeakPolarHBondContact O-CG 3.37Å; Y241-R245 PolarHBondContact O-N 3.08Å; Y243-R245 PolarHBondContact O-N 2.72Å; Y243-R245 VanDerWaalsContact O-N 3.1Å; R245-I247 HydrophobicContact CB-CD1 4.04Å; R245-I247 HydrophobicContact CB-CG1 4.17Å; R245-I247 PolarHBondContact O-N 3.29Å |
| 246 | G | 94.8 | Very high | 95.8 | Very high | 39 Ų | 39 | 82 Ų | 82 | 40% | 0.402 | 39% | 0.39 | S | S | . | . | T | Hydrogen-bonded Turn | trans | 62.1 | 23.4 | -178 | 0 | 0 | 0 | 0 | 0 | 114.5 | Y242 Y243 T261 | Y242-G246 PolarHBondContact O-N 3.41Å; Y243-G246 PolarHBondContact O-N 3.27Å; G246-T261 VanDerWaalsContact C-OG1 3.3Å; G246-T261 WeakPolarHBondContact O-CB 3.39Å; G246-T261 PolarHBondContact O-OG1 3.1Å |
| 247 | I | 94.2 | Very high | 95.8 | Very high | 38 Ų | 38 | 82 Ų | 82 | 20% | 0.195 | 39% | 0.389 | C | S | . | . | S | Bend | trans | -91.2 | -37.5 | 178.8 | -64.4 | 170.2 | 0 | 0 | 0 | 110.7 | W182 Y242 R245 T261 | W182-I247 HydrophobicContact CB-CG2 4.03Å; W182-I247 HydrophobicContact CD2-CG2 4.25Å; W182-I247 HydrophobicContact CG-CG2 3.88Å; Y242-I247 HydrophobicContact CD1-CB 4.41Å; Y242-I247 HydrophobicContact CD1-CD1 4Å; Y242-I247 HydrophobicContact CE1-CD1 4.44Å; Y242-I247 HydrophobicContact CG-CB 4.42Å; Y242-I247 HydrophobicContact CG-CG2 4.44Å; Y242-I247 PolarHBondContact O-N 3.38Å; R245-I247 HydrophobicContact CB-CD1 4.04Å; R245-I247 HydrophobicContact CB-CG1 4.17Å; R245-I247 PolarHBondContact O-N 3.29Å; I247-T261 PolarHBondContact O-N 3.4Å |
| 248 | L | 96.2 | Very high | 95.7 | Very high | 0 Ų | 0 | 75 Ų | 75 | 0% | 0 | 36% | 0.363 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -130.2 | 140.4 | 173 | -68.7 | 179.8 | 0 | 0 | 0 | 109.3 | F209 L239 Y242 Y243 Q259 F260 | F209-L248 HydrophobicContact CE1-CD2 3.7Å; F209-L248 HydrophobicContact CZ-CD1 4.32Å; F209-L248 HydrophobicContact CZ-CD2 3.83Å; L239-L248 HydrophobicContact CD2-CD1 3.66Å; Y242-L248 HydrophobicContact CD2-CD1 3.87Å; Y242-L248 HydrophobicContact CD2-CG 4.38Å; Y242-L248 HydrophobicContact CG-CD1 4.46Å; Y242-L248 PolarHBondContact O-N 3.03Å; Y243-L248 VanDerWaalsContact CA-O 3.23Å; Y243-L248 WeakPolarHBondContact CA-O 3.47Å; Y243-L248 HydrophobicContact CD1-CB 4.47Å; Y243-L248 WeakPolarHBondContact CD1-O 3.38Å; L248-Q259 CarbonylContact C-O 3.56Å; L248-Q259 WeakPolarHBondContact CA-O 3.32Å; L248-F260 HydrophobicContact CD2-CD1 3.38Å; L248-F260 HydrophobicContact CD2-CD2 4.43Å; L248-F260 HydrophobicContact CD2-CE1 3.57Å; L248-F260 HydrophobicContact CD2-CG 3.85Å; L248-F260 HydrophobicContact CD2-CZ 4.18Å |
| 249 | N | 96.5 | Very high | 95.7 | Very high | 63 Ų | 63 | 76.3 Ų | 76.3 | 34% | 0.337 | 36% | 0.364 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -96.6 | 146.4 | 163.3 | -60.5 | -34.6 | 0 | 0 | 0 | 110.1 | Y258 Q259 | N249-Y258 WeakPolarHBondContact O-CA 3.5Å; N249-Q259 HydrophobicContact CB-CB 4.27Å; N249-Q259 PolarHBondContact N-O 3.43Å; N249-Q259 PolarHBondContact O-N 3.34Å |
| 250 | K | 95.4 | Very high | 95.7 | Very high | 93 Ų | 93 | 76.6 Ų | 76.6 | 40% | 0.404 | 37% | 0.365 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -79.1 | 129 | 167.4 | 176.1 | -175.5 | 165.8 | -66.3 | 0 | 108.2 | Y243 E252 | Y243-K250 HydrophobicContact CD1-CB 4.39Å; Y243-K250 HydrophobicContact CD2-CB 4.38Å; Y243-K250 HydrophobicContact CE1-CB 3.96Å; Y243-K250 HydrophobicContact CE2-CB 3.94Å; Y243-K250 HydrophobicContact CE2-CD 4.27Å; Y243-K250 HydrophobicContact CE2-CG 4.48Å; K250-E252 IonicContact NZ-OE1 2.97Å; K250-E252 PolarHBondContact NZ-OE1 3.46Å; K250-E252 IonicContact NZ-OE2 2.67Å; K250-E252 PolarHBondContact NZ-OE2 3.1Å |
| 251 | V | 96.1 | Very high | 95.4 | Very high | 25 Ų | 25 | 74.9 Ų | 74.9 | 15% | 0.152 | 37% | 0.367 | C | S | . | . | P | Polyproline II helix | trans | -78 | 126 | 167.6 | 179.5 | 0 | 0 | 0 | 0 | 108.6 | I208 Q254 V257 Q259 | I208-V251 HydrophobicContact CG2-CG2 4.13Å; V251-Q254 HydrophobicContact CG1-CB 4.06Å; V251-Q254 HydrophobicContact CG1-CG 4.16Å; V251-V257 HydrophobicContact CB-CB 4.18Å; V251-V257 HydrophobicContact CB-CG1 3.94Å; V251-V257 HydrophobicContact CG1-CG1 4.26Å; V251-V257 HydrophobicContact CG2-CG1 3.8Å; V251-V257 PolarHBondContact N-O 3.25Å; V251-Q259 HydrophobicContact CG2-CB 4.42Å |
| 252 | E | 94.8 | Very high | 94.9 | Very high | 140 Ų | 140 | 72.5 Ų | 72.5 | 65% | 0.654 | 37% | 0.372 | S | S | * | . | S | Bend | trans | -69.6 | 151.9 | 174.9 | -68.2 | -59.6 | 128.5 | 0 | 0 | 111 | K250 Q254 | K250-E252 IonicContact NZ-OE1 2.97Å; K250-E252 PolarHBondContact NZ-OE1 3.46Å; K250-E252 IonicContact NZ-OE2 2.67Å; K250-E252 PolarHBondContact NZ-OE2 3.1Å; E252-Q254 PolarHBondContact O-N 3.31Å |
| 253 | G | 94.5 | Very high | 94.2 | Very high | 84 Ų | 84 | 73.3 Ų | 73.3 | 87% | 0.866 | 38% | 0.377 | S | S | * | . | S | Bend | trans | 68.6 | -33 | -175.9 | 0 | 0 | 0 | 0 | 0 | 116.6 | ||
| 254 | Q | 95.4 | Very high | 93.2 | Very high | 102 Ų | 102 | 73.3 Ų | 73.3 | 48% | 0.477 | 39% | 0.386 | S | S | . | . | trans | -97.2 | 122 | -172.4 | -61.2 | -162.3 | 47.5 | 0 | 0 | 113.8 | V251 E252 V257 | V251-Q254 HydrophobicContact CG1-CB 4.06Å; V251-Q254 HydrophobicContact CG1-CG 4.16Å; E252-Q254 PolarHBondContact O-N 3.31Å; Q254-V257 HydrophobicContact CB-CB 3.78Å; Q254-V257 HydrophobicContact CB-CG1 4.47Å; Q254-V257 HydrophobicContact CB-CG2 3.73Å | ||
| 255 | R | 95.9 | Very high | 91.6 | Very high | 224 Ų | 224 | 71.9 Ų | 71.9 | 85% | 0.845 | 39% | 0.388 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -74.8 | 135.9 | 175.4 | -67 | -174.5 | 177.5 | -166.8 | -0.1 | 111.7 | V257 | R255-V257 PolarHBondContact O-N 2.99Š|
| 256 | L | 96.4 | Very high | 90 | Very high | 48 Ų | 48 | 70.5 Ų | 70.5 | 25% | 0.251 | 39% | 0.393 | S | S | . | . | T | Hydrogen-bonded Turn | trans | 61.4 | 22 | 179.2 | -55 | 175.9 | 0 | 0 | 0 | 114.6 | K210 L211 Y232 Y258 | K210-L256 WeakPolarHBondContact CA-O 3.36Å; L211-L256 HydrophobicContact CB-CB 4.22Å; L211-L256 PolarHBondContact N-O 3.47Å; Y232-L256 HydrophobicContact CE1-CD2 4.13Å; Y232-L256 HydrophobicContact CE2-CD2 3.73Å; Y232-L256 WeakPolarHBondContact OH-CD2 3.23Å; L256-Y258 VanDerWaalsContact C-CE2 3.4Å; L256-Y258 WeakPolarHBondContact O-CE2 3.41Å |
| 257 | V | 96.6 | Very high | 88.6 | Confident | 2 Ų | 2 | 69.3 Ų | 69.3 | 1% | 0.012 | 38% | 0.378 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -110.7 | 135.7 | 176.5 | -174.8 | 0 | 0 | 0 | 0 | 110.1 | I208 F209 K210 V251 Q254 R255 | I208-V257 HydrophobicContact CG2-CG1 3.49Å; I208-V257 VanDerWaalsContact CG2-CG1 3.49Å; F209-V257 WeakPolarHBondContact O-CA 3.41Å; K210-V257 HydrophobicContact CB-CG2 4Å; K210-V257 HydrophobicContact CD-CG2 3.76Å; K210-V257 HydrophobicContact CG-CG2 3.74Å; V251-V257 HydrophobicContact CB-CB 4.18Å; V251-V257 HydrophobicContact CB-CG1 3.94Å; V251-V257 HydrophobicContact CG1-CG1 4.26Å; V251-V257 HydrophobicContact CG2-CG1 3.8Å; V251-V257 PolarHBondContact N-O 3.25Å; Q254-V257 HydrophobicContact CB-CB 3.78Å; Q254-V257 HydrophobicContact CB-CG1 4.47Å; Q254-V257 HydrophobicContact CB-CG2 3.73Å; R255-V257 PolarHBondContact O-N 2.99Å |
| 258 | Y | 96.9 | Very high | 87.2 | Confident | 8 Ų | 8 | 72 Ų | 72 | 3% | 0.031 | 40% | 0.396 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -140.8 | 159.1 | -173.9 | -51.8 | -91 | 0 | 0 | 0 | 108.9 | I208 F209 L211 Y232 L239 Y243 N249 L256 | I208-Y258 CarbonylContact C-O 3.59Å; I208-Y258 WeakPolarHBondContact CA-O 3.27Å; F209-Y258 HydrophobicContact CD2-CD2 4.44Å; F209-Y258 AromaticContact CE2-CD2 3.9Å; F209-Y258 HydrophobicContact CE2-CD2 3.9Å; F209-Y258 HydrophobicContact CE2-CG 4.23Å; F209-Y258 HydrophobicContact CZ-CD2 4.32Å; F209-Y258 HydrophobicContact CZ-CG 4.18Å; F209-Y258 PolarHBondContact N-O 3.38Å; F209-Y258 PolarHBondContact O-N 2.94Å; L211-Y258 HydrophobicContact CD1-CD2 3.98Å; L211-Y258 HydrophobicContact CD1-CE2 3.9Å; Y232-Y258 PolarHBondContact OH-OH 2.97Å; L239-Y258 HydrophobicContact CB-CE1 4.33Å; L239-Y258 HydrophobicContact CD1-CE1 3.95Å; L239-Y258 HydrophobicContact CD1-CE2 4.32Å; Y243-Y258 HydrophobicContact CE1-CD1 4.15Å; Y243-Y258 HydrophobicContact CE1-CE1 4.35Å; Y243-Y258 WeakPolarHBondContact OH-CE1 3.49Å; N249-Y258 WeakPolarHBondContact O-CA 3.5Å; L256-Y258 VanDerWaalsContact C-CE2 3.4Å; L256-Y258 WeakPolarHBondContact O-CE2 3.41Å |
