| 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 | 33.2 | Very low | 30.6 | Very low | 236 Ų | 236 | 150 Ų | 150 | 100% | 1.163 | 81% | 0.81 | S | S | * | * | 0 | 111.4 | 0 | -72.3 | -172.3 | -166.7 | 0 | 0 | 104.6 | |||||
| 2 | D | 33.3 | Very low | 30.7 | Very low | 152 Ų | 152 | 153.3 Ų | 153.3 | 81% | 0.813 | 82% | 0.816 | S | S | * | * | trans | -89 | 125.6 | -147 | -52.3 | -70.5 | 0 | 0 | 0 | 112.4 | ||||
| 3 | D | 32.3 | Very low | 30.4 | Very low | 166 Ų | 166 | 148.8 Ų | 148.8 | 89% | 0.888 | 80% | 0.804 | S | S | * | * | trans | -111.5 | 105.4 | 163 | -80.2 | -30.6 | 0 | 0 | 0 | 108 | ||||
| 4 | Q | 37.8 | Very low | 30.3 | Very low | 182 Ų | 182 | 150.9 Ų | 150.9 | 85% | 0.85 | 81% | 0.814 | S | S | * | * | trans | -87.7 | 121.2 | 171.2 | -82.9 | -176.1 | 25.6 | 0 | 0 | 110.6 | ||||
| 5 | I | 29.2 | Very low | 30.1 | Very low | 146 Ų | 146 | 150.6 Ų | 150.6 | 75% | 0.749 | 81% | 0.812 | S | S | * | * | trans | -69.9 | 135 | 166.6 | -64.9 | 167 | 0 | 0 | 0 | 109.1 | T7 | I5-T7 WeakPolarHBondContact CG2-OG1 3.45Š| ||
| 6 | I | 30.4 | Very low | 30 | Very low | 152 Ų | 152 | 147.6 Ų | 147.6 | 78% | 0.779 | 81% | 0.806 | S | S | * | * | trans | -124 | 105 | 158 | -61.3 | 178.9 | 0 | 0 | 0 | 108.1 | V8 | I6-V8 HydrophobicContact CG2-CG2 3.97Š| ||
| 7 | T | 26.3 | Very low | 30.1 | Very low | 115 Ų | 115 | 148.4 Ų | 148.4 | 71% | 0.706 | 81% | 0.807 | S | S | * | * | trans | -102.5 | 131.5 | 164.2 | -48 | 0 | 0 | 0 | 0 | 106.9 | I5 | I5-T7 WeakPolarHBondContact CG2-OG1 3.45Š| ||
| 8 | V | 32.9 | Very low | 30.2 | Very low | 132 Ų | 132 | 147.9 Ų | 147.9 | 80% | 0.8 | 80% | 0.802 | S | S | * | * | trans | -126.8 | 100.1 | 169.5 | -179 | 0 | 0 | 0 | 0 | 108.4 | I6 | I6-V8 HydrophobicContact CG2-CG2 3.97Š| ||
| 9 | E | 24.3 | Very low | 30.1 | Very low | 180 Ų | 180 | 148.6 Ų | 148.6 | 84% | 0.841 | 80% | 0.804 | S | S | * | * | trans | -89.8 | 146 | 155 | -84.7 | -175.7 | 136.2 | 0 | 0 | 109.4 | ||||
| 10 | S | 28.1 | Very low | 30.2 | Very low | 95 Ų | 95 | 149.7 Ų | 149.7 | 66% | 0.664 | 80% | 0.803 | S | S | * | * | trans | 161.1 | 99.5 | 143.2 | 178.7 | 0 | 0 | 0 | 0 | 107.8 | ||||
| 11 | S | 28.2 | Very low | 30.1 | Very low | 94 Ų | 94 | 149.4 Ų | 149.4 | 66% | 0.657 | 80% | 0.802 | S | S | * | * | 63.3 | 118 | 83.2 | 84.9 | 0 | 0 | 0 | 0 | 113.8 | |||||
| 12 | Q | 31.7 | Very low | 30 | Very low | 190 Ų | 190 | 143 Ų | 143 | 89% | 0.888 | 78% | 0.78 | S | S | * | * | 175.2 | 134 | 117.2 | -89.6 | 171.2 | 25.3 | 0 | 0 | 112.6 | |||||
| 13 | S | 26.8 | Very low | 29.7 | Very low | 94 Ų | 94 | 142.6 Ų | 142.6 | 66% | 0.657 | 78% | 0.778 | S | S | * | * | trans | -76.9 | 151.7 | 178.5 | 160.9 | 0 | 0 | 0 | 0 | 112.1 | D15 | S13-D15 PolarHBondContact OG-N 3.44Š| ||
| 14 | L | 29 | Very low | 29.7 | Very low | 179 Ų | 179 | 141 Ų | 141 | 94% | 0.937 | 77% | 0.77 | S | S | * | * | trans | -138.4 | 80.6 | 156.4 | -85.3 | 171 | 0 | 0 | 0 | 109.2 | ||||
| 15 | D | 28.2 | Very low | 29.2 | Very low | 146 Ų | 146 | 141 Ų | 141 | 78% | 0.781 | 77% | 0.767 | S | S | * | * | trans | -87.6 | 148.5 | 149.2 | -77.2 | -44.6 | 0 | 0 | 0 | 109.2 | S13 | S13-D15 PolarHBondContact OG-N 3.44Š| ||
| 16 | S | 28.1 | Very low | 29.2 | Very low | 103 Ų | 103 | 140.5 Ų | 140.5 | 72% | 0.72 | 77% | 0.766 | S | S | * | * | trans | 97.7 | 84.9 | 170.6 | -164 | 0 | 0 | 0 | 0 | 118 | ||||
| 17 | I | 31.3 | Very low | 29.2 | Very low | 161 Ų | 161 | 140.3 Ų | 140.3 | 83% | 0.826 | 77% | 0.771 | S | S | * | * | trans | -142.8 | 87.4 | 134.8 | -59.5 | -173.7 | 0 | 0 | 0 | 106 | ||||
| 18 | I | 31.6 | Very low | 29.4 | Very low | 140 Ų | 140 | 142.1 Ų | 142.1 | 72% | 0.718 | 77% | 0.769 | S | S | * | * | 73.8 | 108.7 | 103.1 | -64.8 | 167.4 | 0 | 0 | 0 | 113.8 | |||||
| 19 | L | 29.8 | Very low | 29.2 | Very low | 160 Ų | 160 | 141.1 Ų | 141.1 | 84% | 0.838 | 77% | 0.767 | S | S | * | * | trans | -39.4 | 131.2 | 155.7 | -72.4 | 124.1 | 0 | 0 | 0 | 113.5 | ||||
| 20 | H | 31.2 | Very low | 29.4 | Very low | 170 Ų | 170 | 138.8 Ų | 138.8 | 79% | 0.787 | 76% | 0.759 | S | S | * | * | -178.6 | 149.8 | 119.1 | -121.6 | -86.6 | 0 | 0 | 0 | 112.4 | |||||
| 21 | N | 28.9 | Very low | 29.3 | Very low | 144 Ų | 144 | 140.7 Ų | 140.7 | 77% | 0.77 | 76% | 0.762 | S | S | * | * | trans | 90.3 | 87.1 | 161.2 | -66.8 | -4.7 | 0 | 0 | 0 | 118.8 | ||||
| 22 | S | 29.8 | Very low | 29.3 | Very low | 102 Ų | 102 | 144.2 Ų | 144.2 | 71% | 0.713 | 77% | 0.774 | S | S | * | * | trans | -46.4 | 151.8 | 142.2 | -159.8 | 0 | 0 | 0 | 0 | 113.6 | ||||
| 23 | N | 27.7 | Very low | 29.1 | Very low | 144 Ų | 144 | 140.7 Ų | 140.7 | 77% | 0.77 | 77% | 0.769 | S | S | * | * | trans | 102.4 | 133.4 | 156 | -63.6 | -5.7 | 0 | 0 | 0 | 119.1 | ||||
| 24 | D | 31.6 | Very low | 29.4 | Very low | 133 Ų | 133 | 142.2 Ų | 142.2 | 71% | 0.711 | 77% | 0.774 | S | S | * | * | trans | 82.3 | 103.3 | 161.7 | -82.7 | -43.4 | 0 | 0 | 0 | 119.8 | ||||
| 25 | K | 27.5 | Very low | 29.3 | Very low | 182 Ų | 182 | 142.1 Ų | 142.1 | 79% | 0.791 | 77% | 0.768 | S | S | * | * | 43.7 | 98.5 | 122.1 | -63.2 | -175.3 | -175.5 | -178.1 | 0 | 116.1 | |||||
| 26 | D | 29.7 | Very low | 29.2 | Very low | 135 Ų | 135 | 143.6 Ų | 143.6 | 72% | 0.722 | 78% | 0.775 | S | S | * | * | trans | -165 | 101.1 | 132.9 | -100.8 | -23.8 | 0 | 0 | 0 | 110 | K28 | D26-K28 PolarHBondContact O-N 3.11Š| ||
| 27 | V | 30.4 | Very low | 29.1 | Very low | 147 Ų | 147 | 145.3 Ų | 145.3 | 89% | 0.891 | 78% | 0.776 | S | S | * | * | trans | -74.8 | 83.8 | 160.2 | 177.4 | 0 | 0 | 0 | 0 | 106.3 | ||||
| 28 | K | 30.7 | Very low | 28.9 | Very low | 154 Ų | 154 | 143.5 Ų | 143.5 | 67% | 0.67 | 77% | 0.773 | S | S | * | * | trans | -102.1 | 87.9 | 163 | -88.3 | -179.2 | 177.7 | 174.1 | 0 | 108.9 | D26 L30 | D26-K28 PolarHBondContact O-N 3.11Å; K28-L30 HydrophobicContact CB-CD1 3.83Å; K28-L30 HydrophobicContact CD-CD1 3.88Å; K28-L30 HydrophobicContact CG-CD1 3.8Å; K28-L30 PolarHBondContact O-N 2.83Å | ||
| 29 | C | 27.8 | Very low | 28.7 | Very low | 111 Ų | 111 | 144.5 Ų | 144.5 | 75% | 0.75 | 78% | 0.778 | S | S | * | * | trans | -60.1 | 104.4 | 149.1 | -171.6 | 0 | 0 | 0 | 0 | 106.1 | ||||
| 30 | L | 28.6 | Very low | 28.5 | Very low | 130 Ų | 130 | 145.7 Ų | 145.7 | 68% | 0.681 | 78% | 0.776 | S | S | * | * | trans | -129.1 | 132.8 | 171.5 | -108.7 | 103.9 | 0 | 0 | 0 | 110.7 | K28 | K28-L30 HydrophobicContact CB-CD1 3.83Å; K28-L30 HydrophobicContact CD-CD1 3.88Å; K28-L30 HydrophobicContact CG-CD1 3.8Å; K28-L30 PolarHBondContact O-N 2.83Å | ||
| 31 | D | 27.2 | Very low | 28.3 | Very low | 135 Ų | 135 | 143 Ų | 143 | 72% | 0.722 | 78% | 0.777 | S | S | * | * | trans | -46 | 123.7 | 179.2 | -62.9 | -72.7 | 0 | 0 | 0 | 114.4 | ||||
| 32 | D | 27.6 | Very low | 28.2 | Very low | 169 Ų | 169 | 140.8 Ų | 140.8 | 90% | 0.904 | 77% | 0.772 | S | S | * | * | trans | -156.6 | 65.7 | 159.9 | -90.5 | -30 | 0 | 0 | 0 | 109.9 | ||||
| 33 | C | 28.3 | Very low | 28 | Very low | 116 Ų | 116 | 141.2 Ų | 141.2 | 78% | 0.784 | 78% | 0.776 | S | S | * | * | S | Bend | trans | -163.5 | 35.8 | 156.6 | -145.9 | 0 | 0 | 0 | 0 | 114.5 | ||
| 34 | V | 31.6 | Very low | 28 | Very low | 126 Ų | 126 | 140.9 Ų | 140.9 | 76% | 0.764 | 77% | 0.772 | S | S | * | * | S | Bend | trans | -111.5 | 2.8 | 175.1 | 179 | 0 | 0 | 0 | 0 | 112.6 | ||
| 35 | H | 27.6 | Very low | 27.6 | Very low | 176 Ų | 176 | 141.9 Ų | 141.9 | 82% | 0.815 | 78% | 0.778 | S | S | * | * | trans | -127.2 | 67.1 | -175.3 | -115.9 | -65.5 | 0 | 0 | 0 | 114.3 | ||||
| 36 | L | 27.1 | Very low | 27.7 | Very low | 177 Ų | 177 | 138.7 Ų | 138.7 | 93% | 0.927 | 77% | 0.768 | S | S | * | * | trans | -134.2 | 57 | 153 | -79.1 | 173 | 0 | 0 | 0 | 109.5 | ||||
| 37 | N | 25.9 | Very low | 27.5 | Very low | 139 Ų | 139 | 138.5 Ų | 138.5 | 74% | 0.743 | 77% | 0.772 | S | S | * | * | trans | -80 | 143.7 | 150.6 | -83.6 | -25.6 | 0 | 0 | 0 | 107.8 | ||||
| 38 | T | 25.6 | Very low | 27.4 | Very low | 124 Ų | 124 | 141.1 Ų | 141.1 | 76% | 0.761 | 77% | 0.767 | S | S | * | * | trans | 89.3 | 63 | 176.2 | -38.2 | 0 | 0 | 0 | 0 | 115.8 | ||||
| 39 | I | 27.5 | Very low | 27.3 | Very low | 161 Ų | 161 | 141.3 Ų | 141.3 | 83% | 0.826 | 78% | 0.776 | S | S | * | * | trans | -93.4 | 108.9 | 133.4 | -61.3 | 178.7 | 0 | 0 | 0 | 105.5 | S41 | I39-S41 PolarHBondContact O-N 3.31Š| ||
| 40 | K | 26.2 | Very low | 27.4 | Very low | 184 Ų | 184 | 145 Ų | 145 | 80% | 0.8 | 78% | 0.782 | S | S | * | * | trans | -51.2 | 109.5 | 166.1 | -89.2 | 175.3 | 171.2 | 174.8 | 0 | 107.5 | S42 | K40-S42 PolarHBondContact O-N 3.04Š| ||
| 41 | S | 26.9 | Very low | 27.5 | Very low | 115 Ų | 115 | 142.5 Ų | 142.5 | 80% | 0.804 | 79% | 0.788 | S | S | * | * | trans | -62.9 | 94.8 | 157.7 | -63.6 | 0 | 0 | 0 | 0 | 106.8 | I39 S43 | I39-S41 PolarHBondContact O-N 3.31Å; S41-S43 PolarHBondContact O-N 2.76Å; S41-S43 VanDerWaalsContact O-N 3.16Å | ||
| 42 | S | 26.8 | Very low | 27.5 | Very low | 96 Ų | 96 | 144.6 Ų | 144.6 | 67% | 0.671 | 79% | 0.793 | S | S | * | * | trans | -55.2 | 116.2 | 159.2 | 47 | 0 | 0 | 0 | 0 | 107.1 | K40 I44 | K40-S42 PolarHBondContact O-N 3.04Å; S42-I44 PolarHBondContact O-N 3.07Å; S42-I44 VanDerWaalsContact O-N 3.1Å | ||
| 43 | S | 25.4 | Very low | 27.7 | Very low | 112 Ų | 112 | 144.8 Ų | 144.8 | 78% | 0.783 | 79% | 0.793 | S | S | * | * | trans | -48.1 | 112 | 178.2 | -49.1 | 0 | 0 | 0 | 0 | 110.8 | S41 | S41-S43 PolarHBondContact O-N 2.76Å; S41-S43 VanDerWaalsContact O-N 3.16Å | ||
| 44 | I | 27.1 | Very low | 27.6 | Very low | 136 Ų | 136 | 144 Ų | 144 | 70% | 0.697 | 79% | 0.789 | S | S | * | * | trans | -107 | 98.2 | 164.1 | -70 | 171.2 | 0 | 0 | 0 | 105.6 | S42 I46 | S42-I44 PolarHBondContact O-N 3.07Å; S42-I44 VanDerWaalsContact O-N 3.1Å; I44-I46 HydrophobicContact CG2-CD1 3.88Å; I44-I46 HydrophobicContact CG2-CG1 3.69Å; I44-I46 PolarHBondContact O-N 3.41Å | ||
| 45 | N | 25.1 | Very low | 27.6 | Very low | 155 Ų | 155 | 144.6 Ų | 144.6 | 83% | 0.829 | 79% | 0.793 | S | S | * | * | trans | -71.4 | 115.3 | 166.8 | -77.2 | -23.8 | 0 | 0 | 0 | 107.6 | ||||
| 46 | I | 27.6 | Very low | 27.7 | Very low | 115 Ų | 115 | 142.4 Ų | 142.4 | 59% | 0.59 | 79% | 0.792 | S | S | * | * | trans | -112.9 | 103.8 | 166.5 | -61.9 | 170.3 | 0 | 0 | 0 | 106.7 | I44 Y48 | I44-I46 HydrophobicContact CG2-CD1 3.88Å; I44-I46 HydrophobicContact CG2-CG1 3.69Å; I44-I46 PolarHBondContact O-N 3.41Å; I46-Y48 HydrophobicContact CG2-CD2 4.37Å; I46-Y48 HydrophobicContact CG2-CE2 4.01Å | ||
| 47 | T | 26.8 | Very low | 28 | Very low | 130 Ų | 130 | 139 Ų | 139 | 80% | 0.798 | 79% | 0.789 | S | S | * | * | P | Polyproline II helix | trans | -73.9 | 124.5 | 166.5 | -51.4 | 0 | 0 | 0 | 0 | 107.7 | ||
| 48 | Y | 28.3 | Very low | 28.3 | Very low | 203 Ų | 203 | 137.7 Ų | 137.7 | 80% | 0.796 | 79% | 0.791 | S | S | * | * | P | Polyproline II helix | trans | -92.2 | 118.4 | 166.6 | -74.2 | -85.1 | 0 | 0 | 0 | 107.9 | I46 | I46-Y48 HydrophobicContact CG2-CD2 4.37Å; I46-Y48 HydrophobicContact CG2-CE2 4.01Å |
| 49 | D | 29.4 | Very low | 28.6 | Very low | 158 Ų | 158 | 139.9 Ų | 139.9 | 85% | 0.845 | 80% | 0.797 | S | S | * | * | P | Polyproline II helix | trans | -93.8 | 119.4 | 173.2 | -163.7 | 13 | 0 | 0 | 0 | 108.1 | ||
| 50 | E | 28.5 | Very low | 29 | Very low | 188 Ų | 188 | 137.7 Ų | 137.7 | 88% | 0.879 | 80% | 0.797 | S | S | * | * | trans | -86.7 | 106.1 | 175.9 | -69.6 | -143.9 | 153 | 0 | 0 | 109.3 | ||||
| 51 | G | 32.1 | Very low | 29.5 | Very low | 78 Ų | 78 | 134 Ų | 134 | 80% | 0.804 | 79% | 0.794 | S | S | * | * | trans | -100.9 | 116.7 | 171.8 | 0 | 0 | 0 | 0 | 0 | 111.6 | ||||
| 52 | E | 26.7 | Very low | 30.1 | Very low | 178 Ų | 178 | 133.9 Ų | 133.9 | 83% | 0.832 | 79% | 0.793 | S | S | * | * | trans | -51.6 | 146.3 | 175.3 | -63 | -179.2 | 133.9 | 0 | 0 | 114.4 | ||||
| 53 | L | 31 | Very low | 30.7 | Very low | 174 Ų | 174 | 134.9 Ų | 134.9 | 91% | 0.911 | 80% | 0.797 | S | S | * | * | trans | -140.2 | 106.1 | 146.3 | -139.5 | 82 | 0 | 0 | 0 | 110.2 | ||||