| 259 | Q | 96.1 | Very high | 85.7 | Confident | 57 Ų | 57 | 74.8 Ų | 74.8 | 27% | 0.266 | 41% | 0.407 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -125.4 | 137.2 | 175.5 | -174.4 | -174.8 | 28 | 0 | 0 | 109.5 | A206 G207 I208 L248 N249 V251 | A206-Q259 VanDerWaalsContact O-CG 3.24Å; A206-Q259 WeakPolarHBondContact O-CG 3.48Å; A206-Q259 PolarHBondContact O-NE2 3.5Å; G207-Q259 CarbonylContact O-C 3.55Å; G207-Q259 WeakPolarHBondContact O-CA 3.22Å; I208-Q259 HydrophobicContact CG1-CB 4.12Å; I208-Q259 HydrophobicContact CG1-CG 3.85Å; L248-Q259 CarbonylContact C-O 3.56Å; L248-Q259 WeakPolarHBondContact CA-O 3.32Å; N249-Q259 HydrophobicContact CB-CB 4.27Å; N249-Q259 PolarHBondContact N-O 3.43Å; N249-Q259 PolarHBondContact O-N 3.34Å; V251-Q259 HydrophobicContact CG2-CB 4.42Å |
| 260 | F | 95.3 | Very high | 84.1 | Confident | 7 Ų | 7 | 73 Ų | 73 | 3% | 0.031 | 40% | 0.397 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -78.2 | 127.9 | 165.4 | -73.4 | -78.7 | 0 | 0 | 0 | 110.1 | W182 M186 L189 W201 G207 F209 L248 S262 L263 | W182-F260 HydrophobicContact CB-CE1 4.38Å; M186-F260 HydrophobicContact CB-CZ 4.29Å; M186-F260 HydrophobicContact CE-CD1 3.51Å; M186-F260 HydrophobicContact CE-CD2 3.84Å; M186-F260 HydrophobicContact CE-CE1 3.43Å; M186-F260 VanDerWaalsContact CE-CE1 3.43Å; M186-F260 HydrophobicContact CE-CE2 3.76Å; M186-F260 HydrophobicContact CE-CG 3.72Å; M186-F260 HydrophobicContact CE-CZ 3.56Å; M186-F260 HydrophobicContact SD-CD2 4.06Å; M186-F260 HydrophobicContact SD-CE1 4.25Å; M186-F260 HydrophobicContact SD-CE2 3.63Å; M186-F260 HydrophobicContact SD-CZ 3.74Å; L189-F260 HydrophobicContact CD1-CE2 4.04Å; W201-F260 AromaticContact CH2-CD2 3.87Å; W201-F260 HydrophobicContact CH2-CD2 3.87Å; W201-F260 AromaticContact CH2-CE2 3.94Å; W201-F260 HydrophobicContact CH2-CE2 3.94Å; W201-F260 HydrophobicContact CZ3-CD2 4.15Å; W201-F260 HydrophobicContact CZ3-CE2 4.45Å; G207-F260 PolarHBondContact O-N 2.83Å; F209-F260 AromaticContact CD1-CD2 3.58Å; F209-F260 HydrophobicContact CD1-CD2 3.58Å; F209-F260 AromaticContact CD1-CE2 3.47Å; F209-F260 HydrophobicContact CD1-CE2 3.47Å; F209-F260 VanDerWaalsContact CD1-CE2 3.47Å; F209-F260 HydrophobicContact CD1-CZ 4.41Å; F209-F260 AromaticContact CE1-CD2 3.39Å; F209-F260 HydrophobicContact CE1-CD2 3.39Å; F209-F260 HydrophobicContact CE1-CE1 4.4Å; F209-F260 AromaticContact CE1-CE2 3.19Å; F209-F260 HydrophobicContact CE1-CE2 3.19Å; F209-F260 HydrophobicContact CE1-CG 4.1Å; F209-F260 AromaticContact CE1-CZ 3.75Å; F209-F260 HydrophobicContact CE1-CZ 3.75Å; F209-F260 HydrophobicContact CG-CE2 4.38Å; F209-F260 HydrophobicContact CZ-CD2 4.47Å; F209-F260 AromaticContact CZ-CE2 3.92Å; F209-F260 HydrophobicContact CZ-CE2 3.92Å; F209-F260 HydrophobicContact CZ-CZ 4.08Å; L248-F260 HydrophobicContact CD2-CD1 3.38Å; L248-F260 HydrophobicContact CD2-CD2 4.43Å; L248-F260 HydrophobicContact CD2-CE1 3.57Å; L248-F260 HydrophobicContact CD2-CG 3.85Å; L248-F260 HydrophobicContact CD2-CZ 4.18Å; F260-S262 PolarHBondContact O-N 3Å; F260-L263 HydrophobicContact CB-CD2 3.67Å; F260-L263 HydrophobicContact CB-CG 4.4Å; F260-L263 HydrophobicContact CD2-CD2 3.92Å; F260-L263 HydrophobicContact CG-CD2 4.05Å |
| 261 | T | 91.9 | Very high | 82.3 | Confident | 72 Ų | 72 | 72.4 Ų | 72.4 | 44% | 0.442 | 40% | 0.401 | S | S | . | . | S | Bend | trans | -67.6 | -24.7 | 178.9 | -38.8 | 0 | 0 | 0 | 0 | 112.7 | G246 I247 | G246-T261 VanDerWaalsContact C-OG1 3.3Å; G246-T261 WeakPolarHBondContact O-CB 3.39Å; G246-T261 PolarHBondContact O-OG1 3.1Å; I247-T261 PolarHBondContact O-N 3.4Å |
| 262 | S | 85.3 | Confident | 80.5 | Confident | 99 Ų | 99 | 77.8 Ų | 77.8 | 69% | 0.692 | 43% | 0.429 | S | S | * | . | S | Bend | trans | -148.5 | 127.2 | 174.6 | -178.2 | 0 | 0 | 0 | 0 | 109 | F260 | F260-S262 PolarHBondContact O-N 3Š|
| 263 | L | 81.3 | Confident | 78.5 | Confident | 33 Ų | 33 | 74.4 Ų | 74.4 | 17% | 0.173 | 43% | 0.432 | C | S | . | . | trans | -97.4 | 142.8 | 173.3 | -62.1 | 168.5 | 0 | 0 | 0 | 109.3 | M186 W201 P204 F260 V265 Y269 | M186-L263 HydrophobicContact CE-CD2 4.24Å; M186-L263 HydrophobicContact SD-CD2 4.44Å; W201-L263 HydrophobicContact CH2-CD2 3.95Å; W201-L263 HydrophobicContact CZ3-CD2 4.35Å; P204-L263 WeakPolarHBondContact O-CD1 3.28Å; F260-L263 HydrophobicContact CB-CD2 3.67Å; F260-L263 HydrophobicContact CB-CG 4.4Å; F260-L263 HydrophobicContact CD2-CD2 3.92Å; F260-L263 HydrophobicContact CG-CD2 4.05Å; L263-V265 PolarHBondContact O-N 2.99Å; L263-Y269 HydrophobicContact CD1-CE1 4.28Å; L263-Y269 WeakPolarHBondContact CD1-OH 3.05Å | ||
| 264 | P | 75.1 | Confident | 76.1 | Confident | 70 Ų | 70 | 76.2 Ų | 76.2 | 46% | 0.455 | 42% | 0.422 | S | S | . | . | trans | -61.7 | 130.2 | 166.9 | -19.3 | 32.2 | 0 | 0 | 0 | 110.4 | N266 M267 | P264-N266 PolarHBondContact O-N 3.4Å; P264-M267 WeakPolarHBondContact O-CB 3.44Å; P264-M267 PolarHBondContact O-N 2.94Å | ||
| 265 | V | 61.4 | Low | 73.3 | Confident | 141 Ų | 141 | 77.7 Ų | 77.7 | 86% | 0.855 | 44% | 0.442 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -55.6 | -27.6 | -176.5 | -174.3 | 0 | 0 | 0 | 0 | 113.1 | L263 M267 | L263-V265 PolarHBondContact O-N 2.99Å; V265-M267 PolarHBondContact O-N 3.16Å |
| 266 | N | 60.3 | Low | 70.7 | Confident | 135 Ų | 135 | 69.8 Ų | 69.8 | 72% | 0.722 | 43% | 0.43 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -93.6 | 20.6 | -177.9 | -58.3 | -2.3 | 0 | 0 | 0 | 113.4 | P264 V268 | P264-N266 PolarHBondContact O-N 3.4Å; N266-V268 PolarHBondContact O-N 2.72Å |
| 267 | M | 65.6 | Low | 68.4 | Low | 14 Ų | 14 | 76.9 Ų | 76.9 | 7% | 0.069 | 46% | 0.459 | C | S | . | . | trans | -72.8 | 116.6 | 179.2 | -174.7 | 155.4 | -146.7 | 0 | 0 | 111.2 | M186 L189 Q190 W201 P264 V265 Y269 | M186-M267 HydrophobicContact CG-CE 3.68Å; M186-M267 HydrophobicContact CG-SD 4.2Å; M186-M267 HydrophobicContact SD-CE 3.53Å; M186-M267 VanDerWaalsContact SD-CE 3.53Å; M186-M267 HydrophobicContact SD-SD 3.48Å; L189-M267 HydrophobicContact CB-CE 4.38Å; Q190-M267 HydrophobicContact CG-CE 3.54Å; W201-M267 HydrophobicContact CH2-CE 4.45Å; W201-M267 HydrophobicContact CH2-SD 4.09Å; W201-M267 HydrophobicContact CZ2-CE 3.61Å; W201-M267 HydrophobicContact CZ2-SD 3.64Å; P264-M267 WeakPolarHBondContact O-CB 3.44Å; P264-M267 PolarHBondContact O-N 2.94Å; V265-M267 PolarHBondContact O-N 3.16Å; M267-Y269 HydrophobicContact CB-CE1 3.93Å; M267-Y269 HydrophobicContact CG-CD1 4.01Å; M267-Y269 HydrophobicContact CG-CE1 3.63Å; M267-Y269 PolarHBondContact O-N 2.72Å; M267-Y269 VanDerWaalsContact O-N 3.08Å; M267-Y269 HydrophobicContact SD-CD1 4.47Å; M267-Y269 HydrophobicContact SD-CE1 3.88Å | ||
| 268 | V | 64.1 | Low | 65.9 | Low | 96 Ų | 96 | 85.7 Ų | 85.7 | 58% | 0.582 | 50% | 0.5 | S | S | * | . | trans | -73.8 | 99.1 | 172.5 | -179.2 | 0 | 0 | 0 | 0 | 108.6 | N266 | N266-V268 PolarHBondContact O-N 2.72Š| ||
| 269 | Y | 63.9 | Low | 63.5 | Low | 58 Ų | 58 | 94.5 Ų | 94.5 | 23% | 0.227 | 54% | 0.541 | C | S | . | . | trans | -71.2 | 136.8 | 172.1 | -55.5 | -62.5 | 0 | 0 | 0 | 110.3 | P204 L263 M267 | P204-Y269 HydrophobicContact CB-CD1 3.53Å; P204-Y269 HydrophobicContact CB-CD2 4.34Å; P204-Y269 HydrophobicContact CB-CE1 4.14Å; P204-Y269 HydrophobicContact CB-CG 3.66Å; P204-Y269 WeakPolarHBondContact O-CE1 3.45Å; L263-Y269 HydrophobicContact CD1-CE1 4.28Å; L263-Y269 WeakPolarHBondContact CD1-OH 3.05Å; M267-Y269 HydrophobicContact CB-CE1 3.93Å; M267-Y269 HydrophobicContact CG-CD1 4.01Å; M267-Y269 HydrophobicContact CG-CE1 3.63Å; M267-Y269 PolarHBondContact O-N 2.72Å; M267-Y269 VanDerWaalsContact O-N 3.08Å; M267-Y269 HydrophobicContact SD-CD1 4.47Å; M267-Y269 HydrophobicContact SD-CE1 3.88Å | ||