| 54 | S | 26.8 | Very low | 31.1 | Very low | 98 Ų | 98 | 134.4 Ų | 134.4 | 69% | 0.685 | 79% | 0.794 | S | S | * | * | trans | -73.9 | 139.5 | 170.2 | -72.1 | 0 | 0 | 0 | 0 | 111 | ||||
| 55 | T | 31.3 | Very low | 31.7 | Very low | 139 Ų | 139 | 136 Ų | 136 | 85% | 0.853 | 80% | 0.803 | S | S | * | * | trans | -148.5 | 122.7 | 147.5 | -55.4 | 0 | 0 | 0 | 0 | 110 | ||||
| 56 | T | 28.7 | Very low | 32.4 | Very low | 130 Ų | 130 | 135.9 Ų | 135.9 | 80% | 0.798 | 80% | 0.802 | S | S | * | * | trans | -76.6 | 141.4 | -178.6 | 49.5 | 0 | 0 | 0 | 0 | 112.9 | ||||
| 57 | A | 34.2 | Very low | 33.1 | Very low | 105 Ų | 105 | 135.1 Ų | 135.1 | 87% | 0.868 | 81% | 0.805 | S | S | * | * | trans | -159.4 | 140.6 | 142.3 | 0 | 0 | 0 | 0 | 0 | 110.8 | ||||
| 58 | S | 32.6 | Very low | 33.8 | Very low | 113 Ų | 113 | 135.8 Ų | 135.8 | 79% | 0.79 | 81% | 0.809 | S | S | * | * | trans | -87.9 | 136.8 | -154.8 | 31.6 | 0 | 0 | 0 | 0 | 116.8 | ||||
| 59 | L | 32.5 | Very low | 34 | Very low | 169 Ų | 169 | 137 Ų | 137 | 89% | 0.885 | 81% | 0.812 | S | S | * | * | trans | 18.8 | 123.9 | 133.1 | -67.3 | 156.8 | 0 | 0 | 0 | 120.3 | ||||
| 60 | S | 34.7 | Very low | 34.5 | Very low | 116 Ų | 116 | 138.2 Ų | 138.2 | 81% | 0.811 | 81% | 0.812 | S | S | * | * | -160.9 | 119.2 | 119 | 67.2 | 0 | 0 | 0 | 0 | 112.9 | |||||
| 61 | S | 36.5 | Very low | 34.6 | Very low | 106 Ų | 106 | 137.5 Ų | 137.5 | 74% | 0.741 | 81% | 0.809 | S | S | * | * | trans | -38.8 | 156.9 | 157.6 | 46.6 | 0 | 0 | 0 | 0 | 115.3 | ||||
| 62 | S | 39.2 | Very low | 34.8 | Very low | 113 Ų | 113 | 140.9 Ų | 140.9 | 79% | 0.79 | 81% | 0.808 | S | S | * | * | cis | 179.3 | -177.5 | 36.9 | -117.3 | 0 | 0 | 0 | 0 | 110 | ||||
| 63 | P | 39.4 | Very low | 34.8 | Very low | 116 Ų | 116 | 138.7 Ų | 138.7 | 75% | 0.753 | 80% | 0.802 | S | S | * | * | trans | -126.3 | -165.2 | -135.3 | 46.7 | -34.1 | 0 | 0 | 0 | 117.7 | ||||
| 64 | S | 34.5 | Very low | 34.8 | Very low | 102 Ų | 102 | 136.8 Ų | 136.8 | 71% | 0.713 | 80% | 0.798 | S | S | * | * | trans | 99.7 | 142.2 | 164.4 | 98.6 | 0 | 0 | 0 | 0 | 115 | ||||
| 65 | L | 40.5 | Very low | 35 | Very low | 171 Ų | 171 | 137.4 Ų | 137.4 | 90% | 0.895 | 80% | 0.802 | S | S | * | * | cis | -155.9 | 172.2 | 37.9 | -100.3 | 142 | 0 | 0 | 0 | 111.5 | ||||
| 66 | N | 38.8 | Very low | 34.9 | Very low | 151 Ų | 151 | 140.2 Ų | 140.2 | 81% | 0.807 | 80% | 0.802 | S | S | * | * | trans | -100.8 | -162.6 | -158.1 | -145 | 12.7 | 0 | 0 | 0 | 112.6 | ||||
| 67 | P | 43.2 | Very low | 34.9 | Very low | 100 Ų | 100 | 139.1 Ų | 139.1 | 65% | 0.649 | 80% | 0.797 | S | S | * | * | -126.5 | 169.5 | -122.4 | 39.6 | -19.7 | 0 | 0 | 0 | 115.5 | |||||
| 68 | T | 40.1 | Very low | 34.6 | Very low | 144 Ų | 144 | 142.4 Ų | 142.4 | 88% | 0.883 | 80% | 0.8 | S | S | * | * | trans | -150 | 136 | 160.6 | -37.9 | 0 | 0 | 0 | 0 | 114.4 | ||||
| 69 | R | 32.7 | Very low | 34.6 | Very low | 228 Ų | 228 | 142.1 Ų | 142.1 | 86% | 0.86 | 79% | 0.789 | S | S | * | * | trans | -54.9 | 155 | 173.1 | -74.5 | 168.8 | 155.4 | 154.7 | -7.8 | 114.7 | ||||
| 70 | H | 40.9 | Very low | 34.6 | Very low | 183 Ų | 183 | 140.1 Ų | 140.1 | 85% | 0.847 | 78% | 0.779 | S | S | * | * | -163.2 | 142.6 | 120.9 | -100.7 | -69.4 | 0 | 0 | 0 | 112.4 | |||||
| 71 | E | 31 | Very low | 34.5 | Very low | 173 Ų | 173 | 139 Ų | 139 | 81% | 0.808 | 77% | 0.771 | S | S | * | * | trans | -63 | 155.8 | 176.9 | -61.8 | 172.2 | 105.8 | 0 | 0 | 113.8 | ||||
| 72 | L | 34.8 | Very low | 34.3 | Very low | 149 Ų | 149 | 138.9 Ų | 138.9 | 78% | 0.78 | 76% | 0.763 | S | S | * | * | 178.7 | 129.4 | 108.7 | -150.4 | 69.9 | 0 | 0 | 0 | 112.2 | |||||
| 73 | N | 28.4 | Very low | 33.9 | Very low | 133 Ų | 133 | 140.9 Ų | 140.9 | 71% | 0.711 | 75% | 0.754 | S | S | * | * | trans | 12.8 | 129.3 | 151.7 | -60.9 | -27.9 | 0 | 0 | 0 | 120.4 | ||||
| 74 | T | 30.5 | Very low | 33.5 | Very low | 134 Ų | 134 | 139.1 Ų | 139.1 | 82% | 0.822 | 74% | 0.744 | S | S | * | * | 175.3 | 135.5 | 113.2 | 26.7 | 0 | 0 | 0 | 0 | 113.1 | |||||
| 75 | S | 30.4 | Very low | 33.8 | Very low | 110 Ų | 110 | 137.7 Ų | 137.7 | 77% | 0.769 | 73% | 0.728 | S | S | * | * | trans | 46.2 | 104.2 | 154.6 | 55.9 | 0 | 0 | 0 | 0 | 120.1 | P77 | S75-P77 WeakPolarHBondContact O-CD 3.46Š| ||
| 76 | K | 29.9 | Very low | 33.8 | Very low | 198 Ų | 198 | 133.7 Ų | 133.7 | 86% | 0.861 | 71% | 0.707 | S | S | * | * | trans | -85.8 | 121.4 | 168.7 | -102.6 | 180 | 176.1 | 179.6 | 0 | 112 | ||||
| 77 | P | 27.9 | Very low | 33.8 | Very low | 107 Ų | 107 | 131.4 Ų | 131.4 | 70% | 0.695 | 70% | 0.695 | S | S | * | * | trans | -87.3 | 146.7 | 164 | 33.9 | -27.9 | 0 | 0 | 0 | 110.9 | S75 N79 | S75-P77 WeakPolarHBondContact O-CD 3.46Å; P77-N79 PolarHBondContact O-N 3.41Å; P77-N79 VanDerWaalsContact O-N 3.16Å | ||
| 78 | L | 28.2 | Very low | 34.2 | Very low | 175 Ų | 175 | 129 Ų | 129 | 92% | 0.916 | 68% | 0.68 | S | S | * | * | S | Bend | trans | -61.4 | 104.5 | 170.5 | -77.8 | 84.4 | 0 | 0 | 0 | 110.3 | ||
| 79 | N | 33 | Very low | 34.7 | Very low | 107 Ų | 107 | 123.3 Ų | 123.3 | 57% | 0.572 | 64% | 0.643 | S | S | * | * | trans | -169.7 | 5.2 | 154.5 | -123.8 | -11.3 | 0 | 0 | 0 | 119.5 | P77 S81 | P77-N79 PolarHBondContact O-N 3.41Å; P77-N79 VanDerWaalsContact O-N 3.16Å; N79-S81 PolarHBondContact O-N 3.19Å | ||
| 80 | D | 31.5 | Very low | 35.7 | Very low | 126 Ų | 126 | 118.8 Ų | 118.8 | 67% | 0.674 | 63% | 0.63 | S | S | * | * | H | α-helix | trans | -79.7 | -11.7 | -168.1 | -69.1 | -30.7 | 0 | 0 | 0 | 116.3 | ||
| 81 | S | 32.7 | Very low | 36.4 | Very low | 93 Ų | 93 | 116.4 Ų | 116.4 | 65% | 0.65 | 62% | 0.617 | S | S | * | * | H | α-helix | trans | -72.9 | -37.9 | -175.2 | 169.6 | 0 | 0 | 0 | 0 | 113.6 | N79 Y83 S84 | N79-S81 PolarHBondContact O-N 3.19Å; S81-Y83 PolarHBondContact O-N 3.26Å; S81-S84 PolarHBondContact O-N 2.89Å |
| 82 | N | 32.8 | Very low | 37.7 | Very low | 104 Ų | 104 | 111 Ų | 111 | 56% | 0.556 | 59% | 0.589 | S | S | * | * | H | α-helix | trans | -71.2 | -28.5 | -176.8 | -92.1 | -30.5 | 0 | 0 | 0 | 113.3 | I86 | N82-I86 WeakPolarHBondContact O-CD1 3.43Å |
| 83 | Y | 30.1 | Very low | 38.6 | Very low | 155 Ų | 155 | 104.9 Ų | 104.9 | 61% | 0.608 | 56% | 0.557 | S | S | * | * | H | α-helix | trans | -76.2 | -25.3 | -179.4 | -77.5 | -84.2 | 0 | 0 | 0 | 113.4 | S81 N87 | S81-Y83 PolarHBondContact O-N 3.26Å; Y83-N87 PolarHBondContact O-N 3.14Å; Y83-N87 PolarHBondContact O-ND2 3.22Å |
| 84 | S | 30.9 | Very low | 39.8 | Very low | 79 Ų | 79 | 107.4 Ų | 107.4 | 55% | 0.552 | 56% | 0.561 | S | S | * | * | H | α-helix | trans | -72.1 | -39.5 | 177.8 | -170.4 | 0 | 0 | 0 | 0 | 112.5 | S81 N87 S88 | S81-S84 PolarHBondContact O-N 2.89Å; S84-N87 PolarHBondContact O-N 2.98Å; S84-S88 PolarHBondContact O-N 3.48Å; S84-S88 PolarHBondContact O-OG 2.74Å |
| 85 | L | 40.5 | Very low | 40.9 | Very low | 71 Ų | 71 | 106.7 Ų | 106.7 | 37% | 0.372 | 55% | 0.549 | S | S | . | . | H | α-helix | trans | -65.4 | -40 | 177.2 | -81.9 | 160.6 | 0 | 0 | 0 | 112.3 | N87 S88 F89 | L85-N87 VanDerWaalsContact C-N 3.34Å; L85-N87 PolarHBondContact O-N 3.05Å; L85-S88 PolarHBondContact O-N 3.31Å; L85-F89 VanDerWaalsContact O-CB 3.31Å; L85-F89 WeakPolarHBondContact O-CB 3.39Å; L85-F89 PolarHBondContact O-N 3.41Å |
| 86 | I | 41.8 | Very low | 42 | Very low | 87 Ų | 87 | 104 Ų | 104 | 45% | 0.446 | 52% | 0.524 | S | S | . | . | H | α-helix | trans | -65.4 | -35 | 178.8 | -72 | 163.8 | 0 | 0 | 0 | 112.1 | N82 F89 K90 | N82-I86 WeakPolarHBondContact O-CD1 3.43Å; I86-F89 WeakPolarHBondContact O-CB 3.44Å; I86-F89 PolarHBondContact O-N 3.45Å; I86-K90 PolarHBondContact O-N 3.33Å |
| 87 | N | 38.8 | Very low | 42.8 | Very low | 104 Ų | 104 | 96.4 Ų | 96.4 | 56% | 0.556 | 49% | 0.492 | S | S | * | . | H | α-helix | trans | -73.3 | -38.9 | 177.6 | -74.2 | -27.7 | 0 | 0 | 0 | 112.1 | Y83 S84 L85 F89 K91 | Y83-N87 PolarHBondContact O-N 3.14Å; Y83-N87 PolarHBondContact O-ND2 3.22Å; S84-N87 PolarHBondContact O-N 2.98Å; L85-N87 VanDerWaalsContact C-N 3.34Å; L85-N87 PolarHBondContact O-N 3.05Å; N87-F89 PolarHBondContact O-N 3.29Å; N87-K91 WeakPolarHBondContact O-CB 3.49Å; N87-K91 PolarHBondContact O-N 3.13Å |
| 88 | S | 51.5 | Low | 43.8 | Very low | 48 Ų | 48 | 96.9 Ų | 96.9 | 34% | 0.336 | 49% | 0.494 | S | S | . | . | H | α-helix | trans | -61.3 | -35.8 | 169 | -65 | 0 | 0 | 0 | 0 | 111.6 | S84 L85 K91 R92 | S84-S88 PolarHBondContact O-N 3.48Å; S84-S88 PolarHBondContact O-OG 2.74Å; L85-S88 PolarHBondContact O-N 3.31Å; S88-K91 PolarHBondContact O-N 3.19Å; S88-R92 WeakPolarHBondContact O-CB 3.46Å; S88-R92 WeakPolarHBondContact O-CG 3.37Å; S88-R92 PolarHBondContact O-N 3.23Å |
| 89 | F | 51.2 | Low | 44.5 | Very low | 25 Ų | 25 | 94.7 Ų | 94.7 | 11% | 0.11 | 48% | 0.482 | C | S | . | . | H | α-helix | trans | -71.2 | -47.6 | 177.8 | -168.5 | -81.5 | 0 | 0 | 0 | 113 | L85 I86 N87 K91 R92 I93 I208 G295 P299 | L85-F89 VanDerWaalsContact O-CB 3.31Å; L85-F89 WeakPolarHBondContact O-CB 3.39Å; L85-F89 PolarHBondContact O-N 3.41Å; I86-F89 WeakPolarHBondContact O-CB 3.44Å; I86-F89 PolarHBondContact O-N 3.45Å; N87-F89 PolarHBondContact O-N 3.29Å; F89-K91 PolarHBondContact O-N 3.13Å; F89-R92 CarbonylContact O-C 3.58Å; F89-R92 WeakPolarHBondContact O-CA 3.45Å; F89-R92 WeakPolarHBondContact O-CB 3.34Å; F89-R92 PolarHBondContact O-N 3.37Å; F89-I93 HydrophobicContact CD1-CD1 4.27Å; F89-I93 HydrophobicContact CD1-CG1 4.21Å; F89-I93 HydrophobicContact CE1-CB 4.49Å; F89-I93 HydrophobicContact CE1-CD1 3.34Å; F89-I93 HydrophobicContact CE1-CG1 3.49Å; F89-I93 VanDerWaalsContact CE1-CG1 3.49Å; F89-I93 HydrophobicContact CZ-CD1 3.99Å; F89-I93 HydrophobicContact CZ-CG1 4Å; F89-I93 PolarHBondContact O-N 3.26Å; F89-I208 HydrophobicContact CD2-CG2 4.49Å; F89-I208 HydrophobicContact CE2-CG2 3.69Å; F89-I208 HydrophobicContact CZ-CG2 4.44Å; F89-G295 WeakPolarHBondContact CE2-O 3.16Å; F89-G295 WeakPolarHBondContact CZ-O 3.24Å; F89-P299 HydrophobicContact CD1-CB 4.05Å; F89-P299 HydrophobicContact CD1-CG 3.61Å; F89-P299 HydrophobicContact CE1-CB 3.41Å; F89-P299 VanDerWaalsContact CE1-CB 3.41Å; F89-P299 HydrophobicContact CE1-CG 3.18Å; F89-P299 HydrophobicContact CZ-CB 4.27Å; F89-P299 HydrophobicContact CZ-CG 3.88Å |
| 90 | K | 52.7 | Low | 44.9 | Very low | 134 Ų | 134 | 94.1 Ų | 94.1 | 58% | 0.583 | 49% | 0.486 | S | S | * | . | H | α-helix | trans | -59.7 | -35.1 | 172.9 | -77.6 | -176.7 | 178.2 | 179.9 | 0 | 111.8 | I86 K94 | I86-K90 PolarHBondContact O-N 3.33Å; K90-K94 WeakPolarHBondContact O-CB 3.38Å; K90-K94 PolarHBondContact O-N 3.45Å |
| 91 | K | 56.6 | Low | 45.6 | Very low | 132 Ų | 132 | 98.3 Ų | 98.3 | 57% | 0.574 | 49% | 0.493 | S | S | * | . | H | α-helix | trans | -66.7 | -43.3 | 172.1 | -169.1 | 176.2 | 179.9 | -179.9 | 0 | 111.6 | N87 S88 F89 K94 Q95 | N87-K91 WeakPolarHBondContact O-CB 3.49Å; N87-K91 PolarHBondContact O-N 3.13Å; S88-K91 PolarHBondContact O-N 3.19Å; F89-K91 PolarHBondContact O-N 3.13Å; K91-K94 PolarHBondContact O-N 2.94Å; K91-Q95 VanDerWaalsContact O-CB 3.28Å; K91-Q95 WeakPolarHBondContact O-CB 3.25Å; K91-Q95 VanDerWaalsContact O-CG 3.24Å; K91-Q95 WeakPolarHBondContact O-CG 3.27Å; K91-Q95 PolarHBondContact O-N 2.95Å |
| 92 | R | 56.5 | Low | 45.8 | Very low | 61 Ų | 61 | 101.2 Ų | 101.2 | 23% | 0.23 | 50% | 0.501 | C | S | . | . | H | α-helix | trans | -61.6 | -43.1 | 173.7 | -81.2 | 174.8 | -171.7 | 146.5 | 11.7 | 112.2 | S88 F89 Q95 H96 E215 | S88-R92 WeakPolarHBondContact O-CB 3.46Å; S88-R92 WeakPolarHBondContact O-CG 3.37Å; S88-R92 PolarHBondContact O-N 3.23Å; F89-R92 CarbonylContact O-C 3.58Å; F89-R92 WeakPolarHBondContact O-CA 3.45Å; F89-R92 WeakPolarHBondContact O-CB 3.34Å; F89-R92 PolarHBondContact O-N 3.37Å; R92-Q95 PolarHBondContact O-N 3.41Å; R92-H96 WeakPolarHBondContact O-CB 3.43Å; R92-H96 PolarHBondContact O-CD2 2.7Å; R92-H96 VanDerWaalsContact O-CG 3.29Å; R92-H96 PolarHBondContact O-N 2.91Å; R92-E215 IonicContact CZ-OE2 2.7Å; R92-E215 VanDerWaalsContact CZ-OE2 3.23Å; R92-E215 IonicContact NH1-OE2 3.99Å; R92-E215 PolarHBondContact NH1-OE2 2.9Å; R92-E215 IonicContact NH2-OE1 3.46Å; R92-E215 PolarHBondContact NH2-OE1 3.34Å; R92-E215 IonicContact NH2-OE2 2.63Å; R92-E215 PolarHBondContact NH2-OE2 2.85Å |