| 270 | I | 63.3 | Low | 61.6 | Low | 25 Ų | 25 | 99.7 Ų | 99.7 | 13% | 0.128 | 57% | 0.566 | C | S | . | * | trans | -115.9 | 95.5 | -179.7 | -62.6 | 139.9 | 0 | 0 | 0 | 105.8 | Q190 R192 | Q190-I270 WeakPolarHBondContact O-CD1 3.33Å; R192-I270 HydrophobicContact CB-CG2 4.4Å; R192-I270 HydrophobicContact CG-CB 4.38Å; R192-I270 HydrophobicContact CG-CD1 3.79Å; R192-I270 HydrophobicContact CG-CG1 3.82Å; R192-I270 HydrophobicContact CG-CG2 3.7Å | ||
| 271 | T | 57.3 | Low | 59.4 | Low | 81 Ų | 81 | 106.3 Ų | 106.3 | 50% | 0.497 | 60% | 0.602 | S | S | . | * | trans | -95.2 | 131.3 | 170.7 | 44 | 0 | 0 | 0 | 0 | 108.7 | P204 G273 | P204-T271 HydrophobicContact CG-CG2 4.06Å; T271-G273 PolarHBondContact O-N 3.34Å | ||
| 272 | D | 58.8 | Low | 57.1 | Low | 137 Ų | 137 | 110.4 Ų | 110.4 | 73% | 0.733 | 62% | 0.621 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -70.3 | 24.6 | 179.7 | -50.5 | -64.4 | 0 | 0 | 0 | 113.8 | ||
| 273 | G | 53 | Low | 55.2 | Low | 70 Ų | 70 | 112.9 Ų | 112.9 | 72% | 0.722 | 63% | 0.626 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -111.7 | 0.2 | -178.8 | 0 | 0 | 0 | 0 | 0 | 114.6 | T271 | T271-G273 PolarHBondContact O-N 3.34Š|
| 274 | D | 43.7 | Very low | 53.9 | Low | 122 Ų | 122 | 118.2 Ų | 118.2 | 65% | 0.652 | 65% | 0.653 | S | S | * | * | trans | -103.7 | 72.4 | 176.1 | -169.4 | 28.6 | 0 | 0 | 0 | 110.2 | ||||
| 275 | C | 37.6 | Very low | 52.2 | Low | 133 Ų | 133 | 122.5 Ų | 122.5 | 90% | 0.899 | 67% | 0.673 | S | S | * | * | trans | -135.6 | 63 | 167.8 | -171.3 | 0 | 0 | 0 | 0 | 106.3 | ||||
| 276 | G | 41.8 | Very low | 51.7 | Low | 58 Ų | 58 | 124.8 Ų | 124.8 | 60% | 0.598 | 67% | 0.671 | S | S | * | * | trans | -131.4 | 86.6 | -162.4 | 0 | 0 | 0 | 0 | 0 | 113.4 | ||||
| 277 | K | 47.5 | Very low | 50.9 | Low | 196 Ų | 196 | 124.2 Ų | 124.2 | 85% | 0.852 | 68% | 0.678 | S | S | * | * | trans | 66 | 83.8 | 164.4 | -56.3 | -171.6 | 171.3 | -156.3 | 0 | 117.1 | ||||
| 278 | E | 44.1 | Very low | 49.4 | Very low | 188 Ų | 188 | 127.1 Ų | 127.1 | 88% | 0.879 | 71% | 0.711 | S | S | * | * | trans | -123.7 | 126.4 | 145.9 | -65.9 | 171.1 | -163.2 | 0 | 0 | 103.6 | ||||
| 279 | E | 46.3 | Very low | 48.3 | Very low | 192 Ų | 192 | 130.2 Ų | 130.2 | 90% | 0.897 | 72% | 0.724 | S | S | * | * | cis | -138.3 | 160.2 | 5.7 | -59.1 | 173.8 | 133 | 0 | 0 | 109.9 | ||||
| 280 | E | 56.4 | Low | 47 | Very low | 166 Ų | 166 | 134.7 Ų | 134.7 | 78% | 0.776 | 75% | 0.752 | S | S | * | * | trans | -139.8 | 143.7 | 171.4 | -162.4 | 164.6 | -145.8 | 0 | 0 | 106 | ||||
| 281 | D | 47.8 | Very low | 46.2 | Very low | 147 Ų | 147 | 141.6 Ų | 141.6 | 79% | 0.786 | 78% | 0.784 | S | S | * | * | trans | 65.3 | 159.2 | -169.3 | -50.9 | -36.6 | 0 | 0 | 0 | 116 | ||||
| 282 | D | 45.5 | Very low | 45.2 | Very low | 157 Ų | 157 | 141.1 Ų | 141.1 | 84% | 0.84 | 80% | 0.795 | S | S | * | * | cis | -83.1 | -157.3 | -14.6 | -60.6 | -74.1 | 0 | 0 | 0 | 110 | ||||
| 283 | D | 44.8 | Very low | 44.5 | Very low | 152 Ų | 152 | 142.5 Ų | 142.5 | 81% | 0.813 | 80% | 0.801 | S | S | * | * | cis | -154.6 | -174.5 | 1 | -160 | -5.4 | 0 | 0 | 0 | 109.6 | ||||
| 284 | I | 53.1 | Low | 43.9 | Very low | 145 Ų | 145 | 144.8 Ų | 144.8 | 74% | 0.744 | 81% | 0.806 | S | S | * | * | trans | -120.1 | 147 | -177.9 | -76.5 | 166.3 | 0 | 0 | 0 | 111.7 | ||||
| 285 | D | 40.6 | Very low | 43.5 | Very low | 160 Ų | 160 | 146.1 Ų | 146.1 | 86% | 0.856 | 81% | 0.814 | S | S | * | * | trans | -144.8 | 153.9 | 141 | -152.4 | -11.5 | 0 | 0 | 0 | 112.1 | ||||
| 286 | K | 49.4 | Very low | 43.4 | Very low | 189 Ų | 189 | 142.6 Ų | 142.6 | 82% | 0.822 | 80% | 0.8 | S | S | * | * | trans | -157.7 | 86.5 | -167.4 | -173 | -160.9 | 177.5 | -178 | 0 | 113.3 | ||||
| 287 | S | 43.6 | Very low | 43.2 | Very low | 123 Ų | 123 | 145.3 Ų | 145.3 | 86% | 0.86 | 81% | 0.805 | S | S | * | * | trans | -164.2 | 159.4 | 153.9 | 63.7 | 0 | 0 | 0 | 0 | 112.7 | ||||
| 288 | G | 35.7 | Very low | 42.7 | Very low | 74 Ų | 74 | 143.6 Ų | 143.6 | 76% | 0.763 | 80% | 0.803 | S | S | * | * | trans | 135.5 | 101.2 | 168.7 | 0 | 0 | 0 | 0 | 0 | 114.6 | ||||
| 289 | N | 39.3 | Very low | 42.4 | Very low | 161 Ų | 161 | 138.9 Ų | 138.9 | 86% | 0.861 | 79% | 0.791 | S | S | * | * | trans | -81.8 | 148.2 | 163.1 | -62.2 | 4.3 | 0 | 0 | 0 | 109.3 | ||||
| 290 | D | 37.1 | Very low | 42.1 | Very low | 152 Ų | 152 | 134.3 Ų | 134.3 | 81% | 0.813 | 78% | 0.78 | S | S | * | * | -159.2 | 153.8 | 118.8 | -153.9 | 25.6 | 0 | 0 | 0 | 112.9 | |||||
| 291 | E | 47.1 | Very low | 41 | Very low | 171 Ų | 171 | 132.5 Ų | 132.5 | 80% | 0.799 | 78% | 0.776 | S | S | * | * | trans | -54.9 | 153.4 | -177.3 | -55 | -70.9 | 133.2 | 0 | 0 | 116 | ||||
| 292 | G | 36.8 | Very low | 40.4 | Very low | 71 Ų | 71 | 133.8 Ų | 133.8 | 73% | 0.732 | 78% | 0.777 | S | S | * | * | trans | -157.5 | 1.3 | -169.9 | 0 | 0 | 0 | 0 | 0 | 123.5 | ||||
| 293 | L | 43.5 | Very low | 40 | Very low | 166 Ų | 166 | 131.2 Ų | 131.2 | 87% | 0.869 | 77% | 0.771 | S | S | * | * | trans | 57.3 | 118.7 | 163.8 | -62.9 | 168.2 | 0 | 0 | 0 | 122.2 | ||||
| 294 | S | 39.9 | Very low | 39.6 | Very low | 118 Ų | 118 | 126.4 Ų | 126.4 | 83% | 0.825 | 75% | 0.753 | S | S | * | * | trans | 61.2 | 151.6 | 147.9 | 58.5 | 0 | 0 | 0 | 0 | 119.9 | ||||
| 295 | D | 35.3 | Very low | 38.6 | Very low | 150 Ų | 150 | 127.8 Ų | 127.8 | 80% | 0.802 | 76% | 0.756 | S | S | * | * | cis | -137.7 | 147 | 5.5 | -166.2 | 30.4 | 0 | 0 | 0 | 108.1 | ||||
| 296 | G | 35.1 | Very low | 38.3 | Very low | 59 Ų | 59 | 129.3 Ų | 129.3 | 61% | 0.608 | 75% | 0.751 | S | S | * | * | 66.3 | 129.7 | 90.6 | 0 | 0 | 0 | 0 | 0 | 113.5 | |||||
| 297 | T | 37.8 | Very low | 37.7 | Very low | 114 Ų | 114 | 128.7 Ų | 128.7 | 70% | 0.699 | 75% | 0.751 | S | S | * | * | cis | -172.3 | 131.9 | 18.4 | -78.9 | 0 | 0 | 0 | 0 | 111 | ||||
| 298 | I | 36.9 | Very low | 37.2 | Very low | 160 Ų | 160 | 131.8 Ų | 131.8 | 82% | 0.821 | 75% | 0.752 | S | S | * | * | trans | 60.1 | 156.5 | 154.4 | -130.4 | 122.6 | 0 | 0 | 0 | 118.5 | ||||
| 299 | S | 37.8 | Very low | 37.3 | Very low | 89 Ų | 89 | 132.1 Ų | 132.1 | 62% | 0.622 | 75% | 0.748 | S | S | * | * | cis | -151.3 | 169 | -1 | -150.4 | 0 | 0 | 0 | 0 | 112.3 | ||||
| 300 | S | 40.3 | Very low | 37 | Very low | 97 Ų | 97 | 131.8 Ų | 131.8 | 68% | 0.678 | 75% | 0.746 | S | S | * | * | trans | 8.5 | 130.3 | 145.1 | -40.7 | 0 | 0 | 0 | 0 | 119 | ||||
| 301 | D | 33.1 | Very low | 37 | Very low | 127 Ų | 127 | 133.3 Ų | 133.3 | 68% | 0.679 | 75% | 0.748 | S | S | * | * | 61.4 | 108.9 | 59.7 | -167.3 | -64.8 | 0 | 0 | 0 | 113.5 | |||||
| 302 | Q | 36.3 | Very low | 36.5 | Very low | 174 Ų | 174 | 129.3 Ų | 129.3 | 81% | 0.813 | 75% | 0.745 | S | S | * | * | trans | -156.8 | 167.9 | 131.4 | -138.3 | 79.3 | 111 | 0 | 0 | 110.8 | ||||
| 303 | S | 36.1 | Very low | 36.6 | Very low | 103 Ų | 103 | 134.4 Ų | 134.4 | 72% | 0.72 | 75% | 0.749 | S | S | * | * | trans | -131.3 | -169.2 | -162.2 | 55.8 | 0 | 0 | 0 | 0 | 112.8 | ||||
| 304 | A | 36.2 | Very low | 36.3 | Very low | 51 Ų | 51 | 134.8 Ų | 134.8 | 42% | 0.421 | 75% | 0.747 | S | S | . | * | trans | 90.4 | 104.9 | 164.8 | 0 | 0 | 0 | 0 | 0 | 119.1 | Y306 | A304-Y306 WeakPolarHBondContact O-CE1 3.49Å; A304-Y306 PolarHBondContact O-OH 3.06Å | ||
| 305 | E | 33.1 | Very low | 36.4 | Very low | 175 Ų | 175 | 137.2 Ų | 137.2 | 82% | 0.818 | 75% | 0.745 | S | S | * | * | trans | 64.1 | 177.1 | 133.9 | -71.4 | 148 | 144.4 | 0 | 0 | 117.3 | ||||
| 306 | Y | 33.1 | Very low | 36.5 | Very low | 192 Ų | 192 | 138.3 Ų | 138.3 | 75% | 0.753 | 75% | 0.745 | S | S | * | * | cis | -158.4 | 166.8 | 28.5 | -10.9 | -96.7 | 0 | 0 | 0 | 110.8 | A304 | A304-Y306 WeakPolarHBondContact O-CE1 3.49Å; A304-Y306 PolarHBondContact O-OH 3.06Å | ||
| 307 | E | 38.2 | Very low | 36.6 | Very low | 176 Ų | 176 | 143.4 Ų | 143.4 | 82% | 0.822 | 76% | 0.758 | S | S | * | * | trans | 24.2 | 128.6 | 159.7 | -37.9 | -65.7 | 93.2 | 0 | 0 | 119.8 | ||||
| 308 | E | 33.8 | Very low | 37.2 | Very low | 188 Ų | 188 | 144.9 Ų | 144.9 | 88% | 0.879 | 76% | 0.758 | S | S | * | * | cis | 86 | 138 | 40.6 | -163.3 | 159.3 | 165.8 | 0 | 0 | 116.4 | ||||
| 309 | A | 36.9 | Very low | 37.4 | Very low | 81 Ų | 81 | 145.8 Ų | 145.8 | 67% | 0.669 | 76% | 0.758 | S | S | * | * | trans | 79 | 121.3 | 167.9 | 0 | 0 | 0 | 0 | 0 | 122.6 | ||||
| 310 | D | 32.6 | Very low | 37.1 | Very low | 153 Ų | 153 | 148.2 Ų | 148.2 | 82% | 0.818 | 76% | 0.764 | S | S | * | * | trans | 59.4 | 157.5 | 131.1 | -59.2 | -37.9 | 0 | 0 | 0 | 122.6 | ||||
| 311 | E | 36.8 | Very low | 36.8 | Very low | 184 Ų | 184 | 149.8 Ų | 149.8 | 86% | 0.86 | 76% | 0.759 | S | S | * | * | cis | -146.3 | -158.1 | 4 | -142.8 | -179.7 | -166.4 | 0 | 0 | 113.4 | ||||
| 312 | A | 37.4 | Very low | 36.8 | Very low | 88 Ų | 88 | 151.1 Ų | 151.1 | 73% | 0.727 | 76% | 0.761 | S | S | * | * | trans | -69.3 | -170.2 | -172.6 | 0 | 0 | 0 | 0 | 0 | 116 | ||||
| 313 | E | 37.7 | Very low | 37.4 | Very low | 177 Ų | 177 | 147.8 Ų | 147.8 | 83% | 0.827 | 76% | 0.755 | S | S | * | * | cis | -139.8 | -173.5 | 14.4 | -58.9 | -179.3 | 96.8 | 0 | 0 | 108.8 | ||||
| 314 | E | 37.6 | Very low | 38.1 | Very low | 174 Ų | 174 | 147.8 Ų | 147.8 | 81% | 0.813 | 75% | 0.752 | S | S | * | * | cis | -99.4 | -115.3 | -4.2 | -59 | 99.6 | 146.2 | 0 | 0 | 114.8 | ||||
| 315 | E | 41.8 | Very low | 38 | Very low | 169 Ų | 169 | 152 Ų | 152 | 79% | 0.79 | 77% | 0.767 | S | S | * | * | cis | -157.9 | 174.9 | 12.5 | -117.9 | -76.2 | 43.8 | 0 | 0 | 109.6 | ||||
| 316 | E | 38.6 | Very low | 38.2 | Very low | 174 Ų | 174 | 151.4 Ų | 151.4 | 81% | 0.813 | 76% | 0.762 | S | S | * | * | trans | -107 | 165.7 | -179 | -57.9 | -172.6 | 141 | 0 | 0 | 112.9 | ||||
| 317 | D | 36.9 | Very low | 38.3 | Very low | 165 Ų | 165 | 151 Ų | 151 | 88% | 0.882 | 76% | 0.764 | S | S | * | * | cis | -132.9 | 168.2 | 38.1 | -66.8 | -63.9 | 0 | 0 | 0 | 114.8 | ||||
| 318 | E | 50.2 | Low | 38 | Very low | 146 Ų | 146 | 149.5 Ų | 149.5 | 68% | 0.682 | 77% | 0.767 | S | S | * | * | trans | -103.3 | 179.4 | 167.5 | -112.5 | -148.1 | 79.1 | 0 | 0 | 112.2 | F321 | E318-F321 VanDerWaalsContact OE1-CE2 3.31Å; E318-F321 WeakPolarHBondContact OE1-CE2 3.47Å | ||
| 319 | E | 39.9 | Very low | 37.8 | Very low | 178 Ų | 178 | 145.3 Ų | 145.3 | 83% | 0.832 | 76% | 0.758 | S | S | * | * | cis | -93.3 | -167 | 16.4 | -56.5 | 179.3 | 117.6 | 0 | 0 | 112.8 | ||||
| 320 | D | 33.4 | Very low | 37.8 | Very low | 140 Ų | 140 | 148.8 Ų | 148.8 | 75% | 0.749 | 77% | 0.765 | S | S | * | * | cis | -153.2 | 163.8 | 18 | 178 | 34.1 | 0 | 0 | 0 | 112.8 | ||||
| 321 | F | 32.5 | Very low | 37.9 | Very low | 131 Ų | 131 | 147.8 Ų | 147.8 | 58% | 0.575 | 76% | 0.764 | S | S | * | * | trans | -108 | 156.1 | -169.9 | -80.1 | -126.9 | 0 | 0 | 0 | 111.6 | E318 | E318-F321 VanDerWaalsContact OE1-CE2 3.31Å; E318-F321 WeakPolarHBondContact OE1-CE2 3.47Å | ||
| 322 | Q | 33.5 | Very low | 37.7 | Very low | 154 Ų | 154 | 144 Ų | 144 | 72% | 0.72 | 76% | 0.758 | S | S | * | * | cis | -169.5 | 167.6 | -8.9 | -115.6 | -170.5 | 17.2 | 0 | 0 | 111.4 | ||||
| 323 | P | 49 | Very low | 38.5 | Very low | 105 Ų | 105 | 145.7 Ų | 145.7 | 68% | 0.682 | 76% | 0.761 | S | S | * | * | trans | -113.4 | -152.5 | 162.3 | 44.7 | -33.7 | 0 | 0 | 0 | 110.6 | ||||
| 324 | P | 51.4 | Low | 38.2 | Very low | 103 Ų | 103 | 149 Ų | 149 | 67% | 0.669 | 77% | 0.766 | S | S | * | * | cis | -136.6 | 145 | -16 | 37.6 | -18.1 | 0 | 0 | 0 | 117.6 | ||||
| 325 | L | 34.2 | Very low | 38 | Very low | 139 Ų | 139 | 144.9 Ų | 144.9 | 73% | 0.728 | 76% | 0.762 | S | S | * | * | trans | 53.5 | 135.5 | 134.6 | -66.2 | 169.6 | 0 | 0 | 0 | 125.2 | ||||
| 326 | K | 35.6 | Very low | 37.6 | Very low | 163 Ų | 163 | 141.1 Ų | 141.1 | 71% | 0.709 | 76% | 0.76 | S | S | * | * | trans | 93.2 | 119.1 | 136.9 | -71.1 | 154.1 | -172.4 | 165.8 | 0 | 124.8 | ||||
| 327 | K | 35.5 | Very low | 37.3 | Very low | 184 Ų | 184 | 140 Ų | 140 | 80% | 0.8 | 76% | 0.764 | S | S | * | * | 87.2 | 153.2 | 126 | -72.9 | -179.1 | 174.7 | -174.4 | 0 | 124.8 | |||||
| 328 | T | 33.1 | Very low | 37 | Very low | 143 Ų | 143 | 136.2 Ų | 136.2 | 88% | 0.877 | 76% | 0.756 | S | S | * | * | trans | 96.2 | 169.6 | 157.4 | 74.7 | 0 | 0 | 0 | 0 | 120.1 | ||||
| 329 | S | 29.3 | Very low | 36.2 | Very low | 100 Ų | 100 | 138 Ų | 138 | 70% | 0.699 | 76% | 0.764 | S | S | * | * | -161.1 | 175.6 | -96.4 | -166 | 0 | 0 | 0 | 0 | 114 | |||||
| 330 | L | 37.3 | Very low | 35.9 | Very low | 155 Ų | 155 | 139.5 Ų | 139.5 | 81% | 0.812 | 76% | 0.763 | S | S | * | * | trans | 75.1 | 154.8 | 166.5 | -53.3 | 130.9 | 0 | 0 | 0 | 116.5 | ||||
| 331 | V | 34.1 | Very low | 36.6 | Very low | 132 Ų | 132 | 139 Ų | 139 | 80% | 0.8 | 77% | 0.767 | S | S | * | * | cis | -158.6 | 166.9 | -7.8 | 115 | 0 | 0 | 0 | 0 | 112.4 | ||||
| 332 | S | 32.3 | Very low | 36.5 | Very low | 105 Ų | 105 | 142.9 Ų | 142.9 | 73% | 0.734 | 78% | 0.778 | S | S | * | * | trans | -98.1 | 177.5 | 179.3 | -41.1 | 0 | 0 | 0 | 0 | 115.4 | ||||
| 333 | P | 54.5 | Low | 36.8 | Very low | 123 Ų | 123 | 141 Ų | 141 | 80% | 0.799 | 78% | 0.779 | S | S | * | * | -150.2 | 162.2 | 117.4 | 37.3 | -20.5 | 0 | 0 | 0 | 118.5 | |||||
| 334 | R | 31.3 | Very low | 36 | Very low | 245 Ų | 245 | 141.4 Ų | 141.4 | 93% | 0.925 | 78% | 0.78 | S | S | * | * | trans | 9 | 154.2 | 149.6 | -90.3 | 178.1 | 154 | 160.7 | -8 | 121 | ||||
| 335 | A | 33.9 | Very low | 34.9 | Very low | 89 Ų | 89 | 141 Ų | 141 | 74% | 0.736 | 78% | 0.784 | S | S | * | * | cis | -175.6 | -179.1 | 14.5 | 0 | 0 | 0 | 0 | 0 | 109.3 | ||||
| 336 | A | 32.1 | Very low | 34.8 | Very low | 89 Ų | 89 | 144.4 Ų | 144.4 | 74% | 0.736 | 79% | 0.793 | S | S | * | * | cis | -176 | -168.3 | -27.8 | 0 | 0 | 0 | 0 | 0 | 109 | ||||
| 337 | V | 32.3 | Very low | 34.7 | Very low | 150 Ų | 150 | 145.4 Ų | 145.4 | 91% | 0.909 | 80% | 0.801 | S | S | * | * | trans | 72.6 | 118.8 | 173 | -173.5 | 0 | 0 | 0 | 0 | 115 | ||||
| 338 | A | 32.6 | Very low | 35 | Very low | 86 Ų | 86 | 142.7 Ų | 142.7 | 71% | 0.711 | 80% | 0.802 | S | S | * | * | cis | -151.7 | -146.9 | -4.3 | 0 | 0 | 0 | 0 | 0 | 109 | ||||
| 339 | Q | 32.5 | Very low | 35 | Very low | 183 Ų | 183 | 140 Ų | 140 | 86% | 0.855 | 80% | 0.795 | S | S | * | * | cis | -156.2 | -154 | 3.9 | -145.3 | -166 | 112.6 | 0 | 0 | 111.2 | ||||
| 340 | R | 32.8 | Very low | 35.2 | Very low | 211 Ų | 211 | 142.2 Ų | 142.2 | 80% | 0.796 | 79% | 0.794 | S | S | * | * | trans | -158.5 | 172.6 | 179.3 | -124.7 | -170.5 | 176.8 | -179.1 | 2.3 | 109.3 | ||||
| 341 | P | 47.8 | Very low | 35.1 | Very low | 128 Ų | 128 | 144.3 Ų | 144.3 | 83% | 0.831 | 79% | 0.791 | S | S | * | * | cis | -145.6 | -155.8 | 49.1 | 41.2 | -18.3 | 0 | 0 | 0 | 116 | ||||
| 342 | R | 32.1 | Very low | 35.1 | Very low | 213 Ų | 213 | 144 Ų | 144 | 80% | 0.804 | 79% | 0.785 | S | S | * | * | trans | -145 | 138.5 | -172.3 | -180 | -156.8 | -161.7 | -167.7 | 10.1 | 111.1 | ||||
| 343 | P | 40.1 | Very low | 35.3 | Very low | 114 Ų | 114 | 144.3 Ų | 144.3 | 74% | 0.74 | 78% | 0.783 | S | S | * | * | trans | -139.6 | 132.4 | 143.1 | 21.3 | 0 | 0 | 0 | 0 | 112.7 | ||||
| 344 | T | 30.9 | Very low | 34.3 | Very low | 115 Ų | 115 | 144.5 Ų | 144.5 | 71% | 0.706 | 78% | 0.781 | S | S | * | * | 76.3 | 99.4 | 71.2 | 64.9 | 0 | 0 | 0 | 0 | 118.9 | |||||
| 345 | A | 29.2 | Very low | 34.6 | Very low | 93 Ų | 93 | 140.1 Ų | 140.1 | 77% | 0.769 | 78% | 0.775 | S | S | * | * | 82.6 | 149.8 | 127 | 0 | 0 | 0 | 0 | 0 | 124.4 | |||||
| 346 | K | 30.7 | Very low | 34.8 | Very low | 211 Ų | 211 | 145.5 Ų | 145.5 | 92% | 0.917 | 78% | 0.776 | S | S | * | * | trans | 84.1 | 144.2 | 162.6 | -62.4 | -178.7 | 179.3 | 178.7 | 0 | 120 | ||||
| 347 | Q | 34.4 | Very low | 35.3 | Very low | 184 Ų | 184 | 146.8 Ų | 146.8 | 86% | 0.86 | 78% | 0.777 | S | S | * | * | trans | -94.6 | 172.3 | 169.3 | -56.2 | -179 | -20.1 | 0 | 0 | 110.5 | ||||
| 348 | P | 42.6 | Very low | 35.5 | Very low | 127 Ų | 127 | 145.1 Ų | 145.1 | 83% | 0.825 | 77% | 0.767 | S | S | * | * | -143.7 | -171 | 86.1 | 39.6 | -22.6 | 0 | 0 | 0 | 115.3 | |||||
| 349 | A | 32.4 | Very low | 35.6 | Very low | 88 Ų | 88 | 144.5 Ų | 144.5 | 73% | 0.727 | 77% | 0.769 | S | S | * | * | trans | -70.4 | -178.1 | -178.6 | 0 | 0 | 0 | 0 | 0 | 113.6 | ||||