| 93 | I | 54.2 | Low | 46.3 | Very low | 19 Ų | 19 | 98.2 Ų | 98.2 | 10% | 0.097 | 49% | 0.488 | C | S | . | . | H | α-helix | trans | -63.6 | -51.6 | 176.6 | -90.3 | -158.1 | 0 | 0 | 0 | 111.1 | F89 Q95 H96 L97 P299 | F89-I93 HydrophobicContact CD1-CD1 4.27Å; F89-I93 HydrophobicContact CD1-CG1 4.21Å; F89-I93 HydrophobicContact CE1-CB 4.49Å; F89-I93 HydrophobicContact CE1-CD1 3.34Å; F89-I93 HydrophobicContact CE1-CG1 3.49Å; F89-I93 VanDerWaalsContact CE1-CG1 3.49Å; F89-I93 HydrophobicContact CZ-CD1 3.99Å; F89-I93 HydrophobicContact CZ-CG1 4Å; F89-I93 PolarHBondContact O-N 3.26Å; I93-Q95 VanDerWaalsContact C-N 3.27Å; I93-Q95 PolarHBondContact O-N 2.97Å; I93-H96 PolarHBondContact O-N 3.14Å; I93-L97 HydrophobicContact CB-CD1 3.82Å; I93-L97 HydrophobicContact CD1-CD1 3.78Å; I93-L97 HydrophobicContact CG1-CD1 3.64Å; I93-L97 HydrophobicContact CG2-CD1 3.51Å; I93-L97 WeakPolarHBondContact O-CB 3.34Å; I93-L97 PolarHBondContact O-N 2.87Å; I93-P299 HydrophobicContact CD1-CB 3.6Å |
| 94 | K | 55 | Low | 46.9 | Very low | 186 Ų | 186 | 95.9 Ų | 95.9 | 81% | 0.809 | 49% | 0.494 | S | S | * | . | H | α-helix | trans | -63.8 | -29.8 | 178.9 | -80.4 | -171.2 | 172.8 | -173.1 | 0 | 113.5 | K90 K91 | K90-K94 WeakPolarHBondContact O-CB 3.38Å; K90-K94 PolarHBondContact O-N 3.45Å; K91-K94 PolarHBondContact O-N 2.94Å |
| 95 | Q | 53.6 | Low | 47.4 | Very low | 120 Ų | 120 | 94.8 Ų | 94.8 | 56% | 0.561 | 48% | 0.482 | S | S | * | . | H | α-helix | trans | -82.4 | -14.5 | 175.9 | -72 | -180 | -15.2 | 0 | 0 | 113.6 | K91 R92 I93 | K91-Q95 VanDerWaalsContact O-CB 3.28Å; K91-Q95 WeakPolarHBondContact O-CB 3.25Å; K91-Q95 VanDerWaalsContact O-CG 3.24Å; K91-Q95 WeakPolarHBondContact O-CG 3.27Å; K91-Q95 PolarHBondContact O-N 2.95Å; R92-Q95 PolarHBondContact O-N 3.41Å; I93-Q95 VanDerWaalsContact C-N 3.27Å; I93-Q95 PolarHBondContact O-N 2.97Å |
| 96 | H | 52.2 | Low | 47.2 | Very low | 54 Ų | 54 | 97.1 Ų | 97.1 | 25% | 0.25 | 49% | 0.487 | C | S | . | . | H | α-helix | trans | -130.2 | 2.4 | -169.4 | -59.1 | -37.7 | 0 | 0 | 0 | 115.5 | R92 I93 K204 K236 | R92-H96 WeakPolarHBondContact O-CB 3.43Å; R92-H96 PolarHBondContact O-CD2 2.7Å; R92-H96 VanDerWaalsContact O-CG 3.29Å; R92-H96 PolarHBondContact O-N 2.91Å; I93-H96 PolarHBondContact O-N 3.14Å; H96-K204 WeakPolarHBondContact O-CD 3.29Å; H96-K204 VanDerWaalsContact O-CE 3.3Å; H96-K204 WeakPolarHBondContact O-CE 3.43Å; H96-K204 PolarHBondContact O-NZ 3.42Å; H96-K236 WeakPolarHBondContact CE1-CE 3.49Å; H96-K236 PolarHBondContact CE1-NZ 3.44Å; H96-K236 WeakPolarHBondContact ND1-CE 3.46Å; H96-K236 PolarHBondContact ND1-NZ 3.12Å; H96-K236 WeakPolarHBondContact NE2-CE 3.44Å |
| 97 | L | 47 | Very low | 47 | Very low | 37 Ų | 37 | 101.4 Ų | 101.4 | 19% | 0.194 | 50% | 0.502 | C | S | . | . | trans | -100.3 | 35.5 | 175.8 | -84.5 | 151.2 | 0 | 0 | 0 | 115.1 | I93 L99 K204 | I93-L97 HydrophobicContact CB-CD1 3.82Å; I93-L97 HydrophobicContact CD1-CD1 3.78Å; I93-L97 HydrophobicContact CG1-CD1 3.64Å; I93-L97 HydrophobicContact CG2-CD1 3.51Å; I93-L97 WeakPolarHBondContact O-CB 3.34Å; I93-L97 PolarHBondContact O-N 2.87Å; L97-L99 PolarHBondContact O-N 3.42Å; L97-K204 HydrophobicContact CD2-CD 4.25Å | ||
| 98 | T | 49.5 | Very low | 47.1 | Very low | 118 Ų | 118 | 99.4 Ų | 99.4 | 72% | 0.724 | 50% | 0.497 | S | S | * | . | trans | -64.7 | 118.4 | 153.7 | 51.2 | 0 | 0 | 0 | 0 | 107.8 | S100 K204 | T98-S100 PolarHBondContact O-N 2.96Å; T98-K204 PolarHBondContact O-NZ 3.5Å | ||
| 99 | L | 41.9 | Very low | 46.3 | Very low | 129 Ų | 129 | 99.1 Ų | 99.1 | 68% | 0.675 | 49% | 0.49 | S | S | * | . | trans | -61.5 | 99.9 | 177.1 | -86.2 | 81.3 | 0 | 0 | 0 | 108.8 | L97 R101 | L97-L99 PolarHBondContact O-N 3.42Å; L99-R101 PolarHBondContact O-N 3.17Å | ||
| 100 | S | 41.8 | Very low | 45.8 | Very low | 94 Ų | 94 | 104.8 Ų | 104.8 | 66% | 0.657 | 52% | 0.517 | S | S | * | . | trans | -87.8 | 95.5 | 159.8 | -173.2 | 0 | 0 | 0 | 0 | 106.8 | T98 N102 | T98-S100 PolarHBondContact O-N 2.96Å; S100-N102 PolarHBondContact O-N 2.92Å | ||
| 101 | R | 46.2 | Very low | 44.8 | Very low | 215 Ų | 215 | 105.2 Ų | 105.2 | 81% | 0.811 | 53% | 0.525 | S | S | * | . | trans | -74.9 | 3.6 | -177.4 | -111.8 | 172.6 | 140.3 | 146.7 | -4.3 | 113.8 | L99 | L99-R101 PolarHBondContact O-N 3.17Š| ||
| 102 | N | 37.1 | Very low | 43.5 | Very low | 153 Ų | 153 | 103.4 Ų | 103.4 | 82% | 0.818 | 52% | 0.522 | S | S | * | . | trans | -139.3 | 48.7 | -165 | -65.5 | -29.2 | 0 | 0 | 0 | 114.7 | S100 | S100-N102 PolarHBondContact O-N 2.92Š| ||
| 103 | S | 43.8 | Very low | 42.2 | Very low | 42 Ų | 42 | 104.7 Ų | 104.7 | 29% | 0.294 | 54% | 0.54 | S | S | . | . | trans | -84.6 | 131.1 | 170.1 | 73 | 0 | 0 | 0 | 0 | 111.1 | L105 Y106 E203 | S103-L105 PolarHBondContact O-N 3.43Å; S103-L105 VanDerWaalsContact O-N 3.15Å; S103-Y106 PolarHBondContact O-N 3.01Å; S103-E203 WeakPolarHBondContact CB-OE1 3.36Å; S103-E203 PolarHBondContact OG-OE1 2.93Å; S103-E203 PolarHBondContact OG-OE2 2.99Å | ||
| 104 | S | 42.4 | Very low | 41.1 | Very low | 105 Ų | 105 | 111.4 Ų | 111.4 | 73% | 0.734 | 57% | 0.574 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -64.3 | -13.2 | 176.3 | 54.7 | 0 | 0 | 0 | 0 | 113.6 | ||
| 105 | L | 40.3 | Very low | 39.8 | Very low | 57 Ų | 57 | 106.4 Ų | 106.4 | 30% | 0.298 | 56% | 0.563 | S | S | . | * | T | Hydrogen-bonded Turn | trans | -72.8 | -29.1 | -178.3 | -67.2 | 171.8 | 0 | 0 | 0 | 112.8 | S103 K107 S108 E203 L246 | S103-L105 PolarHBondContact O-N 3.43Å; S103-L105 VanDerWaalsContact O-N 3.15Å; L105-K107 PolarHBondContact O-N 3.47Å; L105-S108 WeakPolarHBondContact O-CB 3.49Å; L105-S108 PolarHBondContact O-N 3.42Å; L105-S108 VanDerWaalsContact O-N 3.07Å; L105-E203 VanDerWaalsContact CB-OE1 3.26Å; L105-E203 WeakPolarHBondContact CB-OE1 3.33Å; L105-L246 HydrophobicContact CB-CD1 4.45Å |
| 106 | Y | 37.8 | Very low | 38.5 | Very low | 120 Ų | 120 | 106.4 Ų | 106.4 | 47% | 0.471 | 57% | 0.573 | S | S | . | * | G | 310 helix | trans | -59.7 | -33.6 | 176.7 | -171.5 | -96.5 | 0 | 0 | 0 | 112.6 | S103 S108 M109 | S103-Y106 PolarHBondContact O-N 3.01Å; Y106-S108 VanDerWaalsContact C-N 3.31Å; Y106-S108 PolarHBondContact O-N 2.87Å; Y106-M109 HydrophobicContact CD2-CE 4.13Å; Y106-M109 HydrophobicContact CE2-CE 3.8Å; Y106-M109 WeakPolarHBondContact O-CB 3.16Å; Y106-M109 PolarHBondContact O-N 3.17Å |
| 107 | K | 37.6 | Very low | 37.6 | Very low | 177 Ų | 177 | 112.4 Ų | 112.4 | 77% | 0.77 | 60% | 0.599 | S | S | * | * | G | 310 helix | trans | -68.5 | -25.9 | 177.1 | -78.9 | -178.7 | 177.6 | 178.7 | 0 | 113.6 | L105 M109 | L105-K107 PolarHBondContact O-N 3.47Å; K107-M109 VanDerWaalsContact C-N 3.27Å; K107-M109 PolarHBondContact O-N 2.73Å |
| 108 | S | 39.4 | Very low | 36.8 | Very low | 62 Ų | 62 | 120 Ų | 120 | 43% | 0.434 | 63% | 0.63 | S | S | . | * | G | 310 helix | trans | -73.7 | -18.7 | -179.3 | -173.2 | 0 | 0 | 0 | 0 | 113 | L105 Y106 H110 D111 | L105-S108 WeakPolarHBondContact O-CB 3.49Å; L105-S108 PolarHBondContact O-N 3.42Å; L105-S108 VanDerWaalsContact O-N 3.07Å; Y106-S108 VanDerWaalsContact C-N 3.31Å; Y106-S108 PolarHBondContact O-N 2.87Å; S108-H110 PolarHBondContact O-N 3.24Å; S108-D111 PolarHBondContact O-N 3.29Å |
| 109 | M | 34.9 | Very low | 35.8 | Very low | 42 Ų | 42 | 123 Ų | 123 | 21% | 0.207 | 63% | 0.634 | C | S | . | * | G | 310 helix | trans | -65.5 | -23 | -177.5 | -154.4 | 170 | 49.9 | 0 | 0 | 113.1 | Y106 K107 I202 | Y106-M109 HydrophobicContact CD2-CE 4.13Å; Y106-M109 HydrophobicContact CE2-CE 3.8Å; Y106-M109 WeakPolarHBondContact O-CB 3.16Å; Y106-M109 PolarHBondContact O-N 3.17Å; K107-M109 VanDerWaalsContact C-N 3.27Å; K107-M109 PolarHBondContact O-N 2.73Å; M109-I202 HydrophobicContact SD-CD1 3.86Å |
| 110 | H | 40.9 | Very low | 35.2 | Very low | 143 Ų | 143 | 124.2 Ų | 124.2 | 66% | 0.662 | 64% | 0.641 | S | S | * | * | G | 310 helix | trans | -77.3 | -23 | 173.7 | -65.1 | -49.8 | 0 | 0 | 0 | 113.7 | S108 S113 | S108-H110 PolarHBondContact O-N 3.24Å; H110-S113 WeakPolarHBondContact O-CB 3.5Å |
| 111 | D | 31 | Very low | 34.6 | Very low | 143 Ų | 143 | 129.4 Ų | 129.4 | 77% | 0.765 | 65% | 0.647 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -84.2 | -15.5 | 179.9 | -105.7 | -19.3 | 0 | 0 | 0 | 113.4 | S108 S113 | S108-D111 PolarHBondContact O-N 3.29Å; D111-S113 VanDerWaalsContact C-N 3.26Å |
| 112 | L | 30.6 | Very low | 34.1 | Very low | 95 Ų | 95 | 125.2 Ų | 125.2 | 50% | 0.497 | 65% | 0.648 | S | S | . | * | T | Hydrogen-bonded Turn | trans | -86.1 | 0.6 | 173.1 | -65 | 172.5 | 0 | 0 | 0 | 113.1 | I114 | L112-I114 PolarHBondContact O-N 3.13Š|
| 113 | S | 29.4 | Very low | 34 | Very low | 87 Ų | 87 | 123.6 Ų | 123.6 | 61% | 0.608 | 65% | 0.649 | S | S | * | * | S | Bend | trans | -83.6 | 82.8 | 162.9 | -179.4 | 0 | 0 | 0 | 0 | 108.4 | H110 D111 S115 | H110-S113 WeakPolarHBondContact O-CB 3.5Å; D111-S113 VanDerWaalsContact C-N 3.26Å; S113-S115 VanDerWaalsContact C-N 3.3Å; S113-S115 PolarHBondContact O-N 3.35Å |
| 114 | I | 31 | Very low | 33.3 | Very low | 160 Ų | 160 | 127.1 Ų | 127.1 | 82% | 0.821 | 67% | 0.673 | S | S | * | * | trans | -64.5 | 96.3 | 172.7 | -60.1 | 174.3 | 0 | 0 | 0 | 107.8 | L112 | L112-I114 PolarHBondContact O-N 3.13Š| ||
| 115 | S | 26.8 | Very low | 33.1 | Very low | 82 Ų | 82 | 127.2 Ų | 127.2 | 57% | 0.573 | 67% | 0.674 | S | S | * | * | trans | -73.7 | 134.7 | 159.3 | -160.2 | 0 | 0 | 0 | 0 | 107.8 | S113 K117 | S113-S115 VanDerWaalsContact C-N 3.3Å; S113-S115 PolarHBondContact O-N 3.35Å; S115-K117 PolarHBondContact O-N 3.19Å; S115-K117 VanDerWaalsContact O-N 3.11Å | ||
| 116 | P | 27.2 | Very low | 33 | Very low | 120 Ų | 120 | 129.7 Ų | 129.7 | 78% | 0.779 | 70% | 0.696 | S | S | * | * | trans | -76.8 | 104.7 | -175.2 | 30.2 | -30.7 | 0 | 0 | 0 | 109.1 | ||||
| 117 | K | 32.5 | Very low | 33.1 | Very low | 179 Ų | 179 | 128.6 Ų | 128.6 | 78% | 0.778 | 71% | 0.706 | S | S | * | * | trans | -132 | 101 | 171.2 | -76.5 | -172.8 | -179.7 | 173.7 | 0 | 113.2 | S115 | S115-K117 PolarHBondContact O-N 3.19Å; S115-K117 VanDerWaalsContact O-N 3.11Å | ||
| 118 | K | 31.5 | Very low | 33.2 | Very low | 196 Ų | 196 | 125.2 Ų | 125.2 | 85% | 0.852 | 70% | 0.704 | S | S | * | * | trans | 63.3 | 101.7 | 135.6 | -63.4 | -174.1 | 176.3 | -175.3 | 0 | 118.5 | ||||
| 119 | F | 27.8 | Very low | 33.1 | Very low | 182 Ų | 182 | 127.5 Ų | 127.5 | 80% | 0.798 | 72% | 0.716 | S | S | * | * | trans | -62.4 | 129.7 | 150 | -103.5 | -98.3 | 0 | 0 | 0 | 110.2 | Y121 | F119-Y121 HydrophobicContact CD1-CD2 4.38Å; F119-Y121 AromaticContact CD1-CE2 3.86Å; F119-Y121 HydrophobicContact CD1-CE2 3.86Å; F119-Y121 HydrophobicContact CE1-CE2 4.33Å | ||
| 120 | N | 30.1 | Very low | 33.3 | Very low | 155 Ų | 155 | 131.2 Ų | 131.2 | 83% | 0.829 | 74% | 0.741 | S | S | * | * | trans | -123.7 | 118.2 | 164.3 | -113 | 10.8 | 0 | 0 | 0 | 107.7 | ||||
| 121 | Y | 27.7 | Very low | 33.1 | Very low | 203 Ų | 203 | 129.8 Ų | 129.8 | 80% | 0.796 | 74% | 0.743 | S | S | * | * | P | Polyproline II helix | trans | -89 | 134.3 | 167.1 | -81.7 | -90 | 0 | 0 | 0 | 109.1 | F119 | F119-Y121 HydrophobicContact CD1-CD2 4.38Å; F119-Y121 AromaticContact CD1-CE2 3.86Å; F119-Y121 HydrophobicContact CD1-CE2 3.86Å; F119-Y121 HydrophobicContact CE1-CE2 4.33Å |
| 122 | P | 36.3 | Very low | 33.5 | Very low | 127 Ų | 127 | 129 Ų | 129 | 83% | 0.825 | 74% | 0.743 | S | S | * | * | P | Polyproline II helix | trans | -92 | 122.3 | 167.3 | 23.3 | -10.5 | 0 | 0 | 0 | 110.8 | ||
| 123 | S | 34.9 | Very low | 34.1 | Very low | 119 Ų | 119 | 131 Ų | 131 | 83% | 0.832 | 76% | 0.759 | S | S | * | * | P | Polyproline II helix | trans | -83.1 | 147.2 | 166.8 | 42.7 | 0 | 0 | 0 | 0 | 111.5 | ||
| 124 | S | 30 | Very low | 34.7 | Very low | 115 Ų | 115 | 132.2 Ų | 132.2 | 80% | 0.804 | 77% | 0.766 | S | S | * | * | P | Polyproline II helix | trans | -63.3 | 146.8 | -176.5 | 49.9 | 0 | 0 | 0 | 0 | 116.3 | ||
| 125 | S | 37.5 | Very low | 35.1 | Very low | 108 Ų | 108 | 132.3 Ų | 132.3 | 76% | 0.755 | 77% | 0.768 | S | S | * | * | trans | -167.5 | 128.9 | 137.7 | 44.7 | 0 | 0 | 0 | 0 | 112.5 | ||||
| 126 | S | 37.5 | Very low | 35.6 | Very low | 108 Ų | 108 | 132.8 Ų | 132.8 | 76% | 0.755 | 77% | 0.771 | S | S | * | * | trans | 33.6 | 139.1 | 141.4 | 54 | 0 | 0 | 0 | 0 | 120 | ||||
| 127 | S | 40 | Very low | 36.1 | Very low | 98 Ų | 98 | 134.5 Ų | 134.5 | 69% | 0.685 | 77% | 0.773 | S | S | * | * | cis | 174.5 | 153.2 | 25.8 | 30.4 | 0 | 0 | 0 | 0 | 109.1 | ||||
| 128 | S | 39.4 | Very low | 36.2 | Very low | 105 Ų | 105 | 133.5 Ų | 133.5 | 73% | 0.734 | 78% | 0.775 | S | S | * | * | trans | 59.4 | 143.6 | 146 | 56 | 0 | 0 | 0 | 0 | 121.3 | ||||
| 129 | T | 38.6 | Very low | 36.5 | Very low | 111 Ų | 111 | 129.1 Ų | 129.1 | 68% | 0.681 | 77% | 0.765 | S | S | * | * | cis | -175.2 | 143.2 | -10 | -64 | 0 | 0 | 0 | 0 | 105.8 | ||||
| 130 | T | 39 | Very low | 36.6 | Very low | 119 Ų | 119 | 125.8 Ų | 125.8 | 73% | 0.73 | 76% | 0.759 | S | S | * | * | trans | 60.1 | 148.1 | 152.4 | 51.5 | 0 | 0 | 0 | 0 | 120.7 | ||||
| 131 | T | 35.4 | Very low | 36.7 | Very low | 113 Ų | 113 | 126.7 Ų | 126.7 | 69% | 0.693 | 76% | 0.756 | S | S | * | * | cis | -179.3 | 146.5 | -10.3 | 24.4 | 0 | 0 | 0 | 0 | 104.9 | ||||
| 132 | T | 40.1 | Very low | 37 | Very low | 127 Ų | 127 | 123.8 Ų | 123.8 | 78% | 0.779 | 75% | 0.754 | S | S | * | * | trans | 144.3 | 99.1 | 136.9 | 46.4 | 0 | 0 | 0 | 0 | 115 | ||||
| 133 | T | 43.3 | Very low | 36.8 | Very low | 136 Ų | 136 | 123.4 Ų | 123.4 | 83% | 0.834 | 76% | 0.755 | S | S | * | * | 64.8 | 151.2 | 130 | 42.5 | 0 | 0 | 0 | 0 | 123.6 | |||||
| 134 | P | 41.8 | Very low | 36.7 | Very low | 114 Ų | 114 | 122.7 Ų | 122.7 | 74% | 0.74 | 75% | 0.75 | S | S | * | * | trans | -118.8 | 171.1 | -139.7 | 41.1 | -27.8 | 0 | 0 | 0 | 113.8 | ||||
| 135 | N | 39.3 | Very low | 36.9 | Very low | 162 Ų | 162 | 122.5 Ų | 122.5 | 87% | 0.866 | 75% | 0.749 | S | S | * | * | trans | -141.2 | 134.6 | 157.1 | -114.8 | -11.6 | 0 | 0 | 0 | 112.6 | ||||
| 136 | S | 38.7 | Very low | 36.8 | Very low | 92 Ų | 92 | 121.9 Ų | 121.9 | 64% | 0.643 | 74% | 0.744 | S | S | * | * | trans | -31.8 | 134.8 | 174.1 | 50.3 | 0 | 0 | 0 | 0 | 117.7 | ||||
| 137 | N | 37.5 | Very low | 36.4 | Very low | 155 Ų | 155 | 122.2 Ų | 122.2 | 83% | 0.829 | 75% | 0.746 | S | S | * | * | -167.7 | 97.1 | 122.8 | -87.5 | -25.5 | 0 | 0 | 0 | 108.9 | V139 | N137-V139 PolarHBondContact O-N 3.03Š| |||
| 138 | I | 34.7 | Very low | 36.3 | Very low | 159 Ų | 159 | 125 Ų | 125 | 82% | 0.815 | 75% | 0.752 | S | S | * | * | trans | -79.9 | 109.3 | 169.1 | -68.6 | 172.9 | 0 | 0 | 0 | 106.7 | ||||
| 139 | V | 37.1 | Very low | 35.9 | Very low | 104 Ų | 104 | 124 Ų | 124 | 63% | 0.63 | 75% | 0.745 | S | S | * | * | trans | -108.2 | 103.1 | 161.3 | -175.2 | 0 | 0 | 0 | 0 | 107.1 | N137 F141 | N137-V139 PolarHBondContact O-N 3.03Å; V139-F141 HydrophobicContact CB-CD2 4.49Å; V139-F141 HydrophobicContact CB-CE2 4.29Å; V139-F141 HydrophobicContact CG1-CD2 3.68Å; V139-F141 HydrophobicContact CG1-CE2 3.27Å; V139-F141 HydrophobicContact CG1-CZ 3.91Å; V139-F141 PolarHBondContact O-N 3.45Å | ||
| 140 | T | 29.3 | Very low | 35.6 | Very low | 112 Ų | 112 | 124.4 Ų | 124.4 | 69% | 0.687 | 75% | 0.752 | S | S | * | * | trans | -67.7 | 106.8 | 173.1 | -48 | 0 | 0 | 0 | 0 | 108.8 | ||||
| 141 | F | 31.6 | Very low | 35.4 | Very low | 173 Ų | 173 | 124.1 Ų | 124.1 | 76% | 0.759 | 75% | 0.751 | S | S | * | * | trans | -105.2 | 107 | 163.7 | -80.5 | -72.7 | 0 | 0 | 0 | 109 | V139 S143 | V139-F141 HydrophobicContact CB-CD2 4.49Å; V139-F141 HydrophobicContact CB-CE2 4.29Å; V139-F141 HydrophobicContact CG1-CD2 3.68Å; V139-F141 HydrophobicContact CG1-CE2 3.27Å; V139-F141 HydrophobicContact CG1-CZ 3.91Å; V139-F141 PolarHBondContact O-N 3.45Å; F141-S143 PolarHBondContact O-N 2.89Å | ||
| 142 | N | 34.7 | Very low | 35.3 | Very low | 143 Ų | 143 | 125.6 Ų | 125.6 | 77% | 0.765 | 75% | 0.754 | S | S | * | * | trans | -53.5 | 108.4 | 166 | -81.3 | -8.9 | 0 | 0 | 0 | 108.7 | S144 | N142-S144 VanDerWaalsContact C-N 3.25Å; N142-S144 PolarHBondContact O-N 3.47Å | ||
| 143 | S | 32.7 | Very low | 35.3 | Very low | 119 Ų | 119 | 125.7 Ų | 125.7 | 83% | 0.832 | 75% | 0.754 | S | S | * | * | trans | -75.8 | 87 | 164.5 | -63.6 | 0 | 0 | 0 | 0 | 107 | F141 S145 | F141-S143 PolarHBondContact O-N 2.89Å; S143-S145 VanDerWaalsContact C-N 3.33Å; S143-S145 PolarHBondContact O-N 3.15Å | ||
| 144 | S | 33.2 | Very low | 35 | Very low | 103 Ų | 103 | 125.3 Ų | 125.3 | 72% | 0.72 | 75% | 0.747 | S | S | * | * | trans | -59 | 102.8 | 161.1 | -60.3 | 0 | 0 | 0 | 0 | 107.1 | N142 S146 | N142-S144 VanDerWaalsContact C-N 3.25Å; N142-S144 PolarHBondContact O-N 3.47Å; S144-S146 PolarHBondContact O-N 3.33Å | ||
| 145 | S | 34 | Very low | 35.1 | Very low | 112 Ų | 112 | 129.2 Ų | 129.2 | 78% | 0.783 | 75% | 0.752 | S | S | * | * | trans | -62.9 | 81.5 | 168.1 | 51.8 | 0 | 0 | 0 | 0 | 108.7 | S143 S147 | S143-S145 VanDerWaalsContact C-N 3.33Å; S143-S145 PolarHBondContact O-N 3.15Å; S145-S147 PolarHBondContact O-N 3.24Å; S145-S147 VanDerWaalsContact O-N 3.15Å | ||
| 146 | S | 34.6 | Very low | 35.3 | Very low | 95 Ų | 95 | 127.1 Ų | 127.1 | 66% | 0.664 | 74% | 0.741 | S | S | * | * | trans | -76.2 | 97.6 | 163.5 | 57.1 | 0 | 0 | 0 | 0 | 107.1 | S144 I148 | S144-S146 PolarHBondContact O-N 3.33Å; S146-I148 PolarHBondContact O-N 2.95Å | ||
| 147 | S | 30.2 | Very low | 35.8 | Very low | 114 Ų | 114 | 126.9 Ų | 126.9 | 80% | 0.797 | 73% | 0.732 | S | S | * | * | trans | -41.9 | 98.6 | 156 | 44.3 | 0 | 0 | 0 | 0 | 110 | S145 S149 | S145-S147 PolarHBondContact O-N 3.24Å; S145-S147 VanDerWaalsContact O-N 3.15Å; S147-S149 PolarHBondContact O-N 3.26Å | ||
| 148 | I | 36.3 | Very low | 36.8 | Very low | 158 Ų | 158 | 122.6 Ų | 122.6 | 81% | 0.81 | 71% | 0.709 | S | S | * | * | trans | -76.4 | 104.8 | 164.6 | -64.2 | 174 | 0 | 0 | 0 | 104.8 | S146 S150 | S146-I148 PolarHBondContact O-N 2.95Å; I148-S150 PolarHBondContact O-N 3.16Å | ||
| 149 | S | 31.4 | Very low | 38.2 | Very low | 83 Ų | 83 | 115.1 Ų | 115.1 | 58% | 0.58 | 67% | 0.67 | S | S | * | * | trans | -53.7 | 128.6 | 171.3 | 54.6 | 0 | 0 | 0 | 0 | 108.9 | S147 T151 | S147-S149 PolarHBondContact O-N 3.26Å; S149-T151 PolarHBondContact O-N 3.5Å | ||
| 150 | S | 33.1 | Very low | 39.5 | Very low | 120 Ų | 120 | 116.9 Ų | 116.9 | 84% | 0.839 | 67% | 0.672 | S | S | * | * | trans | -54.1 | 89.8 | 158.8 | 45.6 | 0 | 0 | 0 | 0 | 108.2 | I148 N152 | I148-S150 PolarHBondContact O-N 3.16Å; S150-N152 PolarHBondContact O-N 3.1Å | ||
| 151 | T | 34.1 | Very low | 42.2 | Very low | 113 Ų | 113 | 114.8 Ų | 114.8 | 69% | 0.693 | 66% | 0.656 | S | S | * | * | trans | -68 | 104.7 | 170.6 | 32.9 | 0 | 0 | 0 | 0 | 107.2 | S149 V153 | S149-T151 PolarHBondContact O-N 3.5Å; T151-V153 PolarHBondContact O-N 3.25Å | ||
| 152 | N | 33 | Very low | 45 | Very low | 143 Ų | 143 | 107 Ų | 107 | 77% | 0.765 | 62% | 0.623 | S | S | * | * | trans | -48.7 | 87.6 | 165 | -151.5 | -20.5 | 0 | 0 | 0 | 108.1 | S150 N154 | S150-N152 PolarHBondContact O-N 3.1Å; N152-N154 VanDerWaalsContact C-N 3.3Å; N152-N154 PolarHBondContact O-N 3.2Å | ||
| 153 | V | 41 | Very low | 47.6 | Very low | 130 Ų | 130 | 103.1 Ų | 103.1 | 79% | 0.788 | 61% | 0.606 | S | S | * | * | trans | -64.3 | 101.6 | 168.4 | -92.5 | 0 | 0 | 0 | 0 | 105.5 | T151 K155 | T151-V153 PolarHBondContact O-N 3.25Å; V153-K155 PolarHBondContact O-N 3.39Å | ||
| 154 | N | 36.8 | Very low | 50.3 | Low | 127 Ų | 127 | 103 Ų | 103 | 68% | 0.679 | 60% | 0.596 | S | S | * | * | trans | -28.4 | 111.5 | 176.6 | -77.2 | -28.9 | 0 | 0 | 0 | 111.6 | N152 L156 | N152-N154 VanDerWaalsContact C-N 3.3Å; N152-N154 PolarHBondContact O-N 3.2Å; N154-L156 HydrophobicContact CB-CB 4.16Å; N154-L156 HydrophobicContact CB-CD1 4.04Å; N154-L156 HydrophobicContact CB-CG 4.41Å; N154-L156 PolarHBondContact O-N 3.28Å | ||
| 155 | K | 43.5 | Very low | 53.1 | Low | 196 Ų | 196 | 103.1 Ų | 103.1 | 85% | 0.852 | 59% | 0.588 | S | S | * | * | trans | -61.2 | 20.2 | 165.2 | -160.2 | 178.7 | -179.3 | -180 | 0 | 112.5 | V153 | V153-K155 PolarHBondContact O-N 3.39Š| ||
| 156 | L | 43.3 | Very low | 56 | Low | 118 Ų | 118 | 98.7 Ų | 98.7 | 62% | 0.618 | 56% | 0.556 | S | S | * | * | trans | -98.3 | 109.6 | -172.1 | -72.9 | 156.8 | 0 | 0 | 0 | 108.6 | N154 | N154-L156 HydrophobicContact CB-CB 4.16Å; N154-L156 HydrophobicContact CB-CD1 4.04Å; N154-L156 HydrophobicContact CB-CG 4.41Å; N154-L156 PolarHBondContact O-N 3.28Å | ||
| 157 | N | 48.9 | Very low | 59 | Low | 88 Ų | 88 | 97.4 Ų | 97.4 | 47% | 0.471 | 54% | 0.544 | S | S | . | . | trans | 78.2 | 45.2 | 157.5 | -43.4 | -25.9 | 0 | 0 | 0 | 116.9 | Q160 | N157-Q160 HydrophobicContact CB-CG 4.13Å; N157-Q160 PolarHBondContact OD1-NE2 3.1Å | ||
| 158 | L | 59.9 | Low | 62.2 | Low | 65 Ų | 65 | 95.5 Ų | 95.5 | 34% | 0.34 | 53% | 0.53 | S | S | . | . | S | Bend | trans | -102.6 | 118.7 | 172.5 | -155.3 | 81 | 0 | 0 | 0 | 110 | Q160 C277 R278 V280 | L158-Q160 PolarHBondContact O-N 2.8Å; L158-C277 WeakPolarHBondContact CD2-O 3.5Å; L158-R278 WeakPolarHBondContact CD2-O 3.27Å; L158-V280 WeakPolarHBondContact CD1-O 3.28Å; L158-V280 WeakPolarHBondContact CG-O 3.24Å |
| 159 | T | 63.3 | Low | 65 | Low | 1 Ų | 1 | 88.4 Ų | 88.4 | 1% | 0.006 | 49% | 0.494 | C | S | . | . | S | Bend | trans | 56.5 | 45.6 | -179.3 | 63.6 | 0 | 0 | 0 | 0 | 114.5 | D161 V162 V280 P281 L330 F334 | T159-D161 PolarHBondContact O-N 3.49Å; T159-D161 VanDerWaalsContact O-N 3.17Å; T159-V162 PolarHBondContact O-N 3.27Å; T159-V280 WeakPolarHBondContact CG2-O 3.24Å; T159-P281 WeakPolarHBondContact CA-O 3.26Å; T159-P281 PolarHBondContact N-O 3.15Å; T159-L330 HydrophobicContact CG2-CD1 4.2Å; T159-L330 HydrophobicContact CG2-CD2 3.81Å; T159-L330 HydrophobicContact CG2-CG 4.46Å; T159-F334 WeakPolarHBondContact OG1-CD2 3.49Å; T159-F334 WeakPolarHBondContact OG1-CE2 3.25Å |
| 160 | Q | 64.9 | Low | 68.2 | Low | 142 Ų | 142 | 87.4 Ų | 87.4 | 66% | 0.664 | 48% | 0.48 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -64.5 | -16.5 | -179.2 | -66.6 | -168 | -48.8 | 0 | 0 | 114.4 | N157 L158 | N157-Q160 HydrophobicContact CB-CG 4.13Å; N157-Q160 PolarHBondContact OD1-NE2 3.1Å; L158-Q160 PolarHBondContact O-N 2.8Å |
| 161 | D | 85.8 | Confident | 71.3 | Confident | 67 Ų | 67 | 85.1 Ų | 85.1 | 36% | 0.358 | 46% | 0.459 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -103.8 | 13.4 | -172.6 | 63.9 | -30.1 | 0 | 0 | 0 | 113.3 | T159 P163 T282 I283 | T159-D161 PolarHBondContact O-N 3.49Å; T159-D161 VanDerWaalsContact O-N 3.17Å; D161-P163 VanDerWaalsContact O-CD 3.25Å; D161-P163 WeakPolarHBondContact O-CD 3.39Å; D161-T282 VanDerWaalsContact OD1-CA 3.26Å; D161-T282 WeakPolarHBondContact OD1-CA 3.42Å; D161-T282 WeakPolarHBondContact OD2-CB 3.48Å; D161-T282 PolarHBondContact OD2-OG1 3.19Å; D161-I283 PolarHBondContact OD1-N 3.17Å; D161-I283 PolarHBondContact OD2-N 2.75Å |
| 162 | V | 89.7 | Confident | 74.3 | Confident | 9 Ų | 9 | 82.3 Ų | 82.3 | 6% | 0.055 | 44% | 0.438 | C | S | . | . | trans | -72.5 | 116.1 | 171.4 | -179.2 | 0 | 0 | 0 | 0 | 109.1 | T159 I166 I283 L330 A331 F334 K339 | T159-V162 PolarHBondContact O-N 3.27Å; V162-I166 HydrophobicContact CG1-CG2 4.28Å; V162-I283 HydrophobicContact CG2-CB 4.02Å; V162-I283 HydrophobicContact CG2-CD1 3.99Å; V162-I283 HydrophobicContact CG2-CG2 4.23Å; V162-L330 HydrophobicContact CG2-CD2 3.98Å; V162-A331 HydrophobicContact CG1-CB 4.08Å; V162-F334 HydrophobicContact CB-CD1 3.67Å; V162-F334 HydrophobicContact CB-CE1 3.98Å; V162-F334 HydrophobicContact CB-CG 4.25Å; V162-F334 HydrophobicContact CG1-CB 4.4Å; V162-F334 HydrophobicContact CG1-CD1 3.77Å; V162-F334 HydrophobicContact CG1-CE1 4.47Å; V162-F334 HydrophobicContact CG1-CG 4.36Å; V162-F334 HydrophobicContact CG2-CB 4.41Å; V162-F334 HydrophobicContact CG2-CD1 4.05Å; V162-F334 HydrophobicContact CG2-CG 4.13Å; V162-K339 PolarHBondContact O-NZ 3.16Å | ||