| 350 | Q | 33.5 | Very low | 35.8 | Very low | 146 Ų | 146 | 140.4 Ų | 140.4 | 68% | 0.682 | 77% | 0.767 | S | S | * | * | cis | -174 | 168.2 | 45.5 | -149.8 | -178.6 | 37.8 | 0 | 0 | 112.8 | ||||
| 351 | R | 36.1 | Very low | 35.8 | Very low | 199 Ų | 199 | 135.8 Ų | 135.8 | 75% | 0.751 | 77% | 0.767 | S | S | * | * | trans | 85.7 | 144 | 160.1 | -63.7 | 171.8 | -150.3 | 172 | 7.4 | 117.5 | ||||
| 352 | D | 32.9 | Very low | 35.6 | Very low | 125 Ų | 125 | 137.5 Ų | 137.5 | 67% | 0.668 | 77% | 0.768 | S | S | * | * | cis | -151.2 | 156.4 | 0.6 | -130.6 | -48.7 | 0 | 0 | 0 | 116.9 | ||||
| 353 | T | 36.8 | Very low | 36 | Very low | 112 Ų | 112 | 134.6 Ų | 134.6 | 69% | 0.687 | 77% | 0.767 | S | S | * | * | trans | 35.1 | 133.4 | 151.3 | 29 | 0 | 0 | 0 | 0 | 126 | ||||
| 354 | V | 32.8 | Very low | 36.1 | Very low | 126 Ų | 126 | 136.5 Ų | 136.5 | 76% | 0.764 | 77% | 0.766 | S | S | * | * | 83.5 | 138.4 | 126.7 | 161.1 | 0 | 0 | 0 | 0 | 119.6 | |||||
| 355 | L | 37.5 | Very low | 36.7 | Very low | 154 Ų | 154 | 138.6 Ų | 138.6 | 81% | 0.806 | 77% | 0.768 | S | S | * | * | cis | -151.1 | 168.7 | -6.4 | -122.7 | 175.5 | 0 | 0 | 0 | 111.1 | ||||
| 356 | R | 38.2 | Very low | 37.6 | Very low | 201 Ų | 201 | 141 Ų | 141 | 76% | 0.758 | 76% | 0.763 | S | S | * | * | trans | -109.8 | 139.1 | 166.2 | 168.8 | -178.2 | 176.5 | -169.5 | 3.1 | 110.9 | ||||
| 357 | P | 43.2 | Very low | 38.1 | Very low | 116 Ų | 116 | 139.6 Ų | 139.6 | 75% | 0.753 | 76% | 0.76 | S | S | * | * | trans | -105.3 | 176.6 | 156.1 | -6.1 | 26.9 | 0 | 0 | 0 | 114.3 | ||||
| 358 | T | 35.9 | Very low | 39.3 | Very low | 115 Ų | 115 | 137.8 Ų | 137.8 | 71% | 0.706 | 76% | 0.755 | S | S | * | * | trans | -140.7 | 146 | -176.1 | 48 | 0 | 0 | 0 | 0 | 111.8 | ||||
| 359 | G | 35.7 | Very low | 39.7 | Very low | 73 Ų | 73 | 136.6 Ų | 136.6 | 75% | 0.753 | 75% | 0.747 | S | S | * | * | trans | 102.6 | 121.3 | 143 | 0 | 0 | 0 | 0 | 0 | 118.8 | ||||
| 360 | A | 35.9 | Very low | 41 | Very low | 98 Ų | 98 | 140.4 Ų | 140.4 | 81% | 0.81 | 75% | 0.754 | S | S | * | * | trans | 40.4 | 114.5 | 136.6 | 0 | 0 | 0 | 0 | 0 | 121.7 | ||||
| 361 | S | 32.8 | Very low | 42.6 | Very low | 114 Ų | 114 | 136.3 Ų | 136.3 | 80% | 0.797 | 74% | 0.739 | S | S | * | * | -174.9 | 118.7 | 113.8 | -79.4 | 0 | 0 | 0 | 0 | 109.1 | |||||
| 362 | L | 45 | Very low | 44 | Very low | 163 Ų | 163 | 129.6 Ų | 129.6 | 85% | 0.853 | 72% | 0.722 | S | S | * | * | 69.2 | 77.8 | 84.8 | -164.1 | 82.4 | 0 | 0 | 0 | 113.5 | |||||
| 363 | I | 40.2 | Very low | 45.5 | Very low | 153 Ų | 153 | 126.8 Ų | 126.8 | 79% | 0.785 | 72% | 0.716 | S | S | * | * | trans | -114.8 | 133.2 | 146 | -65.3 | -179 | 0 | 0 | 0 | 106.5 | E365 | I363-E365 PolarHBondContact O-N 2.94Š| ||
| 364 | Q | 42.2 | Very low | 46.9 | Very low | 153 Ų | 153 | 128.1 Ų | 128.1 | 72% | 0.715 | 72% | 0.715 | S | S | * | * | trans | -87.2 | 93.5 | -172.7 | -173.6 | 178.8 | 17.4 | 0 | 0 | 109.4 | Q366 | Q364-Q366 HydrophobicContact CG-CG 4.37Å; Q364-Q366 PolarHBondContact O-N 3.07Å | ||
| 365 | E | 43.7 | Very low | 48.6 | Very low | 159 Ų | 159 | 126.5 Ų | 126.5 | 74% | 0.743 | 70% | 0.7 | S | S | * | * | trans | -61.6 | 85.7 | 170.2 | -76.3 | -68.5 | 99.6 | 0 | 0 | 110 | I363 H367 | I363-E365 PolarHBondContact O-N 2.94Å; E365-H367 PolarHBondContact O-N 2.75Å; E365-H367 VanDerWaalsContact O-N 3.11Å | ||
| 366 | Q | 46.7 | Very low | 50.1 | Low | 143 Ų | 143 | 123.6 Ų | 123.6 | 67% | 0.668 | 69% | 0.685 | S | S | * | * | trans | -68.2 | 106.7 | 165 | -65.1 | -171.6 | 18.9 | 0 | 0 | 106.7 | Q364 L368 | Q364-Q366 HydrophobicContact CG-CG 4.37Å; Q364-Q366 PolarHBondContact O-N 3.07Å; Q366-L368 PolarHBondContact O-N 3.41Å | ||
| 367 | H | 42.5 | Very low | 51.5 | Low | 183 Ų | 183 | 122.3 Ų | 122.3 | 85% | 0.847 | 68% | 0.68 | S | S | * | * | trans | -61.5 | 84.3 | 172.8 | -77.5 | -99 | 0 | 0 | 0 | 110.1 | E365 P369 | E365-H367 PolarHBondContact O-N 2.75Å; E365-H367 VanDerWaalsContact O-N 3.11Å; H367-P369 WeakPolarHBondContact O-CD 3.46Å | ||
| 368 | L | 58.3 | Low | 52.7 | Low | 145 Ų | 145 | 120.6 Ų | 120.6 | 76% | 0.759 | 67% | 0.668 | S | S | * | * | trans | -56.7 | 120.9 | 164.2 | -75.2 | 170.2 | 0 | 0 | 0 | 106.7 | Q366 I370 | Q366-L368 PolarHBondContact O-N 3.41Å; L368-I370 PolarHBondContact O-N 3.25Å; L368-I370 VanDerWaalsContact O-N 3.07Å | ||
| 369 | P | 52.3 | Low | 53.9 | Low | 102 Ų | 102 | 119.5 Ų | 119.5 | 66% | 0.662 | 66% | 0.657 | S | S | * | * | trans | -63 | 118.9 | -177 | 24.8 | -33 | 0 | 0 | 0 | 108.3 | H367 V371 | H367-P369 WeakPolarHBondContact O-CD 3.46Å; P369-V371 VanDerWaalsContact C-N 3.32Å; P369-V371 WeakPolarHBondContact O-CG2 3.47Å; P369-V371 PolarHBondContact O-N 3.11Å | ||
| 370 | I | 59.2 | Low | 55.3 | Low | 168 Ų | 168 | 122.3 Ų | 122.3 | 86% | 0.862 | 65% | 0.651 | S | S | * | * | trans | -66.6 | 95.7 | 178.3 | -61.6 | 176.1 | 0 | 0 | 0 | 107.5 | L368 S372 | L368-I370 PolarHBondContact O-N 3.25Å; L368-I370 VanDerWaalsContact O-N 3.07Å; I370-S372 PolarHBondContact O-N 2.78Å | ||
| 371 | V | 66.5 | Low | 56.4 | Low | 60 Ų | 60 | 122.8 Ų | 122.8 | 36% | 0.364 | 64% | 0.639 | S | S | . | * | trans | -68.3 | 104.1 | -178.1 | -173.7 | 0 | 0 | 0 | 0 | 108.2 | P369 M375 L376 | P369-V371 VanDerWaalsContact C-N 3.32Å; P369-V371 WeakPolarHBondContact O-CG2 3.47Å; P369-V371 PolarHBondContact O-N 3.11Å; V371-M375 HydrophobicContact CB-CE 4.22Å; V371-M375 HydrophobicContact CG1-CB 3.83Å; V371-M375 HydrophobicContact CG1-CE 3.78Å; V371-M375 HydrophobicContact CG1-CG 3.86Å; V371-M375 HydrophobicContact CG2-CE 4.31Å; V371-L376 HydrophobicContact CB-CD2 4.49Å; V371-L376 HydrophobicContact CB-CG 4.48Å; V371-L376 HydrophobicContact CG1-CD2 3.77Å; V371-L376 HydrophobicContact CG1-CG 3.75Å | ||
| 372 | S | 65.8 | Low | 57.6 | Low | 58 Ų | 58 | 122.5 Ų | 122.5 | 41% | 0.406 | 63% | 0.628 | S | S | . | * | trans | -48.9 | 143.3 | 173.3 | 170.9 | 0 | 0 | 0 | 0 | 110.8 | I370 E374 M375 L376 | I370-S372 PolarHBondContact O-N 2.78Å; S372-E374 PolarHBondContact O-N 3.38Å; S372-E374 PolarHBondContact OG-N 3.22Å; S372-M375 WeakPolarHBondContact O-CA 3.43Å; S372-M375 WeakPolarHBondContact O-CB 3.35Å; S372-M375 PolarHBondContact O-N 3.02Å; S372-L376 PolarHBondContact O-N 3.27Å | ||
| 373 | A | 63.7 | Low | 58.1 | Low | 66 Ų | 66 | 121.6 Ų | 121.6 | 55% | 0.545 | 62% | 0.62 | S | S | . | * | H | α-helix | trans | -55.5 | -23.4 | 174.2 | 0 | 0 | 0 | 0 | 0 | 112.7 | R377 | A373-R377 PolarHBondContact O-N 3.38Å; A373-R377 VanDerWaalsContact O-N 3.08Å |
| 374 | E | 66.1 | Low | 58.8 | Low | 140 Ų | 140 | 121.6 Ų | 121.6 | 65% | 0.654 | 61% | 0.614 | S | S | * | * | H | α-helix | trans | -73.7 | -36.3 | 172.8 | -57 | -169 | 126.6 | 0 | 0 | 112.7 | S372 R377 T378 | S372-E374 PolarHBondContact O-N 3.38Å; S372-E374 PolarHBondContact OG-N 3.22Å; E374-R377 WeakPolarHBondContact O-CB 3.35Å; E374-R377 PolarHBondContact O-N 2.84Å; E374-T378 PolarHBondContact O-N 3.02Å; E374-T378 PolarHBondContact O-OG1 2.82Å |
| 375 | M | 69.9 | Low | 59.4 | Low | 93 Ų | 93 | 117.8 Ų | 117.8 | 46% | 0.458 | 60% | 0.601 | S | S | . | * | H | α-helix | trans | -72.5 | -32.6 | 174.2 | -174.5 | 153.4 | 63.7 | 0 | 0 | 111.7 | V371 S372 T378 L379 | V371-M375 HydrophobicContact CB-CE 4.22Å; V371-M375 HydrophobicContact CG1-CB 3.83Å; V371-M375 HydrophobicContact CG1-CE 3.78Å; V371-M375 HydrophobicContact CG1-CG 3.86Å; V371-M375 HydrophobicContact CG2-CE 4.31Å; S372-M375 WeakPolarHBondContact O-CA 3.43Å; S372-M375 WeakPolarHBondContact O-CB 3.35Å; S372-M375 PolarHBondContact O-N 3.02Å; M375-T378 WeakPolarHBondContact CA-OG1 3.44Å; M375-T378 PolarHBondContact O-N 3.01Å; M375-T378 PolarHBondContact O-OG1 3.07Å; M375-L379 WeakPolarHBondContact O-CB 3.37Å; M375-L379 VanDerWaalsContact O-CG 3.31Å; M375-L379 WeakPolarHBondContact O-CG 3.49Å; M375-L379 PolarHBondContact O-N 2.88Å |