| 163 | P | 90.5 | Very high | 77.4 | Confident | 62 Ų | 62 | 75.6 Ų | 75.6 | 40% | 0.403 | 40% | 0.402 | S | S | . | . | trans | -58.1 | 153.5 | 179.1 | -23.1 | 34.9 | 0 | 0 | 0 | 112.4 | D161 D165 I169 K339 | D161-P163 VanDerWaalsContact O-CD 3.25Å; D161-P163 WeakPolarHBondContact O-CD 3.39Å; P163-D165 WeakPolarHBondContact CB-O 3.45Å; P163-I169 HydrophobicContact CG-CD1 4.5Å; P163-K339 PolarHBondContact O-NZ 3.36Å | ||
| 164 | D | 88.7 | Confident | 80.1 | Confident | 117 Ų | 117 | 73 Ų | 73 | 63% | 0.626 | 38% | 0.381 | S | S | * | . | S | Bend | trans | -61 | -47.3 | 168.9 | -65.8 | -32.3 | 0 | 0 | 0 | 110.9 | I166 H335 K339 | D164-I166 PolarHBondContact O-N 2.97Å; D164-H335 PolarHBondContact O-CE1 3.34Å; D164-H335 VanDerWaalsContact O-CE1 3.26Å; D164-H335 PolarHBondContact O-NE2 2.63Å; D164-K339 WeakPolarHBondContact OD1-CD 3.36Å; D164-K339 VanDerWaalsContact OD1-CE 3.25Å; D164-K339 WeakPolarHBondContact OD1-CE 3.47Å; D164-K339 IonicContact OD1-NZ 3.42Å; D164-K339 PolarHBondContact OD1-NZ 2.75Å |
| 165 | D | 93 | Very high | 83 | Confident | 106 Ų | 106 | 71.9 Ų | 71.9 | 57% | 0.567 | 38% | 0.375 | S | S | * | . | trans | -89.5 | 107.3 | 173.5 | -177.3 | 13.8 | 0 | 0 | 0 | 111.1 | P163 T167 | P163-D165 WeakPolarHBondContact CB-O 3.45Å; D165-T167 VanDerWaalsContact C-N 3.32Å; D165-T167 WeakPolarHBondContact OD1-CB 3.35Å; D165-T167 PolarHBondContact OD1-N 3.2Å; D165-T167 PolarHBondContact OD1-OG1 3.4Å | ||
| 166 | I | 95 | Very high | 85.5 | Confident | 19 Ų | 19 | 62.6 Ų | 62.6 | 10% | 0.097 | 34% | 0.335 | C | S | . | . | trans | -89.1 | 4.9 | 177.8 | 67.6 | 170.7 | 0 | 0 | 0 | 113.1 | V162 D164 S168 I169 Q170 Y328 A331 K332 H335 | V162-I166 HydrophobicContact CG1-CG2 4.28Å; D164-I166 PolarHBondContact O-N 2.97Å; I166-S168 VanDerWaalsContact C-N 3.28Å; I166-S168 PolarHBondContact O-N 3.45Å; I166-I169 WeakPolarHBondContact O-CB 3.49Å; I166-I169 PolarHBondContact O-N 3.4Å; I166-Q170 PolarHBondContact O-N 3.19Å; I166-Y328 HydrophobicContact CD1-CE2 4.19Å; I166-A331 HydrophobicContact CB-CB 4.38Å; I166-A331 HydrophobicContact CG2-CB 3.98Å; I166-K332 HydrophobicContact CD1-CB 4.24Å; I166-H335 HydrophobicContact CD1-CB 4.49Å | ||
| 167 | T | 96.6 | Very high | 88 | Confident | 67 Ų | 67 | 58.3 Ų | 58.3 | 41% | 0.411 | 31% | 0.313 | S | S | . | . | H | α-helix | trans | -57.3 | -40 | -177.8 | -57.3 | 0 | 0 | 0 | 0 | 111.8 | D165 I169 Q170 N171 | D165-T167 VanDerWaalsContact C-N 3.32Å; D165-T167 WeakPolarHBondContact OD1-CB 3.35Å; D165-T167 PolarHBondContact OD1-N 3.2Å; D165-T167 PolarHBondContact OD1-OG1 3.4Å; T167-I169 VanDerWaalsContact C-N 3.34Å; T167-I169 PolarHBondContact O-N 2.84Å; T167-Q170 PolarHBondContact O-N 2.91Å; T167-N171 WeakPolarHBondContact O-CB 3.43Å; T167-N171 PolarHBondContact O-N 2.75Å; T167-N171 PolarHBondContact O-ND2 2.88Å; T167-N171 PolarHBondContact O-OD1 3.31Å |
| 168 | S | 96.6 | Very high | 90.3 | Very high | 74 Ų | 74 | 58.8 Ų | 58.8 | 52% | 0.517 | 32% | 0.315 | S | S | . | . | H | α-helix | trans | -60.1 | -43.4 | 174.9 | -171.2 | 0 | 0 | 0 | 0 | 112 | I166 Q170 N171 E172 | I166-S168 VanDerWaalsContact C-N 3.28Å; I166-S168 PolarHBondContact O-N 3.45Å; S168-Q170 VanDerWaalsContact C-N 3.35Å; S168-N171 PolarHBondContact O-N 3.47Å; S168-E172 WeakPolarHBondContact O-CB 3.46Å; S168-E172 VanDerWaalsContact O-CG 3.24Å; S168-E172 WeakPolarHBondContact O-CG 3.38Å; S168-E172 PolarHBondContact O-N 2.91Å |
| 169 | I | 96.8 | Very high | 92 | Very high | 10 Ų | 10 | 58.4 Ų | 58.4 | 5% | 0.051 | 32% | 0.316 | C | S | . | . | H | α-helix | trans | -68.3 | -37.8 | 179.6 | -59 | 174.4 | 0 | 0 | 0 | 110.5 | P163 I166 T167 E172 H173 I283 K327 Y328 A331 | P163-I169 HydrophobicContact CG-CD1 4.5Å; I166-I169 WeakPolarHBondContact O-CB 3.49Å; I166-I169 PolarHBondContact O-N 3.4Å; T167-I169 VanDerWaalsContact C-N 3.34Å; T167-I169 PolarHBondContact O-N 2.84Å; I169-E172 WeakPolarHBondContact O-CB 3.3Å; I169-H173 PolarHBondContact O-N 2.93Å; I169-I283 HydrophobicContact CD1-CD1 3.81Å; I169-K327 HydrophobicContact CG2-CD 4.35Å; I169-K327 HydrophobicContact CG2-CG 4.07Å; I169-Y328 HydrophobicContact CG2-CD2 4.31Å; I169-A331 HydrophobicContact CD1-CB 3.92Å; I169-A331 HydrophobicContact CG2-CB 4.3Å |
| 170 | Q | 97.8 | Very high | 93.5 | Very high | 61 Ų | 61 | 58.4 Ų | 58.4 | 29% | 0.285 | 32% | 0.315 | S | S | . | . | H | α-helix | trans | -63.1 | -48.7 | 174 | -178.4 | 172 | -22.6 | 0 | 0 | 111.6 | I166 T167 S168 E172 H173 E174 Y328 | I166-Q170 PolarHBondContact O-N 3.19Å; T167-Q170 PolarHBondContact O-N 2.91Å; S168-Q170 VanDerWaalsContact C-N 3.35Å; Q170-E172 VanDerWaalsContact C-N 3.31Å; Q170-E172 PolarHBondContact O-N 2.98Å; Q170-H173 WeakPolarHBondContact O-CB 3.26Å; Q170-H173 PolarHBondContact O-N 2.71Å; Q170-H173 VanDerWaalsContact O-N 3.12Å; Q170-E174 HydrophobicContact CG-CG 4.37Å; Q170-E174 VanDerWaalsContact CG-OE1 3.31Å; Q170-E174 WeakPolarHBondContact CG-OE1 3.3Å; Q170-E174 PolarHBondContact NE2-OE1 2.97Å; Q170-E174 WeakPolarHBondContact O-CG 3.37Å; Q170-E174 PolarHBondContact O-N 3.35Å; Q170-Y328 HydrophobicContact CB-CD2 3.98Å; Q170-Y328 HydrophobicContact CB-CE2 3.51Å; Q170-Y328 HydrophobicContact CG-CE1 4.35Å; Q170-Y328 HydrophobicContact CG-CE2 3.81Å; Q170-Y328 PolarHBondContact OE1-OH 3.16Å; Q170-Y328 VanDerWaalsContact OE1-OH 3.14Å |
| 171 | N | 98 | Very high | 94.9 | Very high | 73 Ų | 73 | 54.4 Ų | 54.4 | 39% | 0.39 | 30% | 0.301 | S | S | . | . | H | α-helix | trans | -62 | -39.7 | 178.7 | -67.9 | -14 | 0 | 0 | 0 | 111.6 | T167 S168 H173 E174 N175 | T167-N171 WeakPolarHBondContact O-CB 3.43Å; T167-N171 PolarHBondContact O-N 2.75Å; T167-N171 PolarHBondContact O-ND2 2.88Å; T167-N171 PolarHBondContact O-OD1 3.31Å; S168-N171 PolarHBondContact O-N 3.47Å; N171-H173 VanDerWaalsContact C-N 3.35Å; N171-E174 PolarHBondContact O-N 3.24Å; N171-N175 WeakPolarHBondContact O-CB 3.41Å; N171-N175 PolarHBondContact O-N 2.99Å; N171-N175 PolarHBondContact O-ND2 3.21Å; N171-N175 VanDerWaalsContact O-ND2 3.12Å |
| 172 | E | 97.6 | Very high | 95.3 | Very high | 53 Ų | 53 | 55.1 Ų | 55.1 | 25% | 0.248 | 31% | 0.311 | C | S | . | . | H | α-helix | trans | -56.5 | -48 | 172.3 | -78.3 | 177.8 | -165.9 | 0 | 0 | 111.6 | S168 I169 Q170 A176 R324 K327 | S168-E172 WeakPolarHBondContact O-CB 3.46Å; S168-E172 VanDerWaalsContact O-CG 3.24Å; S168-E172 WeakPolarHBondContact O-CG 3.38Å; S168-E172 PolarHBondContact O-N 2.91Å; I169-E172 WeakPolarHBondContact O-CB 3.3Å; Q170-E172 VanDerWaalsContact C-N 3.31Å; Q170-E172 PolarHBondContact O-N 2.98Å; E172-A176 PolarHBondContact O-N 3.31Å; E172-A176 VanDerWaalsContact O-N 3.17Å; E172-R324 VanDerWaalsContact CB-NH1 3.32Å; E172-R324 VanDerWaalsContact O-CD 3.22Å; E172-R324 WeakPolarHBondContact O-CD 3.31Å; E172-R324 IonicContact OE2-NH1 3.23Å; E172-K327 IonicContact OE2-NZ 2.92Å; E172-K327 PolarHBondContact OE2-NZ 3.16Å |
| 173 | H | 97.4 | Very high | 95.6 | Very high | 3 Ų | 3 | 55.7 Ų | 55.7 | 1% | 0.014 | 31% | 0.313 | C | S | . | . | H | α-helix | trans | -60.2 | -51 | 175.8 | 164.5 | 69.9 | 0 | 0 | 0 | 112.3 | I169 Q170 N171 N175 A176 L177 E266 T325 Y328 | I169-H173 PolarHBondContact O-N 2.93Å; Q170-H173 WeakPolarHBondContact O-CB 3.26Å; Q170-H173 PolarHBondContact O-N 2.71Å; Q170-H173 VanDerWaalsContact O-N 3.12Å; N171-H173 VanDerWaalsContact C-N 3.35Å; H173-N175 VanDerWaalsContact C-N 3.33Å; H173-N175 PolarHBondContact O-N 3.04Å; H173-A176 PolarHBondContact O-N 3.47Å; H173-A176 VanDerWaalsContact O-N 3.16Å; H173-L177 PolarHBondContact O-N 3.41Å; H173-E266 IonicContact CD2-OE1 3.13Å; H173-E266 IonicContact CE1-OE1 3.37Å; H173-E266 PolarHBondContact CE1-OE1 3.13Å; H173-E266 IonicContact NE2-OE1 2.61Å; H173-E266 PolarHBondContact NE2-OE1 2.68Å; H173-T325 VanDerWaalsContact CE1-CG2 3.5Å; H173-T325 WeakPolarHBondContact CE1-CG2 3.37Å; H173-T325 PolarHBondContact CE1-OG1 3.41Å; H173-T325 VanDerWaalsContact CE1-OG1 3.28Å; H173-T325 VanDerWaalsContact ND1-CA 3.3Å; H173-T325 WeakPolarHBondContact ND1-CA 3.12Å; H173-T325 PolarHBondContact ND1-OG1 3.46Å; H173-T325 VanDerWaalsContact ND1-OG1 3.12Å; H173-Y328 HydrophobicContact CB-CD1 4.19Å; H173-Y328 HydrophobicContact CB-CG 4.12Å; H173-Y328 AromaticContact CD2-CD1 3.59Å; H173-Y328 AromaticContact CG-CD1 3.8Å |
| 174 | E | 97.4 | Very high | 95.8 | Very high | 75 Ų | 75 | 56.1 Ų | 56.1 | 35% | 0.35 | 32% | 0.315 | S | S | . | . | H | α-helix | trans | -60.9 | -40.5 | -179.5 | -71.3 | 174.5 | -173.7 | 0 | 0 | 112 | Q170 N171 A176 L177 N178 | Q170-E174 HydrophobicContact CG-CG 4.37Å; Q170-E174 VanDerWaalsContact CG-OE1 3.31Å; Q170-E174 WeakPolarHBondContact CG-OE1 3.3Å; Q170-E174 PolarHBondContact NE2-OE1 2.97Å; Q170-E174 WeakPolarHBondContact O-CG 3.37Å; Q170-E174 PolarHBondContact O-N 3.35Å; N171-E174 PolarHBondContact O-N 3.24Å; E174-A176 PolarHBondContact O-N 2.98Å; E174-L177 WeakPolarHBondContact O-CB 3.41Å; E174-L177 PolarHBondContact O-N 3.49Å; E174-N178 WeakPolarHBondContact O-CB 3.32Å; E174-N178 PolarHBondContact O-N 3.03Å; E174-N178 PolarHBondContact O-ND2 3.3Å |
| 175 | N | 97.7 | Very high | 96.1 | Very high | 103 Ų | 103 | 57.2 Ų | 57.2 | 55% | 0.551 | 32% | 0.32 | S | S | * | . | H | α-helix | trans | -63.3 | -41 | 175.5 | -73.8 | -27.4 | 0 | 0 | 0 | 112.4 | N171 H173 N178 T179 | N171-N175 WeakPolarHBondContact O-CB 3.41Å; N171-N175 PolarHBondContact O-N 2.99Å; N171-N175 PolarHBondContact O-ND2 3.21Å; N171-N175 VanDerWaalsContact O-ND2 3.12Å; H173-N175 VanDerWaalsContact C-N 3.33Å; H173-N175 PolarHBondContact O-N 3.04Å; N175-N178 PolarHBondContact O-N 2.95Å; N175-T179 PolarHBondContact O-N 3.36Å; N175-T179 PolarHBondContact O-OG1 2.55Å |
| 176 | A | 97.2 | Very high | 96.2 | Very high | 2 Ų | 2 | 58.9 Ų | 58.9 | 2% | 0.017 | 33% | 0.325 | C | S | . | . | H | α-helix | trans | -70.4 | -36.4 | 176.6 | 0 | 0 | 0 | 0 | 0 | 112.1 | E172 H173 E174 T179 V180 Y321 R324 | E172-A176 PolarHBondContact O-N 3.31Å; E172-A176 VanDerWaalsContact O-N 3.17Å; H173-A176 PolarHBondContact O-N 3.47Å; H173-A176 VanDerWaalsContact O-N 3.16Å; E174-A176 PolarHBondContact O-N 2.98Å; A176-T179 WeakPolarHBondContact O-CB 3.34Å; A176-T179 PolarHBondContact O-N 3.04Å; A176-V180 PolarHBondContact O-N 3.4Å; A176-Y321 HydrophobicContact CB-CD2 4.27Å; A176-R324 HydrophobicContact CB-CB 4.5Å |
| 177 | L | 96.3 | Very high | 96.3 | Very high | 28 Ų | 28 | 60.5 Ų | 60.5 | 15% | 0.147 | 33% | 0.332 | C | S | . | . | H | α-helix | trans | -60.1 | -47.8 | 171.6 | 178.9 | 60.2 | 0 | 0 | 0 | 111.4 | H173 E174 T179 V180 T181 T262 Y321 | H173-L177 PolarHBondContact O-N 3.41Å; E174-L177 WeakPolarHBondContact O-CB 3.41Å; E174-L177 PolarHBondContact O-N 3.49Å; L177-T179 PolarHBondContact O-N 3.01Å; L177-V180 HydrophobicContact CD1-CG2 4.49Å; L177-V180 WeakPolarHBondContact O-CG2 3.29Å; L177-V180 PolarHBondContact O-N 2.98Å; L177-T181 HydrophobicContact CD1-CG2 3.9Å; L177-T181 HydrophobicContact CG-CG2 4.4Å; L177-T181 WeakPolarHBondContact O-CB 3.15Å; L177-T181 VanDerWaalsContact O-CG2 3.3Å; L177-T181 WeakPolarHBondContact O-CG2 3.48Å; L177-T181 PolarHBondContact O-N 3.26Å; L177-T181 PolarHBondContact O-OG1 3.41Å; L177-T262 HydrophobicContact CD1-CG2 3.98Å; L177-Y321 HydrophobicContact CB-CD2 4.18Å; L177-Y321 HydrophobicContact CB-CE2 3.78Å; L177-Y321 HydrophobicContact CD1-CE2 3.6Å; L177-Y321 HydrophobicContact CG-CE2 4.26Å |
| 178 | N | 95.5 | Very high | 96.2 | Very high | 98 Ų | 98 | 58 Ų | 58 | 52% | 0.524 | 32% | 0.316 | S | S | . | . | H | α-helix | trans | -59.9 | -36.6 | 175.6 | -71.1 | -24.9 | 0 | 0 | 0 | 111.8 | E174 N175 T181 S182 | E174-N178 WeakPolarHBondContact O-CB 3.32Å; E174-N178 PolarHBondContact O-N 3.03Å; E174-N178 PolarHBondContact O-ND2 3.3Å; N175-N178 PolarHBondContact O-N 2.95Å; N178-T181 WeakPolarHBondContact CA-OG1 3.48Å; N178-T181 PolarHBondContact O-OG1 3.34Å; N178-S182 WeakPolarHBondContact O-CB 3.46Å; N178-S182 PolarHBondContact O-N 3.16Å; N178-S182 PolarHBondContact O-OG 3.28Å |
| 179 | T | 96.2 | Very high | 96.1 | Very high | 57 Ų | 57 | 59.6 Ų | 59.6 | 35% | 0.35 | 32% | 0.318 | S | S | . | . | H | α-helix | trans | -66.1 | -48.5 | 177.6 | -58.1 | 0 | 0 | 0 | 0 | 111.6 | N175 A176 L177 S182 F183 | N175-T179 PolarHBondContact O-N 3.36Å; N175-T179 PolarHBondContact O-OG1 2.55Å; A176-T179 WeakPolarHBondContact O-CB 3.34Å; A176-T179 PolarHBondContact O-N 3.04Å; L177-T179 PolarHBondContact O-N 3.01Å; T179-S182 PolarHBondContact O-N 2.79Å; T179-S182 PolarHBondContact O-OG 3.43Å; T179-F183 HydrophobicContact CG2-CE1 4.28Å; T179-F183 WeakPolarHBondContact O-CD1 3.37Å; T179-F183 WeakPolarHBondContact O-CE1 3.4Å |
| 180 | V | 95.4 | Very high | 96 | Very high | 0 Ų | 0 | 62 Ų | 62 | 0% | 0 | 33% | 0.331 | C | S | . | . | H | α-helix | trans | -75.2 | -27 | -177.6 | -61 | 0 | 0 | 0 | 0 | 113.5 | A176 L177 S182 F183 L259 T262 I318 Y321 | A176-V180 PolarHBondContact O-N 3.4Å; L177-V180 HydrophobicContact CD1-CG2 4.49Å; L177-V180 WeakPolarHBondContact O-CG2 3.29Å; L177-V180 PolarHBondContact O-N 2.98Å; V180-S182 VanDerWaalsContact C-N 3.31Å; V180-F183 HydrophobicContact CG1-CZ 4.17Å; V180-L259 HydrophobicContact CB-CD2 4.11Å; V180-L259 HydrophobicContact CG2-CD2 4.11Å; V180-T262 HydrophobicContact CG2-CG2 4.32Å; V180-I318 HydrophobicContact CB-CD1 4.41Å; V180-I318 HydrophobicContact CG1-CD1 3.94Å; V180-Y321 HydrophobicContact CG1-CD1 4.29Å; V180-Y321 HydrophobicContact CG1-CG 4Å; V180-Y321 HydrophobicContact CG2-CD1 3.84Å; V180-Y321 HydrophobicContact CG2-CD2 4.02Å; V180-Y321 HydrophobicContact CG2-CE1 4.17Å; V180-Y321 HydrophobicContact CG2-CE2 4.35Å; V180-Y321 HydrophobicContact CG2-CG 3.75Å |
| 181 | T | 93.9 | Very high | 95.9 | Very high | 58 Ų | 58 | 59.1 Ų | 59.1 | 36% | 0.356 | 32% | 0.317 | S | S | . | . | H | α-helix | trans | -77.1 | -19.6 | 175.8 | 51.3 | 0 | 0 | 0 | 0 | 112.6 | L177 N178 T262 | L177-T181 HydrophobicContact CD1-CG2 3.9Å; L177-T181 HydrophobicContact CG-CG2 4.4Å; L177-T181 WeakPolarHBondContact O-CB 3.15Å; L177-T181 VanDerWaalsContact O-CG2 3.3Å; L177-T181 WeakPolarHBondContact O-CG2 3.48Å; L177-T181 PolarHBondContact O-N 3.26Å; L177-T181 PolarHBondContact O-OG1 3.41Å; N178-T181 WeakPolarHBondContact CA-OG1 3.48Å; N178-T181 PolarHBondContact O-OG1 3.34Å; T181-T262 HydrophobicContact CG2-CG2 3.72Å |
| 182 | S | 94.8 | Very high | 95.8 | Very high | 83 Ų | 83 | 59.5 Ų | 59.5 | 58% | 0.58 | 32% | 0.317 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -91.6 | 6.8 | 175.8 | 57.2 | 0 | 0 | 0 | 0 | 114.2 | N178 T179 V180 T184 | N178-S182 WeakPolarHBondContact O-CB 3.46Å; N178-S182 PolarHBondContact O-N 3.16Å; N178-S182 PolarHBondContact O-OG 3.28Å; T179-S182 PolarHBondContact O-N 2.79Å; T179-S182 PolarHBondContact O-OG 3.43Å; V180-S182 VanDerWaalsContact C-N 3.31Å; S182-T184 PolarHBondContact O-N 2.78Å |
| 183 | F | 95.5 | Very high | 95.7 | Very high | 21 Ų | 21 | 60.4 Ų | 60.4 | 9% | 0.092 | 33% | 0.326 | C | S | . | . | trans | -59.2 | 135.4 | 177 | -80.6 | 7 | 0 | 0 | 0 | 112.3 | T179 V180 Q187 L188 L191 T314 I318 | T179-F183 HydrophobicContact CG2-CE1 4.28Å; T179-F183 WeakPolarHBondContact O-CD1 3.37Å; T179-F183 WeakPolarHBondContact O-CE1 3.4Å; V180-F183 HydrophobicContact CG1-CZ 4.17Å; F183-Q187 HydrophobicContact CB-CB 4.36Å; F183-Q187 HydrophobicContact CG-CB 4.41Å; F183-L188 HydrophobicContact CB-CD2 4.07Å; F183-L188 HydrophobicContact CB-CG 4.12Å; F183-L188 HydrophobicContact CD2-CD2 4.02Å; F183-L191 HydrophobicContact CE2-CD2 4.37Å; F183-T314 HydrophobicContact CD2-CG2 4.2Å; F183-T314 HydrophobicContact CE2-CG2 3.57Å; F183-T314 HydrophobicContact CZ-CG2 3.89Å; F183-I318 HydrophobicContact CD2-CD1 4.42Å; F183-I318 HydrophobicContact CE2-CD1 3.59Å; F183-I318 HydrophobicContact CE2-CG1 3.64Å; F183-I318 HydrophobicContact CZ-CD1 4.2Å; F183-I318 HydrophobicContact CZ-CG1 4.03Å | ||
| 184 | T | 95.6 | Very high | 95.7 | Very high | 71 Ų | 71 | 60.4 Ų | 60.4 | 44% | 0.436 | 33% | 0.327 | S | S | . | . | trans | -72.8 | 160 | 173 | 72.6 | 0 | 0 | 0 | 0 | 110.7 | S182 E186 Q187 L188 | S182-T184 PolarHBondContact O-N 2.78Å; T184-E186 PolarHBondContact O-N 2.94Å; T184-E186 PolarHBondContact OG1-N 2.75Å; T184-Q187 PolarHBondContact O-N 3.2Å; T184-Q187 VanDerWaalsContact O-N 3.13Å; T184-Q187 WeakPolarHBondContact OG1-CG 3.35Å; T184-Q187 PolarHBondContact OG1-N 3.17Å; T184-L188 WeakPolarHBondContact O-CG 3.31Å; T184-L188 PolarHBondContact O-N 3.03Å | ||
| 185 | N | 94.3 | Very high | 95.7 | Very high | 139 Ų | 139 | 57 Ų | 57 | 74% | 0.743 | 31% | 0.311 | S | S | * | . | H | α-helix | trans | -57.8 | -32.8 | 173.9 | -69.5 | -27.7 | 0 | 0 | 0 | 112.4 | L189 | N185-L189 WeakPolarHBondContact O-CB 3.48Å; N185-L189 PolarHBondContact O-N 3.1Å |
| 186 | E | 95 | Very high | 95.6 | Very high | 142 Ų | 142 | 55.1 Ų | 55.1 | 66% | 0.664 | 31% | 0.305 | S | S | * | . | H | α-helix | trans | -65.6 | -46.6 | 175.5 | -178.1 | 177.5 | -171.7 | 0 | 0 | 111.5 | T184 L188 L189 L190 | T184-E186 PolarHBondContact O-N 2.94Å; T184-E186 PolarHBondContact OG1-N 2.75Å; E186-L188 VanDerWaalsContact C-N 3.34Å; E186-L188 PolarHBondContact O-N 3.45Å; E186-L189 PolarHBondContact O-N 2.89Å; E186-L190 HydrophobicContact CG-CD1 4.35Å; E186-L190 WeakPolarHBondContact O-CB 3.37Å; E186-L190 WeakPolarHBondContact O-CG 3.49Å; E186-L190 PolarHBondContact O-N 3.33Å |
| 187 | Q | 96 | Very high | 95.4 | Very high | 52 Ų | 52 | 56.9 Ų | 56.9 | 24% | 0.243 | 31% | 0.314 | C | S | . | . | H | α-helix | trans | -61.5 | -42 | 175.9 | -71.6 | 172.8 | -48.6 | 0 | 0 | 111.8 | F183 T184 L190 L191 T314 | F183-Q187 HydrophobicContact CB-CB 4.36Å; F183-Q187 HydrophobicContact CG-CB 4.41Å; T184-Q187 PolarHBondContact O-N 3.2Å; T184-Q187 VanDerWaalsContact O-N 3.13Å; T184-Q187 WeakPolarHBondContact OG1-CG 3.35Å; T184-Q187 PolarHBondContact OG1-N 3.17Å; Q187-L190 PolarHBondContact O-N 3.24Å; Q187-L191 WeakPolarHBondContact O-CB 3.44Å; Q187-L191 PolarHBondContact O-N 3Å; Q187-T314 HydrophobicContact CB-CG2 4.1Å |
| 188 | L | 95.1 | Very high | 95.4 | Very high | 16 Ų | 16 | 55.6 Ų | 55.6 | 8% | 0.084 | 31% | 0.307 | C | S | . | . | H | α-helix | trans | -61.9 | -43.8 | 175.8 | -68.4 | 173.9 | 0 | 0 | 0 | 111.8 | F183 T184 E186 L191 Q192 L259 | F183-L188 HydrophobicContact CB-CD2 4.07Å; F183-L188 HydrophobicContact CB-CG 4.12Å; F183-L188 HydrophobicContact CD2-CD2 4.02Å; T184-L188 WeakPolarHBondContact O-CG 3.31Å; T184-L188 PolarHBondContact O-N 3.03Å; E186-L188 VanDerWaalsContact C-N 3.34Å; E186-L188 PolarHBondContact O-N 3.45Å; L188-L191 PolarHBondContact O-N 3.37Å; L188-Q192 WeakPolarHBondContact O-CB 3.22Å; L188-Q192 VanDerWaalsContact O-CG 3.27Å; L188-Q192 WeakPolarHBondContact O-CG 3.22Å; L188-Q192 PolarHBondContact O-N 2.83Å; L188-L259 HydrophobicContact CD2-CB 3.87Å |
| 189 | L | 94.6 | Very high | 95.4 | Very high | 107 Ų | 107 | 53 Ų | 53 | 56% | 0.56 | 29% | 0.291 | S | S | * | . | H | α-helix | trans | -64.8 | -43.2 | 177.8 | -178 | 62.8 | 0 | 0 | 0 | 112 | N185 E186 L191 Q192 T193 | N185-L189 WeakPolarHBondContact O-CB 3.48Å; N185-L189 PolarHBondContact O-N 3.1Å; E186-L189 PolarHBondContact O-N 2.89Å; L189-L191 VanDerWaalsContact C-N 3.33Å; L189-L191 PolarHBondContact O-N 3.33Å; L189-Q192 PolarHBondContact O-N 2.99Å; L189-T193 VanDerWaalsContact O-CB 3.26Å; L189-T193 WeakPolarHBondContact O-CB 3.33Å; L189-T193 PolarHBondContact O-N 2.88Å; L189-T193 PolarHBondContact O-OG1 3.32Å |
| 190 | L | 94.7 | Very high | 95.2 | Very high | 60 Ų | 60 | 56.5 Ų | 56.5 | 31% | 0.314 | 30% | 0.303 | S | S | . | . | H | α-helix | trans | -58.2 | -45.9 | 174.5 | -75.3 | 172.6 | 0 | 0 | 0 | 111.1 | E186 Q187 S194 L311 | E186-L190 HydrophobicContact CG-CD1 4.35Å; E186-L190 WeakPolarHBondContact O-CB 3.37Å; E186-L190 WeakPolarHBondContact O-CG 3.49Å; E186-L190 PolarHBondContact O-N 3.33Å; Q187-L190 PolarHBondContact O-N 3.24Å; L190-S194 VanDerWaalsContact O-CB 3.24Å; L190-S194 WeakPolarHBondContact O-CB 3.38Å; L190-S194 PolarHBondContact O-N 3.02Å; L190-S194 PolarHBondContact O-OG 3.32Å; L190-L311 HydrophobicContact CB-CD1 4.24Å |
| 191 | L | 95.9 | Very high | 95.1 | Very high | 1 Ų | 1 | 57.9 Ų | 57.9 | 1% | 0.005 | 31% | 0.31 | C | S | . | . | H | α-helix | trans | -64.7 | -46.5 | 179.2 | -174.7 | 68.8 | 0 | 0 | 0 | 112 | F183 Q187 L188 L189 S194 W195 I256 T314 W315 I318 | F183-L191 HydrophobicContact CE2-CD2 4.37Å; Q187-L191 WeakPolarHBondContact O-CB 3.44Å; Q187-L191 PolarHBondContact O-N 3Å; L188-L191 PolarHBondContact O-N 3.37Å; L189-L191 VanDerWaalsContact C-N 3.33Å; L189-L191 PolarHBondContact O-N 3.33Å; L191-S194 WeakPolarHBondContact CA-OG 3.1Å; L191-S194 PolarHBondContact O-OG 3.23Å; L191-W195 WeakPolarHBondContact O-CB 3.3Å; L191-W195 PolarHBondContact O-N 3.16Å; L191-I256 HydrophobicContact CD1-CD1 4.24Å; L191-I256 HydrophobicContact CD1-CG1 4.41Å; L191-I256 HydrophobicContact CD2-CB 4.43Å; L191-I256 HydrophobicContact CD2-CG1 3.97Å; L191-I256 HydrophobicContact CD2-CG2 4.09Å; L191-I256 HydrophobicContact CG-CD1 4.25Å; L191-I256 HydrophobicContact CG-CG1 4.07Å; L191-I256 HydrophobicContact CG-CG2 3.93Å; L191-T314 HydrophobicContact CB-CG2 4.14Å; L191-T314 HydrophobicContact CD1-CG2 4.39Å; L191-W315 HydrophobicContact CD1-CD2 3.78Å; L191-W315 HydrophobicContact CD1-CE3 4.15Å; L191-W315 HydrophobicContact CD1-CG 4.16Å; L191-W315 HydrophobicContact CD1-CH2 4.2Å; L191-W315 HydrophobicContact CD1-CZ2 3.9Å; L191-W315 HydrophobicContact CD1-CZ3 4.35Å; L191-I318 HydrophobicContact CD1-CG1 4.12Å; L191-I318 HydrophobicContact CD2-CD1 3.67Å; L191-I318 HydrophobicContact CD2-CG1 3.58Å |
| 192 | Q | 95.6 | Very high | 95 | Very high | 80 Ų | 80 | 55.6 Ų | 55.6 | 37% | 0.374 | 30% | 0.295 | S | S | . | . | H | α-helix | trans | -66.4 | -40.8 | 179.7 | -72.3 | 173.7 | -9.5 | 0 | 0 | 112.6 | L188 L189 S196 I256 | L188-Q192 WeakPolarHBondContact O-CB 3.22Å; L188-Q192 VanDerWaalsContact O-CG 3.27Å; L188-Q192 WeakPolarHBondContact O-CG 3.22Å; L188-Q192 PolarHBondContact O-N 2.83Å; L189-Q192 PolarHBondContact O-N 2.99Å; Q192-S196 PolarHBondContact O-N 2.77Å; Q192-S196 VanDerWaalsContact O-N 3.17Å; Q192-S196 PolarHBondContact O-OG 3.47Å; Q192-I256 HydrophobicContact CG-CG2 4Å |
| 193 | T | 95.4 | Very high | 94.8 | Very high | 73 Ų | 73 | 53.9 Ų | 53.9 | 45% | 0.448 | 28% | 0.278 | S | S | . | . | H | α-helix | trans | -66.5 | -50.3 | 178.2 | -56.6 | 0 | 0 | 0 | 0 | 110.6 | L189 W195 S196 | L189-T193 VanDerWaalsContact O-CB 3.26Å; L189-T193 WeakPolarHBondContact O-CB 3.33Å; L189-T193 PolarHBondContact O-N 2.88Å; L189-T193 PolarHBondContact O-OG1 3.32Å; T193-W195 VanDerWaalsContact C-N 3.33Å; T193-W195 PolarHBondContact O-N 2.94Å; T193-S196 WeakPolarHBondContact O-CB 3.43Å; T193-S196 PolarHBondContact O-N 3.44Å |
| 194 | S | 97 | Very high | 94.6 | Very high | 3 Ų | 3 | 55.6 Ų | 55.6 | 2% | 0.021 | 29% | 0.286 | C | S | . | . | H | α-helix | trans | -63.3 | -38.1 | 177.6 | 60.7 | 0 | 0 | 0 | 0 | 112.3 | L190 L191 S196 I197 V198 L311 W315 | L190-S194 VanDerWaalsContact O-CB 3.24Å; L190-S194 WeakPolarHBondContact O-CB 3.38Å; L190-S194 PolarHBondContact O-N 3.02Å; L190-S194 PolarHBondContact O-OG 3.32Å; L191-S194 WeakPolarHBondContact CA-OG 3.1Å; L191-S194 PolarHBondContact O-OG 3.23Å; S194-S196 VanDerWaalsContact C-N 3.28Å; S194-S196 PolarHBondContact O-N 3.45Å; S194-I197 WeakPolarHBondContact O-CB 3.42Å; S194-I197 PolarHBondContact O-N 2.95Å; S194-I197 VanDerWaalsContact O-N 3.13Å; S194-V198 WeakPolarHBondContact O-CG2 3.3Å; S194-V198 PolarHBondContact O-N 2.94Å; S194-L311 WeakPolarHBondContact OG-CD1 3.44Å; S194-W315 PolarHBondContact OG-NE1 3.37Å |