| 376 | L | 68.4 | Low | 59.8 | Low | 92 Ų | 92 | 121.2 Ų | 121.2 | 48% | 0.482 | 61% | 0.607 | S | S | . | * | H | α-helix | trans | -64.2 | -39.6 | 167.3 | -69.1 | 175.8 | 0 | 0 | 0 | 111.8 | V371 S372 L379 Q380 | V371-L376 HydrophobicContact CB-CD2 4.49Å; V371-L376 HydrophobicContact CB-CG 4.48Å; V371-L376 HydrophobicContact CG1-CD2 3.77Å; V371-L376 HydrophobicContact CG1-CG 3.75Å; S372-L376 PolarHBondContact O-N 3.27Å; L376-L379 PolarHBondContact O-N 2.78Å; L376-Q380 WeakPolarHBondContact O-CG 3.45Å; L376-Q380 PolarHBondContact O-N 3.35Å |
| 377 | R | 66.8 | Low | 59.9 | Low | 174 Ų | 174 | 118.6 Ų | 118.6 | 66% | 0.657 | 60% | 0.604 | S | S | * | * | H | α-helix | trans | -62.8 | -43.4 | 173.8 | -82.1 | -173.2 | 179.9 | 120 | 0.9 | 112.8 | A373 E374 Q380 N381 | A373-R377 PolarHBondContact O-N 3.38Å; A373-R377 VanDerWaalsContact O-N 3.08Å; E374-R377 WeakPolarHBondContact O-CB 3.35Å; E374-R377 PolarHBondContact O-N 2.84Å; R377-Q380 PolarHBondContact O-N 2.98Å; R377-N381 WeakPolarHBondContact O-CB 3.49Å; R377-N381 PolarHBondContact O-N 3.02Å |
| 378 | T | 68.1 | Low | 60.2 | Low | 81 Ų | 81 | 116.3 Ų | 116.3 | 50% | 0.497 | 60% | 0.598 | S | S | . | * | H | α-helix | trans | -67.2 | -37.2 | 178.3 | 51.9 | 0 | 0 | 0 | 0 | 112 | E374 M375 N381 L382 | E374-T378 PolarHBondContact O-N 3.02Å; E374-T378 PolarHBondContact O-OG1 2.82Å; M375-T378 WeakPolarHBondContact CA-OG1 3.44Å; M375-T378 PolarHBondContact O-N 3.01Å; M375-T378 PolarHBondContact O-OG1 3.07Å; T378-N381 PolarHBondContact O-N 3.1Å; T378-L382 WeakPolarHBondContact O-CB 3.35Å; T378-L382 WeakPolarHBondContact O-CG 3.31Å; T378-L382 PolarHBondContact O-N 3.5Å |
| 379 | L | 63 | Low | 60.1 | Low | 91 Ų | 91 | 118 Ų | 118 | 48% | 0.476 | 60% | 0.602 | S | S | . | * | H | α-helix | trans | -64.7 | -43.6 | 173.5 | -71.5 | 171 | 0 | 0 | 0 | 112.7 | M375 L376 N381 L382 Q383 | M375-L379 WeakPolarHBondContact O-CB 3.37Å; M375-L379 VanDerWaalsContact O-CG 3.31Å; M375-L379 WeakPolarHBondContact O-CG 3.49Å; M375-L379 PolarHBondContact O-N 2.88Å; L376-L379 PolarHBondContact O-N 2.78Å; L379-N381 VanDerWaalsContact C-N 3.33Å; L379-N381 PolarHBondContact O-N 2.96Å; L379-L382 PolarHBondContact O-N 3.19Å; L379-Q383 PolarHBondContact O-N 3.41Å |
| 380 | Q | 63.6 | Low | 59.9 | Low | 133 Ų | 133 | 118.6 Ų | 118.6 | 62% | 0.621 | 61% | 0.606 | S | S | * | * | H | α-helix | trans | -62.4 | -39.6 | 173.7 | -75.8 | -177.8 | -13.8 | 0 | 0 | 112.1 | L376 R377 Q383 K384 | L376-Q380 WeakPolarHBondContact O-CG 3.45Å; L376-Q380 PolarHBondContact O-N 3.35Å; R377-Q380 PolarHBondContact O-N 2.98Å; Q380-Q383 PolarHBondContact O-N 3.32Å; Q380-K384 WeakPolarHBondContact O-CB 3.23Å; Q380-K384 PolarHBondContact O-N 3.34Å; Q380-K384 VanDerWaalsContact O-N 3.09Å |
| 381 | N | 58.9 | Low | 59.4 | Low | 107 Ų | 107 | 115.8 Ų | 115.8 | 57% | 0.572 | 61% | 0.608 | S | S | * | * | H | α-helix | trans | -65 | -41.4 | 174.6 | -119 | -18.8 | 0 | 0 | 0 | 111.6 | R377 T378 L379 Q383 K384 V385 | R377-N381 WeakPolarHBondContact O-CB 3.49Å; R377-N381 PolarHBondContact O-N 3.02Å; T378-N381 PolarHBondContact O-N 3.1Å; L379-N381 VanDerWaalsContact C-N 3.33Å; L379-N381 PolarHBondContact O-N 2.96Å; N381-Q383 PolarHBondContact O-N 3.09Å; N381-K384 CarbonylContact O-C 3.44Å; N381-K384 PolarHBondContact O-N 3Å; N381-K384 VanDerWaalsContact O-N 3.12Å; N381-V385 WeakPolarHBondContact O-CG2 3.5Å; N381-V385 PolarHBondContact O-N 3.21Å |
| 382 | L | 58.8 | Low | 58.9 | Low | 108 Ų | 108 | 115.6 Ų | 115.6 | 57% | 0.565 | 62% | 0.618 | S | S | * | * | H | α-helix | trans | -63.3 | -38.5 | 176.6 | -80.4 | 166.5 | 0 | 0 | 0 | 112.8 | T378 L379 K384 V385 R386 | T378-L382 WeakPolarHBondContact O-CB 3.35Å; T378-L382 WeakPolarHBondContact O-CG 3.31Å; T378-L382 PolarHBondContact O-N 3.5Å; L379-L382 PolarHBondContact O-N 3.19Å; L382-K384 VanDerWaalsContact C-N 3.34Å; L382-V385 PolarHBondContact O-N 3.08Å; L382-R386 WeakPolarHBondContact O-CB 3.38Å; L382-R386 PolarHBondContact O-N 3.45Å |
| 383 | Q | 56.3 | Low | 58.4 | Low | 144 Ų | 144 | 122.4 Ų | 122.4 | 67% | 0.673 | 64% | 0.643 | S | S | * | * | H | α-helix | trans | -62.6 | -42.1 | 170.7 | -75.2 | -174 | -56.1 | 0 | 0 | 111.6 | L379 Q380 N381 V385 R386 S387 | L379-Q383 PolarHBondContact O-N 3.41Å; Q380-Q383 PolarHBondContact O-N 3.32Å; N381-Q383 PolarHBondContact O-N 3.09Å; Q383-V385 VanDerWaalsContact C-N 3.34Å; Q383-V385 PolarHBondContact O-N 3.11Å; Q383-R386 PolarHBondContact O-N 3.07Å; Q383-S387 PolarHBondContact O-N 2.92Å |
| 384 | K | 55.1 | Low | 57.6 | Low | 154 Ų | 154 | 122.3 Ų | 122.3 | 67% | 0.67 | 64% | 0.643 | S | S | * | * | H | α-helix | trans | -71 | -26.6 | -179.4 | -151.2 | 164.4 | -170.5 | 171.6 | 0 | 113.5 | Q380 N381 L382 S387 | Q380-K384 WeakPolarHBondContact O-CB 3.23Å; Q380-K384 PolarHBondContact O-N 3.34Å; Q380-K384 VanDerWaalsContact O-N 3.09Å; N381-K384 CarbonylContact O-C 3.44Å; N381-K384 PolarHBondContact O-N 3Å; N381-K384 VanDerWaalsContact O-N 3.12Å; L382-K384 VanDerWaalsContact C-N 3.34Å; K384-S387 PolarHBondContact O-OG 3.01Å |
| 385 | V | 54.2 | Low | 57.4 | Low | 73 Ų | 73 | 120.2 Ų | 120.2 | 44% | 0.442 | 64% | 0.643 | S | S | . | * | H | α-helix | trans | -74.7 | -39.9 | 168 | 171.6 | 0 | 0 | 0 | 0 | 111 | N381 L382 Q383 S387 L388 | N381-V385 WeakPolarHBondContact O-CG2 3.5Å; N381-V385 PolarHBondContact O-N 3.21Å; L382-V385 PolarHBondContact O-N 3.08Å; Q383-V385 VanDerWaalsContact C-N 3.34Å; Q383-V385 PolarHBondContact O-N 3.11Å; V385-S387 PolarHBondContact O-N 3.36Å; V385-L388 PolarHBondContact O-N 3.39Å; V385-L388 VanDerWaalsContact O-N 3.09Å |
| 386 | R | 51.4 | Low | 56.9 | Low | 231 Ų | 231 | 121.2 Ų | 121.2 | 87% | 0.872 | 66% | 0.655 | S | S | * | * | H | α-helix | trans | -62.7 | -23.5 | 176.5 | -92.9 | -175.8 | 167.8 | 175.6 | -2.8 | 114.4 | L382 Q383 L388 | L382-R386 WeakPolarHBondContact O-CB 3.38Å; L382-R386 PolarHBondContact O-N 3.45Å; Q383-R386 PolarHBondContact O-N 3.07Å; R386-L388 VanDerWaalsContact C-N 3.3Å |
| 387 | S | 49 | Very low | 56.4 | Low | 87 Ų | 87 | 123.3 Ų | 123.3 | 61% | 0.608 | 66% | 0.66 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -78.1 | -6.6 | 174 | 46.2 | 0 | 0 | 0 | 0 | 114.9 | Q383 K384 V385 Q389 | Q383-S387 PolarHBondContact O-N 2.92Å; K384-S387 PolarHBondContact O-OG 3.01Å; V385-S387 PolarHBondContact O-N 3.36Å; S387-Q389 PolarHBondContact O-N 3.04Å |
| 388 | L | 48.6 | Very low | 56.3 | Low | 136 Ų | 136 | 121.6 Ų | 121.6 | 71% | 0.712 | 66% | 0.66 | S | S | * | * | trans | -88.2 | 83.1 | 177.5 | -64.1 | 177.3 | 0 | 0 | 0 | 110.7 | V385 R386 | V385-L388 PolarHBondContact O-N 3.39Å; V385-L388 VanDerWaalsContact O-N 3.09Å; R386-L388 VanDerWaalsContact C-N 3.3Å | ||
| 389 | Q | 56.3 | Low | 56.3 | Low | 180 Ų | 180 | 121.8 Ų | 121.8 | 84% | 0.841 | 66% | 0.661 | S | S | * | * | trans | -60.1 | 124.2 | 172.2 | -176.4 | 175.1 | -7.5 | 0 | 0 | 110 | S387 A391 | S387-Q389 PolarHBondContact O-N 3.04Å; Q389-A391 PolarHBondContact O-N 3.47Å | ||
| 390 | P | 48.3 | Very low | 56.6 | Low | 114 Ų | 114 | 120.4 Ų | 120.4 | 74% | 0.74 | 66% | 0.662 | S | S | * | * | trans | -77.8 | 91.8 | -171.4 | 29.9 | -35.1 | 0 | 0 | 0 | 111.9 | G392 | P390-G392 PolarHBondContact O-N 3.46Š| ||
| 391 | A | 47.8 | Very low | 57 | Low | 110 Ų | 110 | 120 Ų | 120 | 91% | 0.909 | 66% | 0.66 | S | S | * | * | trans | -73.1 | 59.4 | 169.5 | 0 | 0 | 0 | 0 | 0 | 112 | Q389 | Q389-A391 PolarHBondContact O-N 3.47Š| ||
| 392 | G | 56.4 | Low | 57.7 | Low | 56 Ų | 56 | 119.7 Ų | 119.7 | 58% | 0.577 | 66% | 0.658 | S | S | * | * | S | Bend | trans | 88.9 | 149.2 | 174.7 | 0 | 0 | 0 | 0 | 0 | 116.3 | P390 | P390-G392 PolarHBondContact O-N 3.46Š|
| 393 | Q | 55.6 | Low | 58.6 | Low | 200 Ų | 200 | 120 Ų | 120 | 94% | 0.935 | 66% | 0.66 | S | S | * | * | trans | 55.7 | 76 | 158.9 | -59.2 | -65.1 | -9.4 | 0 | 0 | 118.3 | ||||
| 394 | A | 47.1 | Very low | 59.6 | Low | 65 Ų | 65 | 115 Ų | 115 | 54% | 0.537 | 65% | 0.646 | S | S | . | * | trans | -149.7 | 86.8 | 164 | 0 | 0 | 0 | 0 | 0 | 113.7 | V396 F397 | A394-V396 PolarHBondContact O-N 3.46Å; A394-V396 VanDerWaalsContact O-N 3.12Å; A394-F397 PolarHBondContact O-N 3.41Å | ||
| 395 | S | 62.3 | Low | 60.6 | Low | 95 Ų | 95 | 110 Ų | 110 | 66% | 0.664 | 63% | 0.631 | S | S | * | * | H | α-helix | trans | -54.8 | -31.4 | -178.3 | 172.3 | 0 | 0 | 0 | 0 | 114.8 | F397 Q398 T399 | S395-F397 VanDerWaalsContact C-N 3.29Å; S395-F397 PolarHBondContact O-N 2.99Å; S395-Q398 WeakPolarHBondContact O-CB 3.41Å; S395-Q398 PolarHBondContact O-N 3.26Å; S395-T399 PolarHBondContact O-N 2.95Å |
| 396 | V | 59.3 | Low | 61.4 | Low | 115 Ų | 115 | 110.1 Ų | 110.1 | 70% | 0.697 | 63% | 0.629 | S | S | * | * | H | α-helix | trans | -64.2 | -25.1 | -177.4 | -70.2 | 0 | 0 | 0 | 0 | 115 | A394 T399 A400 | A394-V396 PolarHBondContact O-N 3.46Å; A394-V396 VanDerWaalsContact O-N 3.12Å; V396-T399 PolarHBondContact O-OG1 2.95Å; V396-T399 VanDerWaalsContact O-OG1 3.11Å; V396-A400 PolarHBondContact O-N 3.04Å |
| 397 | F | 58.1 | Low | 62.2 | Low | 136 Ų | 136 | 103.1 Ų | 103.1 | 60% | 0.596 | 61% | 0.614 | S | S | * | * | H | α-helix | trans | -76.3 | -31.3 | 178.3 | -151.9 | -90.5 | 0 | 0 | 0 | 111.4 | A394 S395 A400 Q401 | A394-F397 PolarHBondContact O-N 3.41Å; S395-F397 VanDerWaalsContact C-N 3.29Å; S395-F397 PolarHBondContact O-N 2.99Å; F397-A400 PolarHBondContact O-N 3.27Å; F397-Q401 WeakPolarHBondContact O-CB 3.48Å; F397-Q401 PolarHBondContact O-N 3.4Å |
| 398 | Q | 64.4 | Low | 63.3 | Low | 138 Ų | 138 | 105.7 Ų | 105.7 | 65% | 0.645 | 62% | 0.617 | S | S | * | * | H | α-helix | trans | -70 | -38.7 | 179.8 | -163 | 174.1 | 14.4 | 0 | 0 | 111.6 | S395 L402 | S395-Q398 WeakPolarHBondContact O-CB 3.41Å; S395-Q398 PolarHBondContact O-N 3.26Å; Q398-L402 VanDerWaalsContact O-CB 3.23Å; Q398-L402 WeakPolarHBondContact O-CB 3.47Å; Q398-L402 PolarHBondContact O-N 3Å |
| 399 | T | 67.4 | Low | 64.2 | Low | 85 Ų | 85 | 107 Ų | 107 | 52% | 0.521 | 61% | 0.612 | S | S | . | * | H | α-helix | trans | -67.8 | -38.9 | 172.2 | 39 | 0 | 0 | 0 | 0 | 112.5 | S395 V396 L402 L403 | S395-T399 PolarHBondContact O-N 2.95Å; V396-T399 PolarHBondContact O-OG1 2.95Å; V396-T399 VanDerWaalsContact O-OG1 3.11Å; T399-L402 PolarHBondContact O-N 2.94Å; T399-L403 PolarHBondContact O-N 3.17Å |
| 400 | A | 69.1 | Low | 64.5 | Low | 61 Ų | 61 | 103.6 Ų | 103.6 | 50% | 0.504 | 60% | 0.596 | S | S | . | * | H | α-helix | trans | -62.9 | -44.1 | 174.7 | 0 | 0 | 0 | 0 | 0 | 112.2 | V396 F397 L403 G404 | V396-A400 PolarHBondContact O-N 3.04Å; F397-A400 PolarHBondContact O-N 3.27Å; A400-L403 PolarHBondContact O-N 3Å; A400-G404 PolarHBondContact O-N 3.49Å |
| 401 | Q | 72.9 | Confident | 65 | Low | 124 Ų | 124 | 100.8 Ų | 100.8 | 58% | 0.579 | 58% | 0.583 | S | S | * | * | H | α-helix | trans | -64.4 | -41.5 | 176.4 | -169.3 | 172 | 16.1 | 0 | 0 | 111.9 | F397 G404 S405 | F397-Q401 WeakPolarHBondContact O-CB 3.48Å; F397-Q401 PolarHBondContact O-N 3.4Å; Q401-G404 PolarHBondContact O-N 3.2Å; Q401-S405 PolarHBondContact O-N 3.27Å; Q401-S405 PolarHBondContact O-OG 3.12Å |
| 402 | L | 74.3 | Confident | 65.5 | Low | 102 Ų | 102 | 98.5 Ų | 98.5 | 53% | 0.534 | 56% | 0.564 | S | S | . | * | H | α-helix | trans | -70.2 | -32.4 | 179.7 | -163.4 | 148.7 | 0 | 0 | 0 | 112.6 | Q398 T399 L406 | Q398-L402 VanDerWaalsContact O-CB 3.23Å; Q398-L402 WeakPolarHBondContact O-CB 3.47Å; Q398-L402 PolarHBondContact O-N 3Å; T399-L402 PolarHBondContact O-N 2.94Å; L402-L406 HydrophobicContact CD2-CD1 4.29Å; L402-L406 PolarHBondContact O-N 3.48Å |
| 403 | L | 76.1 | Confident | 65.5 | Low | 114 Ų | 114 | 99 Ų | 99 | 60% | 0.597 | 56% | 0.558 | S | S | * | * | H | α-helix | trans | -65.8 | -44.3 | 168.5 | -114 | 70.3 | 0 | 0 | 0 | 111.9 | T399 A400 S405 L406 C407 | T399-L403 PolarHBondContact O-N 3.17Å; A400-L403 PolarHBondContact O-N 3Å; L403-S405 PolarHBondContact O-N 3.12Å; L403-L406 WeakPolarHBondContact O-CA 3.39Å; L403-L406 WeakPolarHBondContact O-CB 3.48Å; L403-L406 PolarHBondContact O-N 2.89Å; L403-C407 PolarHBondContact O-N 3.47Å |
| 404 | G | 77.7 | Confident | 65.5 | Low | 38 Ų | 38 | 96.1 Ų | 96.1 | 39% | 0.392 | 55% | 0.545 | S | S | . | . | H | α-helix | trans | -56.1 | -52.1 | 176.1 | 0 | 0 | 0 | 0 | 0 | 111.7 | A400 Q401 L406 C407 E408 | A400-G404 PolarHBondContact O-N 3.49Å; Q401-G404 PolarHBondContact O-N 3.2Å; G404-L406 PolarHBondContact O-N 3.25Å; G404-L406 VanDerWaalsContact O-N 3.09Å; G404-C407 PolarHBondContact O-N 3.44Å; G404-E408 WeakPolarHBondContact O-CB 3.42Å; G404-E408 PolarHBondContact O-N 3.37Å |
| 405 | S | 76.5 | Confident | 65.7 | Low | 49 Ų | 49 | 98.5 Ų | 98.5 | 34% | 0.343 | 55% | 0.553 | S | S | . | * | H | α-helix | trans | -71.2 | 3.9 | 175 | -56.8 | 0 | 0 | 0 | 0 | 114.7 | Q401 L403 R409 | Q401-S405 PolarHBondContact O-N 3.27Å; Q401-S405 PolarHBondContact O-OG 3.12Å; L403-S405 PolarHBondContact O-N 3.12Å; S405-R409 VanDerWaalsContact O-CZ 3.27Å; S405-R409 PolarHBondContact O-NE 3.29Å; S405-R409 PolarHBondContact O-NH2 2.85Å |
| 406 | L | 69.9 | Low | 65.2 | Low | 77 Ų | 77 | 97.5 Ų | 97.5 | 40% | 0.403 | 55% | 0.55 | S | S | . | * | H | α-helix | trans | -97.3 | -51.5 | 167.8 | -113.8 | 166.4 | 0 | 0 | 0 | 110.3 | L402 L403 G404 E408 R409 Q410 | L402-L406 HydrophobicContact CD2-CD1 4.29Å; L402-L406 PolarHBondContact O-N 3.48Å; L403-L406 WeakPolarHBondContact O-CA 3.39Å; L403-L406 WeakPolarHBondContact O-CB 3.48Å; L403-L406 PolarHBondContact O-N 2.89Å; G404-L406 PolarHBondContact O-N 3.25Å; G404-L406 VanDerWaalsContact O-N 3.09Å; L406-E408 VanDerWaalsContact C-N 3.29Å; L406-E408 PolarHBondContact O-N 3.02Å; L406-R409 PolarHBondContact O-N 3.35Å; L406-R409 VanDerWaalsContact O-N 3.1Å; L406-Q410 PolarHBondContact O-N 2.96Å |
| 407 | C | 68.3 | Low | 64.8 | Low | 84 Ų | 84 | 97.8 Ų | 97.8 | 57% | 0.568 | 55% | 0.553 | S | S | * | * | H | α-helix | trans | -55.9 | -43.1 | 173.3 | -71.7 | 0 | 0 | 0 | 0 | 112.2 | L403 G404 R409 Q410 A411 | L403-C407 PolarHBondContact O-N 3.47Å; G404-C407 PolarHBondContact O-N 3.44Å; C407-R409 VanDerWaalsContact C-N 3.31Å; C407-R409 PolarHBondContact O-N 2.96Å; C407-Q410 PolarHBondContact O-N 2.94Å; C407-Q410 VanDerWaalsContact O-N 3.16Å; C407-A411 PolarHBondContact O-N 3Å |
| 408 | E | 72.4 | Confident | 64.3 | Low | 140 Ų | 140 | 99 Ų | 99 | 65% | 0.654 | 57% | 0.565 | S | S | * | * | H | α-helix | trans | -62.6 | -36.1 | 178.1 | -171.5 | 170.2 | -145.4 | 0 | 0 | 112.3 | G404 L406 A412 | G404-E408 WeakPolarHBondContact O-CB 3.42Å; G404-E408 PolarHBondContact O-N 3.37Å; L406-E408 VanDerWaalsContact C-N 3.29Å; L406-E408 PolarHBondContact O-N 3.02Å; E408-A412 WeakPolarHBondContact O-CB 3.47Å; E408-A412 PolarHBondContact O-N 3.09Å |
| 409 | R | 67.1 | Low | 63.5 | Low | 165 Ų | 165 | 97.1 Ų | 97.1 | 62% | 0.623 | 57% | 0.573 | S | S | * | * | H | α-helix | trans | -73.8 | -31.4 | 173.3 | -92 | -179.4 | -71 | 178.4 | -2.1 | 113.3 | S405 L406 C407 S413 | S405-R409 VanDerWaalsContact O-CZ 3.27Å; S405-R409 PolarHBondContact O-NE 3.29Å; S405-R409 PolarHBondContact O-NH2 2.85Å; L406-R409 PolarHBondContact O-N 3.35Å; L406-R409 VanDerWaalsContact O-N 3.1Å; C407-R409 VanDerWaalsContact C-N 3.31Å; C407-R409 PolarHBondContact O-N 2.96Å; R409-S413 PolarHBondContact O-N 3.09Å; R409-S413 VanDerWaalsContact O-N 3.07Å |
| 410 | Q | 63.8 | Low | 62 | Low | 107 Ų | 107 | 96.4 Ų | 96.4 | 50% | 0.5 | 58% | 0.583 | S | S | . | * | H | α-helix | trans | -69.6 | -45.7 | 174.6 | -70.5 | 178.2 | -94.6 | 0 | 0 | 110.8 | L406 C407 A412 S413 E414 | L406-Q410 PolarHBondContact O-N 2.96Å; C407-Q410 PolarHBondContact O-N 2.94Å; C407-Q410 VanDerWaalsContact O-N 3.16Å; Q410-A412 VanDerWaalsContact C-N 3.3Å; Q410-A412 PolarHBondContact O-N 3.45Å; Q410-S413 WeakPolarHBondContact O-CA 3.36Å; Q410-S413 PolarHBondContact O-N 3.25Å; Q410-S413 PolarHBondContact O-OG 2.95Å; Q410-E414 PolarHBondContact O-N 3.2Å |
| 411 | A | 58.4 | Low | 60.6 | Low | 55 Ų | 55 | 104.3 Ų | 104.3 | 46% | 0.455 | 61% | 0.606 | S | S | . | * | H | α-helix | trans | -59.1 | -38.5 | 172.6 | 0 | 0 | 0 | 0 | 0 | 112.8 | C407 S413 T415 | C407-A411 PolarHBondContact O-N 3Å; A411-S413 VanDerWaalsContact C-N 3.26Å; A411-S413 PolarHBondContact O-N 3.47Å; A411-T415 PolarHBondContact O-N 3.48Å; A411-T415 PolarHBondContact O-OG1 2.87Å |