| 195 | W | 97.2 | Very high | 94.6 | Very high | 4 Ų | 4 | 52.4 Ų | 52.4 | 2% | 0.015 | 27% | 0.266 | C | S | . | . | H | α-helix | trans | -61.5 | -35.6 | 175.5 | 179 | -125.2 | 0 | 0 | 0 | 113.1 | L191 T193 I197 V198 K199 L249 V252 D253 I256 W315 | L191-W195 WeakPolarHBondContact O-CB 3.3Å; L191-W195 PolarHBondContact O-N 3.16Å; T193-W195 VanDerWaalsContact C-N 3.33Å; T193-W195 PolarHBondContact O-N 2.94Å; W195-I197 PolarHBondContact O-N 2.88Å; W195-V198 HydrophobicContact CE3-CB 3.73Å; W195-V198 HydrophobicContact CE3-CG1 3.58Å; W195-V198 HydrophobicContact CZ3-CB 4.14Å; W195-V198 HydrophobicContact CZ3-CG1 3.46Å; W195-V198 VanDerWaalsContact CZ3-CG1 3.46Å; W195-V198 PolarHBondContact O-N 2.71Å; W195-K199 HydrophobicContact CD2-CD 4.5Å; W195-K199 HydrophobicContact CD2-CG 3.92Å; W195-K199 VanDerWaalsContact CE2-CG 3.47Å; W195-K199 HydrophobicContact CE3-CG 4.45Å; W195-K199 HydrophobicContact CG-CG 4.37Å; W195-K199 HydrophobicContact CH2-CG 4.35Å; W195-K199 HydrophobicContact CZ2-CD 4.21Å; W195-K199 HydrophobicContact CZ2-CG 3.7Å; W195-K199 WeakPolarHBondContact O-CB 3.3Å; W195-K199 WeakPolarHBondContact O-CG 3.38Å; W195-K199 PolarHBondContact O-N 2.94Å; W195-L249 HydrophobicContact CH2-CB 4.33Å; W195-L249 HydrophobicContact CH2-CD2 4.34Å; W195-V252 HydrophobicContact CE3-CG1 4.47Å; W195-V252 HydrophobicContact CH2-CB 4.07Å; W195-V252 HydrophobicContact CH2-CG1 3.85Å; W195-V252 HydrophobicContact CZ2-CB 4.44Å; W195-V252 HydrophobicContact CZ2-CG1 4.3Å; W195-V252 HydrophobicContact CZ3-CG1 3.94Å; W195-D253 HydrophobicContact CZ2-CB 3.73Å; W195-D253 PolarHBondContact NE1-OD1 3.03Å; W195-I256 HydrophobicContact CB-CD1 3.86Å; W195-I256 HydrophobicContact CB-CG2 4.23Å; W195-I256 HydrophobicContact CD2-CD1 3.7Å; W195-I256 HydrophobicContact CE3-CD1 4.06Å; W195-I256 HydrophobicContact CG-CD1 3.62Å; W195-I256 HydrophobicContact CG-CG2 4.33Å; W195-W315 HydrophobicContact CB-CH2 4.18Å; W195-W315 HydrophobicContact CB-CZ2 4.03Å; W195-W315 HydrophobicContact CD2-CH2 4.11Å; W195-W315 AromaticContact CE3-CH2 3.4Å; W195-W315 HydrophobicContact CE3-CH2 3.4Å; W195-W315 HydrophobicContact CE3-CZ2 4.11Å; W195-W315 HydrophobicContact CE3-CZ3 4.35Å; W195-W315 HydrophobicContact CG-CH2 4.47Å; W195-W315 HydrophobicContact CZ3-CH2 4.05Å |
| 196 | S | 95.6 | Very high | 94.5 | Very high | 62 Ų | 62 | 45.9 Ų | 45.9 | 43% | 0.434 | 23% | 0.231 | S | C | . | . | H | α-helix | trans | -62.6 | -29.7 | 177.1 | -61.4 | 0 | 0 | 0 | 0 | 112.8 | Q192 T193 S194 | Q192-S196 PolarHBondContact O-N 2.77Å; Q192-S196 VanDerWaalsContact O-N 3.17Å; Q192-S196 PolarHBondContact O-OG 3.47Å; T193-S196 WeakPolarHBondContact O-CB 3.43Å; T193-S196 PolarHBondContact O-N 3.44Å; S194-S196 VanDerWaalsContact C-N 3.28Å; S194-S196 PolarHBondContact O-N 3.45Å |
| 197 | I | 94.7 | Very high | 94.4 | Very high | 39 Ų | 39 | 39.7 Ų | 39.7 | 20% | 0.2 | 20% | 0.203 | C | C | . | . | H | α-helix | trans | -77.2 | -49.6 | 171.8 | -59.6 | -51.5 | 0 | 0 | 0 | 110.8 | S194 W195 K199 Q200 E304 L306 | S194-I197 WeakPolarHBondContact O-CB 3.42Å; S194-I197 PolarHBondContact O-N 2.95Å; S194-I197 VanDerWaalsContact O-N 3.13Å; W195-I197 PolarHBondContact O-N 2.88Å; I197-K199 PolarHBondContact O-N 3.23Å; I197-Q200 VanDerWaalsContact O-CB 3.3Å; I197-Q200 WeakPolarHBondContact O-CB 3.5Å; I197-Q200 WeakPolarHBondContact O-CG 3.38Å; I197-Q200 PolarHBondContact O-N 3.2Å; I197-E304 HydrophobicContact CG2-CB 3.94Å; I197-E304 HydrophobicContact CG2-CG 3.55Å; I197-L306 HydrophobicContact CB-CD1 4.17Å; I197-L306 HydrophobicContact CG1-CD1 3.64Å |
| 198 | V | 95.7 | Very high | 94.3 | Very high | 1 Ų | 1 | 38.4 Ų | 38.4 | 1% | 0.006 | 20% | 0.198 | C | C | . | . | H | α-helix | trans | -54.8 | -38.2 | 178.9 | 174.7 | 0 | 0 | 0 | 0 | 111.9 | S194 W195 Q200 H201 I202 I205 I297 L301 W315 | S194-V198 WeakPolarHBondContact O-CG2 3.3Å; S194-V198 PolarHBondContact O-N 2.94Å; W195-V198 HydrophobicContact CE3-CB 3.73Å; W195-V198 HydrophobicContact CE3-CG1 3.58Å; W195-V198 HydrophobicContact CZ3-CB 4.14Å; W195-V198 HydrophobicContact CZ3-CG1 3.46Å; W195-V198 VanDerWaalsContact CZ3-CG1 3.46Å; W195-V198 PolarHBondContact O-N 2.71Å; V198-Q200 PolarHBondContact O-N 3.22Å; V198-Q200 VanDerWaalsContact O-N 3.16Å; V198-H201 PolarHBondContact O-N 3.37Å; V198-I202 PolarHBondContact O-N 2.96Å; V198-I205 HydrophobicContact CB-CD1 4.5Å; V198-I205 HydrophobicContact CG1-CD1 3.41Å; V198-I205 VanDerWaalsContact CG1-CD1 3.41Å; V198-I297 HydrophobicContact CG1-CG1 4.06Å; V198-I297 HydrophobicContact CG1-CG2 4.46Å; V198-I297 HydrophobicContact CG2-CG2 3.95Å; V198-L301 HydrophobicContact CG2-CD2 3.58Å; V198-L301 HydrophobicContact CG2-CG 4.12Å; V198-W315 HydrophobicContact CG2-CZ2 4.37Å |
| 199 | K | 94.5 | Very high | 94.2 | Very high | 44 Ų | 44 | 37.7 Ų | 37.7 | 19% | 0.191 | 19% | 0.194 | C | C | . | . | G | 310 helix | trans | -57.1 | -27.1 | 176.2 | -84.1 | -167.9 | -74.9 | -162.8 | 0 | 114.4 | W195 I197 H201 I202 D253 | W195-K199 HydrophobicContact CD2-CD 4.5Å; W195-K199 HydrophobicContact CD2-CG 3.92Å; W195-K199 VanDerWaalsContact CE2-CG 3.47Å; W195-K199 HydrophobicContact CE3-CG 4.45Å; W195-K199 HydrophobicContact CG-CG 4.37Å; W195-K199 HydrophobicContact CH2-CG 4.35Å; W195-K199 HydrophobicContact CZ2-CD 4.21Å; W195-K199 HydrophobicContact CZ2-CG 3.7Å; W195-K199 WeakPolarHBondContact O-CB 3.3Å; W195-K199 WeakPolarHBondContact O-CG 3.38Å; W195-K199 PolarHBondContact O-N 2.94Å; I197-K199 PolarHBondContact O-N 3.23Å; K199-H201 PolarHBondContact O-N 3.29Å; K199-I202 WeakPolarHBondContact O-CB 3.5Å; K199-I202 WeakPolarHBondContact O-CG2 3.46Å; K199-I202 PolarHBondContact O-N 3.01Å; K199-D253 IonicContact NZ-OD1 2.75Å; K199-D253 PolarHBondContact NZ-OD1 2.96Å; K199-D253 VanDerWaalsContact NZ-OD1 3.14Å |
| 200 | Q | 93.3 | Very high | 94 | Very high | 130 Ų | 130 | 33 Ų | 33 | 61% | 0.607 | 17% | 0.169 | S | C | * | . | G | 310 helix | trans | -68 | -17.2 | 177.2 | -56.2 | -179.4 | 36.9 | 0 | 0 | 112.1 | I197 V198 | I197-Q200 VanDerWaalsContact O-CB 3.3Å; I197-Q200 WeakPolarHBondContact O-CB 3.5Å; I197-Q200 WeakPolarHBondContact O-CG 3.38Å; I197-Q200 PolarHBondContact O-N 3.2Å; V198-Q200 PolarHBondContact O-N 3.22Å; V198-Q200 VanDerWaalsContact O-N 3.16Å |
| 201 | H | 93 | Very high | 93.9 | Very high | 30 Ų | 30 | 31.2 Ų | 31.2 | 14% | 0.139 | 16% | 0.16 | C | C | . | . | G | 310 helix | trans | -115.1 | 13.7 | -179 | -53.3 | -88.9 | 0 | 0 | 0 | 112.8 | V198 K199 E203 K204 I205 | V198-H201 PolarHBondContact O-N 3.37Å; K199-H201 PolarHBondContact O-N 3.29Å; H201-E203 PolarHBondContact O-N 2.92Å; H201-K204 PolarHBondContact O-N 3.45Å; H201-I205 HydrophobicContact CB-CD1 4.01Å; H201-I205 HydrophobicContact CB-CG1 4.2Å; H201-I205 WeakPolarHBondContact O-CG1 3.14Å; H201-I205 PolarHBondContact O-N 3.43Å |
| 202 | I | 92.6 | Very high | 93.7 | Very high | 9 Ų | 9 | 31.2 Ų | 31.2 | 5% | 0.046 | 16% | 0.16 | C | C | . | . | H | α-helix | trans | -53.8 | -44.5 | -167.3 | -162.1 | 175.1 | 0 | 0 | 0 | 113.5 | M109 V198 K199 K204 I205 G206 L246 L249 | M109-I202 HydrophobicContact SD-CD1 3.86Å; V198-I202 PolarHBondContact O-N 2.96Å; K199-I202 WeakPolarHBondContact O-CB 3.5Å; K199-I202 WeakPolarHBondContact O-CG2 3.46Å; K199-I202 PolarHBondContact O-N 3.01Å; I202-K204 PolarHBondContact O-N 3.06Å; I202-I205 PolarHBondContact O-N 3.23Å; I202-G206 PolarHBondContact O-N 3.42Å; I202-L246 HydrophobicContact CB-CD2 4.48Å; I202-L246 HydrophobicContact CD1-CD2 4.31Å; I202-L246 HydrophobicContact CG1-CD2 4.13Å; I202-L246 HydrophobicContact CG2-CD2 3.79Å; I202-L249 HydrophobicContact CB-CD1 4.33Å; I202-L249 HydrophobicContact CD1-CB 3.69Å; I202-L249 HydrophobicContact CD1-CD1 4.49Å; I202-L249 HydrophobicContact CG1-CB 3.51Å; I202-L249 HydrophobicContact CG1-CD1 3.39Å; I202-L249 HydrophobicContact CG1-CG 4.07Å; I202-L249 WeakPolarHBondContact O-CD1 3.15Å |
| 203 | E | 88.7 | Confident | 93.4 | Very high | 47 Ų | 47 | 27.4 Ų | 27.4 | 22% | 0.22 | 14% | 0.142 | C | C | . | . | H | α-helix | trans | -61 | -44.1 | 179 | -69.4 | 174.1 | -167.9 | 0 | 0 | 112.1 | S103 L105 H201 V207 L246 | S103-E203 WeakPolarHBondContact CB-OE1 3.36Å; S103-E203 PolarHBondContact OG-OE1 2.93Å; S103-E203 PolarHBondContact OG-OE2 2.99Å; L105-E203 VanDerWaalsContact CB-OE1 3.26Å; L105-E203 WeakPolarHBondContact CB-OE1 3.33Å; H201-E203 PolarHBondContact O-N 2.92Å; E203-V207 WeakPolarHBondContact O-CG2 3.32Å; E203-V207 PolarHBondContact O-N 3.5Å; E203-L246 HydrophobicContact CG-CD1 4.49Å; E203-L246 HydrophobicContact CG-CD2 3.97Å |
| 204 | K | 91.7 | Very high | 93.2 | Very high | 57 Ų | 57 | 24 Ų | 24 | 25% | 0.248 | 12% | 0.121 | C | C | . | . | H | α-helix | trans | -69.1 | -44 | -178.8 | -62.7 | -176.8 | -176.3 | -173.1 | 0 | 110.6 | H96 L97 T98 H201 I202 G206 V207 I208 | H96-K204 WeakPolarHBondContact O-CD 3.29Å; H96-K204 VanDerWaalsContact O-CE 3.3Å; H96-K204 WeakPolarHBondContact O-CE 3.43Å; H96-K204 PolarHBondContact O-NZ 3.42Å; L97-K204 HydrophobicContact CD2-CD 4.25Å; T98-K204 PolarHBondContact O-NZ 3.5Å; H201-K204 PolarHBondContact O-N 3.45Å; I202-K204 PolarHBondContact O-N 3.06Å; K204-G206 VanDerWaalsContact C-N 3.34Å; K204-G206 PolarHBondContact O-N 3.14Å; K204-V207 PolarHBondContact O-N 3.06Å; K204-I208 HydrophobicContact CB-CD1 4.44Å; K204-I208 WeakPolarHBondContact O-CB 3.43Å; K204-I208 WeakPolarHBondContact O-CD1 3.42Å; K204-I208 WeakPolarHBondContact O-CG1 3.48Å; K204-I208 PolarHBondContact O-N 3.34Å |
| 205 | I | 95.2 | Very high | 92.8 | Very high | 4 Ų | 4 | 28 Ų | 28 | 2% | 0.021 | 14% | 0.14 | C | C | . | . | H | α-helix | trans | -58.3 | -49.5 | 178 | -68.3 | 174.7 | 0 | 0 | 0 | 109.8 | V198 H201 I202 V207 I208 T209 L249 A296 I297 V300 | V198-I205 HydrophobicContact CB-CD1 4.5Å; V198-I205 HydrophobicContact CG1-CD1 3.41Å; V198-I205 VanDerWaalsContact CG1-CD1 3.41Å; H201-I205 HydrophobicContact CB-CD1 4.01Å; H201-I205 HydrophobicContact CB-CG1 4.2Å; H201-I205 WeakPolarHBondContact O-CG1 3.14Å; H201-I205 PolarHBondContact O-N 3.43Å; I202-I205 PolarHBondContact O-N 3.23Å; I205-V207 PolarHBondContact O-N 3.4Å; I205-I208 PolarHBondContact O-N 3.22Å; I205-T209 WeakPolarHBondContact O-CB 3.43Å; I205-T209 PolarHBondContact O-N 3.31Å; I205-T209 PolarHBondContact O-OG1 3.38Å; I205-T209 VanDerWaalsContact O-OG1 3.05Å; I205-L249 HydrophobicContact CB-CD1 3.98Å; I205-L249 HydrophobicContact CG2-CD1 3.84Å; I205-L249 HydrophobicContact CG2-CD2 4.1Å; I205-A296 HydrophobicContact CG2-CB 3.88Å; I205-I297 HydrophobicContact CD1-CG1 4.38Å; I205-I297 HydrophobicContact CG2-CG1 4.14Å; I205-V300 HydrophobicContact CD1-CG2 4.35Å |
| 206 | G | 94.1 | Very high | 92.2 | Very high | 2 Ų | 2 | 32 Ų | 32 | 2% | 0.021 | 16% | 0.158 | C | C | . | . | H | α-helix | trans | -58.2 | -48 | -179 | 0 | 0 | 0 | 0 | 0 | 112.3 | I202 K204 F210 | I202-G206 PolarHBondContact O-N 3.42Å; K204-G206 VanDerWaalsContact C-N 3.34Å; K204-G206 PolarHBondContact O-N 3.14Å; G206-F210 WeakPolarHBondContact O-CD2 3.35Å; G206-F210 PolarHBondContact O-N 3.46Å |
| 207 | V | 92.6 | Very high | 91.6 | Very high | 12 Ų | 12 | 31.9 Ų | 31.9 | 7% | 0.073 | 15% | 0.151 | C | C | . | . | H | α-helix | trans | -63.9 | -45.3 | 177.4 | 175 | 0 | 0 | 0 | 0 | 111.6 | E203 K204 I205 T209 F210 L211 K236 M241 Q242 | E203-V207 WeakPolarHBondContact O-CG2 3.32Å; E203-V207 PolarHBondContact O-N 3.5Å; K204-V207 PolarHBondContact O-N 3.06Å; I205-V207 PolarHBondContact O-N 3.4Å; V207-T209 PolarHBondContact O-N 2.98Å; V207-F210 PolarHBondContact O-N 3.11Å; V207-L211 HydrophobicContact CG1-CD1 3.76Å; V207-L211 HydrophobicContact CG1-CG 4.14Å; V207-L211 WeakPolarHBondContact O-CB 3.42Å; V207-L211 VanDerWaalsContact O-CG 3.29Å; V207-L211 WeakPolarHBondContact O-CG 3.42Å; V207-L211 PolarHBondContact O-N 2.99Å; V207-K236 HydrophobicContact CG1-CB 4.47Å; V207-K236 HydrophobicContact CG1-CG 4.15Å; V207-M241 HydrophobicContact CG2-CG 4.3Å; V207-Q242 HydrophobicContact CG2-CG 3.91Å |
| 208 | I | 92.9 | Very high | 91.2 | Very high | 26 Ų | 26 | 33.2 Ų | 33.2 | 13% | 0.133 | 16% | 0.164 | C | C | . | . | H | α-helix | trans | -61.5 | -44 | -179.4 | -72.1 | 166.4 | 0 | 0 | 0 | 111 | F89 K204 I205 F210 L211 G212 A296 | F89-I208 HydrophobicContact CD2-CG2 4.49Å; F89-I208 HydrophobicContact CE2-CG2 3.69Å; F89-I208 HydrophobicContact CZ-CG2 4.44Å; K204-I208 HydrophobicContact CB-CD1 4.44Å; K204-I208 WeakPolarHBondContact O-CB 3.43Å; K204-I208 WeakPolarHBondContact O-CD1 3.42Å; K204-I208 WeakPolarHBondContact O-CG1 3.48Å; K204-I208 PolarHBondContact O-N 3.34Å; I205-I208 PolarHBondContact O-N 3.22Å; I208-F210 PolarHBondContact O-N 3.38Å; I208-L211 PolarHBondContact O-N 3.21Å; I208-G212 PolarHBondContact O-N 3.09Å; I208-A296 HydrophobicContact CB-CB 4.42Å; I208-A296 HydrophobicContact CG2-CB 3.99Å |