| 412 | A | 57.7 | Low | 58.6 | Low | 62 Ų | 62 | 101.7 Ų | 101.7 | 51% | 0.512 | 61% | 0.612 | S | S | . | * | H | α-helix | trans | -68.9 | -20.7 | 173.4 | 0 | 0 | 0 | 0 | 0 | 113.8 | E408 Q410 T415 | E408-A412 WeakPolarHBondContact O-CB 3.47Å; E408-A412 PolarHBondContact O-N 3.09Å; Q410-A412 VanDerWaalsContact C-N 3.3Å; Q410-A412 PolarHBondContact O-N 3.45Å; A412-T415 WeakPolarHBondContact CA-OG1 3.36Å; A412-T415 PolarHBondContact O-OG1 3.18Å |
| 413 | S | 56.8 | Low | 56.7 | Low | 66 Ų | 66 | 101.3 Ų | 101.3 | 46% | 0.462 | 62% | 0.624 | S | S | . | * | H | α-helix | trans | -87.3 | -36.4 | 176.1 | 71.4 | 0 | 0 | 0 | 0 | 112.9 | R409 Q410 A411 T415 A416 | R409-S413 PolarHBondContact O-N 3.09Å; R409-S413 VanDerWaalsContact O-N 3.07Å; Q410-S413 WeakPolarHBondContact O-CA 3.36Å; Q410-S413 PolarHBondContact O-N 3.25Å; Q410-S413 PolarHBondContact O-OG 2.95Å; A411-S413 VanDerWaalsContact C-N 3.26Å; A411-S413 PolarHBondContact O-N 3.47Å; S413-T415 VanDerWaalsContact C-N 3.34Å; S413-A416 PolarHBondContact O-N 3.37Å |
| 414 | E | 55 | Low | 54.7 | Low | 141 Ų | 141 | 104 Ų | 104 | 66% | 0.659 | 63% | 0.634 | S | S | * | * | H | α-helix | trans | -71.1 | -30.3 | 177.8 | -68.5 | 173.6 | 171.6 | 0 | 0 | 112.2 | Q410 A416 T417 | Q410-E414 PolarHBondContact O-N 3.2Å; E414-A416 VanDerWaalsContact C-N 3.27Å; E414-A416 PolarHBondContact O-N 2.96Å; E414-T417 PolarHBondContact O-OG1 3.21Å; E414-T417 VanDerWaalsContact O-OG1 3.14Å |
| 415 | T | 51.9 | Low | 52.6 | Low | 114 Ų | 114 | 109 Ų | 109 | 70% | 0.699 | 65% | 0.646 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -75.7 | -9.2 | 174.1 | 45.4 | 0 | 0 | 0 | 0 | 114 | A411 A412 S413 | A411-T415 PolarHBondContact O-N 3.48Å; A411-T415 PolarHBondContact O-OG1 2.87Å; A412-T415 WeakPolarHBondContact CA-OG1 3.36Å; A412-T415 PolarHBondContact O-OG1 3.18Å; S413-T415 VanDerWaalsContact C-N 3.34Å |
| 416 | A | 51.5 | Low | 50.6 | Low | 74 Ų | 74 | 115.6 Ų | 115.6 | 61% | 0.612 | 67% | 0.669 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -92.5 | -10.8 | -179.7 | 0 | 0 | 0 | 0 | 0 | 114.5 | S413 E414 | S413-A416 PolarHBondContact O-N 3.37Å; E414-A416 VanDerWaalsContact C-N 3.27Å; E414-A416 PolarHBondContact O-N 2.96Å |
| 417 | T | 51.3 | Low | 48.8 | Very low | 122 Ų | 122 | 116.9 Ų | 116.9 | 75% | 0.748 | 68% | 0.684 | S | S | * | * | S | Bend | trans | -96.9 | -6.7 | -169.1 | 41.2 | 0 | 0 | 0 | 0 | 116.7 | E414 | E414-T417 PolarHBondContact O-OG1 3.21Å; E414-T417 VanDerWaalsContact O-OG1 3.14Å |
| 418 | D | 47.1 | Very low | 47.1 | Very low | 161 Ų | 161 | 121.6 Ų | 121.6 | 86% | 0.861 | 70% | 0.697 | S | S | * | * | S | Bend | trans | -100 | -7.8 | -176.6 | -159.1 | 41 | 0 | 0 | 0 | 114.4 | ||
| 419 | A | 47.7 | Very low | 45.3 | Very low | 98 Ų | 98 | 118.5 Ų | 118.5 | 81% | 0.81 | 70% | 0.696 | S | S | * | * | S | Bend | trans | -110 | 71.2 | -174.8 | 0 | 0 | 0 | 0 | 0 | 113 | ||
| 420 | G | 37.5 | Very low | 43.7 | Very low | 71 Ų | 71 | 118.9 Ų | 118.9 | 73% | 0.732 | 71% | 0.705 | S | S | * | * | trans | -177.7 | 17.4 | -177.6 | 0 | 0 | 0 | 0 | 0 | 122.1 | G422 | G420-G422 PolarHBondContact O-N 2.85Š| ||
| 421 | K | 39 | Very low | 42.4 | Very low | 226 Ų | 226 | 124.3 Ų | 124.3 | 98% | 0.983 | 72% | 0.721 | S | S | * | * | trans | -87.2 | 85.2 | 173.3 | -90 | -177.6 | 176.6 | 170.8 | 0 | 112.4 | ||||
| 422 | G | 31.7 | Very low | 41.4 | Very low | 69 Ų | 69 | 131.6 Ų | 131.6 | 71% | 0.711 | 74% | 0.736 | S | S | * | * | trans | -168 | 131.8 | 173 | 0 | 0 | 0 | 0 | 0 | 115.9 | G420 | G420-G422 PolarHBondContact O-N 2.85Š| ||
| 423 | A | 33.4 | Very low | 40.2 | Very low | 94 Ų | 94 | 135.3 Ų | 135.3 | 78% | 0.777 | 75% | 0.748 | S | S | * | * | trans | 56.7 | 88.9 | 156.9 | 0 | 0 | 0 | 0 | 0 | 121.2 | ||||
| 424 | Q | 33.2 | Very low | 39.5 | Very low | 172 Ų | 172 | 136.5 Ų | 136.5 | 80% | 0.804 | 76% | 0.762 | S | S | * | * | 61.3 | 145.9 | 119.6 | -68.9 | -176.2 | -12.8 | 0 | 0 | 124.6 | |||||
| 425 | H | 33.5 | Very low | 39.1 | Very low | 142 Ų | 142 | 135.9 Ų | 135.9 | 66% | 0.657 | 77% | 0.77 | S | S | * | * | trans | 79 | 114.9 | 146.1 | -83.2 | -50.5 | 0 | 0 | 0 | 122.8 | ||||
| 426 | K | 35.2 | Very low | 38.5 | Very low | 188 Ų | 188 | 141 Ų | 141 | 82% | 0.817 | 78% | 0.778 | S | S | * | * | trans | 69.1 | 151.2 | 146.1 | -64.1 | 172.1 | -176.3 | 175.4 | 0 | 115.6 | ||||
| 427 | S | 32.9 | Very low | 37.7 | Very low | 104 Ų | 104 | 145 Ų | 145 | 73% | 0.727 | 79% | 0.788 | S | S | * | * | cis | -162.5 | 140.1 | -8.3 | 40.8 | 0 | 0 | 0 | 0 | 112.3 | ||||
| 428 | H | 31.2 | Very low | 37.1 | Very low | 182 Ų | 182 | 145.2 Ų | 145.2 | 84% | 0.843 | 79% | 0.789 | S | S | * | * | trans | 52.4 | 121.8 | 130.9 | -152.1 | -83.6 | 0 | 0 | 0 | 122.1 | ||||
| 429 | A | 34.9 | Very low | 37 | Very low | 75 Ų | 75 | 142.8 Ų | 142.8 | 62% | 0.62 | 78% | 0.784 | S | S | * | * | trans | 66 | 166.4 | 164.9 | 0 | 0 | 0 | 0 | 0 | 116.6 | ||||
| 430 | E | 34 | Very low | 37.2 | Very low | 174 Ų | 174 | 144.4 Ų | 144.4 | 81% | 0.813 | 79% | 0.787 | S | S | * | * | cis | -140.4 | 168.4 | 1.8 | -166.9 | 134.6 | 99.5 | 0 | 0 | 112.7 | ||||
| 431 | R | 36.5 | Very low | 37.8 | Very low | 221 Ų | 221 | 146.9 Ų | 146.9 | 83% | 0.834 | 79% | 0.788 | S | S | * | * | trans | -70.1 | 148 | 171.6 | -56.7 | 161.3 | 166.8 | 171.1 | -7.6 | 111.6 | ||||
| 432 | R | 36.8 | Very low | 38 | Very low | 207 Ų | 207 | 142.1 Ų | 142.1 | 78% | 0.781 | 78% | 0.778 | S | S | * | * | 170 | 150.3 | 109.2 | -96.3 | 172 | 172.8 | 146.4 | -2.8 | 115.8 | |||||
| 433 | N | 33.4 | Very low | 38.6 | Very low | 141 Ų | 141 | 143.8 Ų | 143.8 | 75% | 0.754 | 78% | 0.779 | S | S | * | * | trans | 56.1 | 118.9 | 144.7 | -58.7 | 3.7 | 0 | 0 | 0 | 121.3 | ||||
| 434 | A | 41 | Very low | 39.2 | Very low | 91 Ų | 91 | 145.8 Ų | 145.8 | 75% | 0.752 | 78% | 0.776 | S | S | * | * | trans | -78.1 | 167.7 | 143.4 | 0 | 0 | 0 | 0 | 0 | 110.9 | ||||
| 435 | P | 48.3 | Very low | 39.7 | Very low | 127 Ų | 127 | 150.1 Ų | 150.1 | 83% | 0.825 | 80% | 0.796 | S | S | * | * | trans | -123 | 169.4 | 136 | 36.6 | -30.4 | 0 | 0 | 0 | 113.2 | ||||
| 436 | Y | 38 | Very low | 40 | Very low | 221 Ų | 221 | 150.5 Ų | 150.5 | 87% | 0.867 | 80% | 0.803 | S | S | * | * | trans | -98.6 | -177.9 | -176.2 | -113.6 | -104 | 0 | 0 | 0 | 112.2 | ||||
| 437 | L | 35.9 | Very low | 40.3 | Very low | 158 Ų | 158 | 148.5 Ų | 148.5 | 83% | 0.827 | 80% | 0.803 | S | S | * | * | trans | 75.9 | 152.4 | 166.2 | -63.8 | 158 | 0 | 0 | 0 | 116.2 | ||||
| 438 | V | 38.4 | Very low | 40.7 | Very low | 128 Ų | 128 | 151 Ų | 151 | 78% | 0.776 | 81% | 0.807 | S | S | * | * | cis | -133.5 | 160.4 | 1.2 | -155 | 0 | 0 | 0 | 0 | 109.7 | ||||
| 439 | S | 43.6 | Very low | 41.2 | Very low | 109 Ų | 109 | 149.2 Ų | 149.2 | 76% | 0.762 | 81% | 0.805 | S | S | * | * | trans | -101.4 | 134.8 | 163.8 | -52.3 | 0 | 0 | 0 | 0 | 111.4 | ||||
| 440 | P | 53.5 | Low | 41.6 | Very low | 132 Ų | 132 | 153.8 Ų | 153.8 | 86% | 0.857 | 82% | 0.816 | S | S | * | * | trans | -88.2 | 148.6 | 169.3 | 34.3 | -32.1 | 0 | 0 | 0 | 112.1 | ||||
| 441 | T | 48.5 | Very low | 42.1 | Very low | 123 Ų | 123 | 152.5 Ų | 152.5 | 76% | 0.755 | 82% | 0.816 | S | S | * | * | trans | -126.7 | 145.8 | -179.2 | 52.2 | 0 | 0 | 0 | 0 | 112.2 | ||||
| 442 | T | 44 | Very low | 42.5 | Very low | 127 Ų | 127 | 147.6 Ų | 147.6 | 78% | 0.779 | 82% | 0.815 | S | S | * | * | trans | 66.2 | 152.2 | 150.8 | -157.8 | 0 | 0 | 0 | 0 | 121 | ||||
| 443 | S | 45.3 | Very low | 43 | Very low | 104 Ų | 104 | 143 Ų | 143 | 73% | 0.727 | 82% | 0.818 | S | S | * | * | trans | 76.1 | 156.4 | 155.5 | -60.8 | 0 | 0 | 0 | 0 | 120.4 | ||||
| 444 | D | 45.7 | Very low | 43.8 | Very low | 135 Ų | 135 | 143.2 Ų | 143.2 | 72% | 0.722 | 82% | 0.823 | S | S | * | * | cis | 178.4 | 108.6 | -32.7 | -177.9 | -111 | 0 | 0 | 0 | 107.9 | ||||
| 445 | Q | 43.1 | Very low | 44 | Very low | 263 Ų | 263 | 147.9 Ų | 147.9 | 100% | 1.229 | 83% | 0.83 | S | S | * | * | trans | 176.3 | 0 | 152.4 | -106.5 | 150.8 | 100.2 | 0 | 0 | 111.4 |
Retrieved 445 of 445 residues in 72 ms
(Link to these results)