| 209 | T | 93.3 | Very high | 90.4 | Very high | 1 Ų | 1 | 36.5 Ų | 36.5 | 1% | 0.006 | 18% | 0.182 | C | C | . | . | H | α-helix | trans | -55.7 | -52.9 | 176.9 | -66.5 | 0 | 0 | 0 | 0 | 111 | I205 V207 G212 I213 Q292 L293 | I205-T209 WeakPolarHBondContact O-CB 3.43Å; I205-T209 PolarHBondContact O-N 3.31Å; I205-T209 PolarHBondContact O-OG1 3.38Å; I205-T209 VanDerWaalsContact O-OG1 3.05Å; V207-T209 PolarHBondContact O-N 2.98Å; T209-G212 PolarHBondContact O-N 3.2Å; T209-I213 HydrophobicContact CG2-CD1 4.25Å; T209-I213 WeakPolarHBondContact O-CG1 3.49Å; T209-I213 PolarHBondContact O-N 3.1Å; T209-Q292 HydrophobicContact CG2-CB 3.86Å; T209-Q292 PolarHBondContact OG1-O 3.1Å; T209-L293 HydrophobicContact CG2-CD2 3.9Å; T209-L293 HydrophobicContact CG2-CG 3.86Å |
| 210 | F | 91.1 | Very high | 89.8 | Confident | 7 Ų | 7 | 35.1 Ų | 35.1 | 3% | 0.031 | 18% | 0.176 | C | C | . | . | H | α-helix | trans | -69.7 | -37 | -177.8 | -81.1 | -73.6 | 0 | 0 | 0 | 113.6 | G206 V207 I208 G212 I213 F214 F220 F224 M241 H244 V248 | G206-F210 WeakPolarHBondContact O-CD2 3.35Å; G206-F210 PolarHBondContact O-N 3.46Å; V207-F210 PolarHBondContact O-N 3.11Å; I208-F210 PolarHBondContact O-N 3.38Å; F210-G212 VanDerWaalsContact C-N 3.27Å; F210-G212 PolarHBondContact O-N 2.91Å; F210-I213 HydrophobicContact CD1-CD1 4.1Å; F210-I213 HydrophobicContact CE1-CD1 4.28Å; F210-I213 PolarHBondContact O-N 3.3Å; F210-F214 HydrophobicContact CD1-CE1 4.48Å; F210-F214 WeakPolarHBondContact O-CB 3.36Å; F210-F214 WeakPolarHBondContact O-CD1 3.25Å; F210-F214 WeakPolarHBondContact O-CG 3.45Å; F210-F214 PolarHBondContact O-N 3.09Å; F210-F220 AromaticContact CD1-CE1 4Å; F210-F220 HydrophobicContact CD1-CE1 4Å; F210-F220 AromaticContact CE1-CE1 3.91Å; F210-F220 HydrophobicContact CE1-CE1 3.91Å; F210-F220 HydrophobicContact CE1-CZ 4.31Å; F210-F224 HydrophobicContact CE1-CZ 4.4Å; F210-M241 HydrophobicContact CB-CE 3.81Å; F210-M241 HydrophobicContact CB-SD 3.48Å; F210-M241 WeakPolarHBondContact CB-SD 3.44Å; F210-M241 HydrophobicContact CD2-SD 4.14Å; F210-M241 HydrophobicContact CG-CE 4.44Å; F210-M241 HydrophobicContact CG-SD 3.92Å; F210-H244 AromaticContact CE1-CD2 3.55Å; F210-H244 AromaticContact CE1-NE2 3.53Å; F210-H244 AromaticContact CE2-CD2 3.43Å; F210-H244 VanDerWaalsContact CE2-CD2 3.43Å; F210-H244 WeakPolarHBondContact CE2-CD2 3.49Å; F210-H244 AromaticContact CE2-NE2 3.93Å; F210-H244 AromaticContact CZ-CD2 3.13Å; F210-H244 WeakPolarHBondContact CZ-CD2 3.3Å; F210-H244 AromaticContact CZ-NE2 3.17Å; F210-H244 WeakPolarHBondContact CZ-NE2 3.22Å; F210-V248 HydrophobicContact CE2-CB 4.47Å; F210-V248 HydrophobicContact CE2-CG2 3.87Å; F210-V248 HydrophobicContact CZ-CG2 3.77Å |
| 211 | L | 91.9 | Very high | 89.3 | Confident | 23 Ų | 23 | 30.8 Ų | 30.8 | 12% | 0.12 | 15% | 0.154 | C | C | . | . | H | α-helix | trans | -62.1 | -37.9 | 172.7 | -69.9 | -179.6 | 0 | 0 | 0 | 111.7 | V207 I208 F214 E215 F232 I235 K236 | V207-L211 HydrophobicContact CG1-CD1 3.76Å; V207-L211 HydrophobicContact CG1-CG 4.14Å; V207-L211 WeakPolarHBondContact O-CB 3.42Å; V207-L211 VanDerWaalsContact O-CG 3.29Å; V207-L211 WeakPolarHBondContact O-CG 3.42Å; V207-L211 PolarHBondContact O-N 2.99Å; I208-L211 PolarHBondContact O-N 3.21Å; L211-F214 PolarHBondContact O-N 3.13Å; L211-E215 WeakPolarHBondContact O-CB 3.44Å; L211-E215 PolarHBondContact O-N 2.89Å; L211-F232 HydrophobicContact CD2-CB 4.11Å; L211-F232 HydrophobicContact CD2-CD1 4.12Å; L211-F232 HydrophobicContact CD2-CG 4.31Å; L211-I235 HydrophobicContact CD2-CB 4.28Å; L211-I235 HydrophobicContact CD2-CG2 4.06Å; L211-K236 HydrophobicContact CD1-CB 4Å; L211-K236 HydrophobicContact CD1-CG 4.29Å |
| 212 | G | 91.5 | Very high | 88.7 | Confident | 1 Ų | 1 | 31.6 Ų | 31.6 | 1% | 0.01 | 16% | 0.159 | C | C | . | . | H | α-helix | trans | -64.9 | -42.3 | 174.6 | 0 | 0 | 0 | 0 | 0 | 112.9 | I208 T209 F210 E215 Q216 Q292 | I208-G212 PolarHBondContact O-N 3.09Å; T209-G212 PolarHBondContact O-N 3.2Å; F210-G212 VanDerWaalsContact C-N 3.27Å; F210-G212 PolarHBondContact O-N 2.91Å; G212-E215 PolarHBondContact O-N 2.91Å; G212-Q216 PolarHBondContact O-N 3.25Å; G212-Q292 VanDerWaalsContact CA-OE1 3.31Å |
| 213 | I | 89.8 | Confident | 88.1 | Confident | 0 Ų | 0 | 33 Ų | 33 | 0% | 0 | 17% | 0.172 | C | C | . | . | H | α-helix | trans | -61.4 | -46.4 | 172.9 | -58.6 | 165.5 | 0 | 0 | 0 | 110.3 | T209 F210 E215 Q216 H217 F220 L285 V289 Q292 | T209-I213 HydrophobicContact CG2-CD1 4.25Å; T209-I213 WeakPolarHBondContact O-CG1 3.49Å; T209-I213 PolarHBondContact O-N 3.1Å; F210-I213 HydrophobicContact CD1-CD1 4.1Å; F210-I213 HydrophobicContact CE1-CD1 4.28Å; F210-I213 PolarHBondContact O-N 3.3Å; I213-E215 VanDerWaalsContact C-N 3.28Å; I213-E215 PolarHBondContact O-N 2.85Å; I213-Q216 PolarHBondContact O-N 3.44Å; I213-Q216 VanDerWaalsContact O-N 3.16Å; I213-H217 PolarHBondContact O-N 2.92Å; I213-F220 HydrophobicContact CB-CD1 4.14Å; I213-F220 HydrophobicContact CB-CE1 4.41Å; I213-F220 HydrophobicContact CD1-CE1 4.18Å; I213-F220 HydrophobicContact CG2-CB 4.31Å; I213-F220 HydrophobicContact CG2-CD1 3.28Å; I213-F220 HydrophobicContact CG2-CE1 3.77Å; I213-F220 HydrophobicContact CG2-CG 4.04Å; I213-L285 HydrophobicContact CG2-CD1 3.87Å; I213-V289 HydrophobicContact CD1-CG2 3.96Å; I213-Q292 HydrophobicContact CD1-CB 4.46Å; I213-Q292 HydrophobicContact CG1-CB 3.84Å; I213-Q292 HydrophobicContact CG1-CG 3.58Å |
| 214 | F | 90 | Very high | 87.7 | Confident | 2 Ų | 2 | 32.6 Ų | 32.6 | 1% | 0.009 | 17% | 0.169 | C | C | . | . | H | α-helix | trans | -66.1 | -28.8 | -177.9 | -65.8 | -11.7 | 0 | 0 | 0 | 113.9 | F210 L211 F220 R221 F224 F227 F232 I235 M241 | F210-F214 HydrophobicContact CD1-CE1 4.48Å; F210-F214 WeakPolarHBondContact O-CB 3.36Å; F210-F214 WeakPolarHBondContact O-CD1 3.25Å; F210-F214 WeakPolarHBondContact O-CG 3.45Å; F210-F214 PolarHBondContact O-N 3.09Å; L211-F214 PolarHBondContact O-N 3.13Å; F214-F220 HydrophobicContact CD1-CB 4.44Å; F214-F220 AromaticContact CD1-CD1 3.72Å; F214-F220 HydrophobicContact CD1-CD1 3.72Å; F214-F220 HydrophobicContact CD1-CG 4.48Å; F214-F220 AromaticContact CE1-CD1 3.46Å; F214-F220 HydrophobicContact CE1-CD1 3.46Å; F214-F220 VanDerWaalsContact CE1-CD1 3.46Å; F214-F220 AromaticContact CE1-CE1 3.98Å; F214-F220 HydrophobicContact CE1-CE1 3.98Å; F214-F220 HydrophobicContact CE1-CG 4.28Å; F214-R221 HydrophobicContact CB-CB 4Å; F214-R221 HydrophobicContact CB-CG 4.47Å; F214-R221 HydrophobicContact CD1-CB 3.65Å; F214-R221 HydrophobicContact CD1-CG 4.38Å; F214-R221 HydrophobicContact CD2-CB 3.94Å; F214-R221 HydrophobicContact CD2-CG 3.77Å; F214-R221 HydrophobicContact CE1-CB 4.03Å; F214-R221 HydrophobicContact CE2-CB 4.25Å; F214-R221 HydrophobicContact CE2-CG 3.94Å; F214-R221 HydrophobicContact CG-CB 3.62Å; F214-R221 HydrophobicContact CG-CG 4Å; F214-R221 HydrophobicContact CZ-CB 4.32Å; F214-R221 HydrophobicContact CZ-CG 4.37Å; F214-F224 AromaticContact CE1-CD2 3.87Å; F214-F224 HydrophobicContact CE1-CD2 3.87Å; F214-F224 AromaticContact CE1-CE2 3.92Å; F214-F224 HydrophobicContact CE1-CE2 3.92Å; F214-F224 AromaticContact CZ-CD2 3.78Å; F214-F224 HydrophobicContact CZ-CD2 3.78Å; F214-F224 HydrophobicContact CZ-CE2 4.06Å; F214-F224 HydrophobicContact CZ-CG 4.42Å; F214-F227 HydrophobicContact CE2-CB 4.41Å; F214-F227 AromaticContact CE2-CD2 3.97Å; F214-F227 HydrophobicContact CE2-CD2 3.97Å; F214-F227 HydrophobicContact CE2-CG 4.45Å; F214-F227 AromaticContact CZ-CD2 3.99Å; F214-F227 HydrophobicContact CZ-CD2 3.99Å; F214-F232 HydrophobicContact CB-CE1 3.67Å; F214-F232 HydrophobicContact CB-CZ 4.16Å; F214-I235 HydrophobicContact CD2-CD1 4.45Å; F214-I235 HydrophobicContact CE2-CG2 4.2Å; F214-M241 HydrophobicContact CD2-CE 4.17Å; F214-M241 HydrophobicContact CE2-CE 3.18Å; F214-M241 HydrophobicContact CZ-CE 3.56Å |
| 215 | E | 88.6 | Confident | 87.2 | Confident | 88 Ų | 88 | 34 Ų | 34 | 41% | 0.411 | 18% | 0.183 | S | C | . | . | H | α-helix | trans | -68.3 | -37.9 | 173.9 | -177.4 | 172 | -138.8 | 0 | 0 | 111.8 | R92 L211 G212 I213 F232 | R92-E215 IonicContact CZ-OE2 2.7Å; R92-E215 VanDerWaalsContact CZ-OE2 3.23Å; R92-E215 IonicContact NH1-OE2 3.99Å; R92-E215 PolarHBondContact NH1-OE2 2.9Å; R92-E215 IonicContact NH2-OE1 3.46Å; R92-E215 PolarHBondContact NH2-OE1 3.34Å; R92-E215 IonicContact NH2-OE2 2.63Å; R92-E215 PolarHBondContact NH2-OE2 2.85Å; L211-E215 WeakPolarHBondContact O-CB 3.44Å; L211-E215 PolarHBondContact O-N 2.89Å; G212-E215 PolarHBondContact O-N 2.91Å; I213-E215 VanDerWaalsContact C-N 3.28Å; I213-E215 PolarHBondContact O-N 2.85Å; E215-F232 HydrophobicContact CB-CE2 4.04Å; E215-F232 HydrophobicContact CB-CZ 4.16Å; E215-F232 HydrophobicContact CG-CE2 4.41Å |
| 216 | Q | 85.4 | Confident | 86.6 | Confident | 86 Ų | 86 | 39.2 Ų | 39.2 | 40% | 0.402 | 21% | 0.207 | S | C | . | . | H | α-helix | trans | -82.7 | -33.8 | 178.4 | -66.8 | 179.2 | -12.8 | 0 | 0 | 112.7 | G212 I213 | G212-Q216 PolarHBondContact O-N 3.25Å; I213-Q216 PolarHBondContact O-N 3.44Å; I213-Q216 VanDerWaalsContact O-N 3.16Å |
| 217 | H | 83.9 | Confident | 86.2 | Confident | 61 Ų | 61 | 39.3 Ų | 39.3 | 28% | 0.282 | 21% | 0.207 | S | C | . | . | trans | -136.4 | 82.1 | -170.1 | -61.1 | -71.2 | 0 | 0 | 0 | 110 | I213 D219 F220 L285 | I213-H217 PolarHBondContact O-N 2.92Å; H217-D219 WeakPolarHBondContact CA-OD1 3.41Å; H217-D219 WeakPolarHBondContact CB-OD1 3.41Å; H217-D219 PolarHBondContact O-N 3.36Å; H217-F220 HydrophobicContact CB-CB 4.16Å; H217-F220 VanDerWaalsContact O-CB 3.26Å; H217-F220 WeakPolarHBondContact O-CB 3.02Å; H217-F220 PolarHBondContact O-N 3.13Å; H217-L285 HydrophobicContact CB-CD1 3.76Å; H217-L285 WeakPolarHBondContact CD2-CD1 3.34Å; H217-L285 VanDerWaalsContact CG-CD1 3.47Å | ||
| 218 | S | 84.4 | Confident | 85.8 | Confident | 67 Ų | 67 | 44.4 Ų | 44.4 | 47% | 0.469 | 23% | 0.225 | S | C | . | . | H | α-helix | trans | -65.7 | -24.2 | -178.6 | 67.4 | 0 | 0 | 0 | 0 | 113.8 | F220 R221 D222 | S218-F220 VanDerWaalsContact C-N 3.31Å; S218-R221 WeakPolarHBondContact O-CB 3.25Å; S218-R221 PolarHBondContact O-N 3.43Å; S218-D222 PolarHBondContact O-N 3.1Å; S218-D222 VanDerWaalsContact O-N 3.1Å |
| 219 | D | 80.2 | Confident | 85.3 | Confident | 70 Ų | 70 | 51.6 Ų | 51.6 | 37% | 0.374 | 26% | 0.255 | S | S | . | . | H | α-helix | trans | -62.6 | -35.9 | 170.6 | 59 | -33.6 | 0 | 0 | 0 | 111.9 | H217 D222 A223 | H217-D219 WeakPolarHBondContact CA-OD1 3.41Å; H217-D219 WeakPolarHBondContact CB-OD1 3.41Å; H217-D219 PolarHBondContact O-N 3.36Å; D219-D222 PolarHBondContact O-N 3.39Å; D219-A223 PolarHBondContact O-N 3.2Å |
| 220 | F | 80.6 | Confident | 84.9 | Confident | 15 Ų | 15 | 55.2 Ų | 55.2 | 7% | 0.066 | 27% | 0.269 | C | S | . | . | H | α-helix | trans | -63.3 | -45.1 | 172.6 | -167.7 | -129.5 | 0 | 0 | 0 | 112.3 | F210 I213 F214 H217 S218 D222 A223 F224 L285 | F210-F220 AromaticContact CD1-CE1 4Å; F210-F220 HydrophobicContact CD1-CE1 4Å; F210-F220 AromaticContact CE1-CE1 3.91Å; F210-F220 HydrophobicContact CE1-CE1 3.91Å; F210-F220 HydrophobicContact CE1-CZ 4.31Å; I213-F220 HydrophobicContact CB-CD1 4.14Å; I213-F220 HydrophobicContact CB-CE1 4.41Å; I213-F220 HydrophobicContact CD1-CE1 4.18Å; I213-F220 HydrophobicContact CG2-CB 4.31Å; I213-F220 HydrophobicContact CG2-CD1 3.28Å; I213-F220 HydrophobicContact CG2-CE1 3.77Å; I213-F220 HydrophobicContact CG2-CG 4.04Å; F214-F220 HydrophobicContact CD1-CB 4.44Å; F214-F220 AromaticContact CD1-CD1 3.72Å; F214-F220 HydrophobicContact CD1-CD1 3.72Å; F214-F220 HydrophobicContact CD1-CG 4.48Å; F214-F220 AromaticContact CE1-CD1 3.46Å; F214-F220 HydrophobicContact CE1-CD1 3.46Å; F214-F220 VanDerWaalsContact CE1-CD1 3.46Å; F214-F220 AromaticContact CE1-CE1 3.98Å; F214-F220 HydrophobicContact CE1-CE1 3.98Å; F214-F220 HydrophobicContact CE1-CG 4.28Å; H217-F220 HydrophobicContact CB-CB 4.16Å; H217-F220 VanDerWaalsContact O-CB 3.26Å; H217-F220 WeakPolarHBondContact O-CB 3.02Å; H217-F220 PolarHBondContact O-N 3.13Å; S218-F220 VanDerWaalsContact C-N 3.31Å; F220-D222 PolarHBondContact O-N 3.41Å; F220-A223 VanDerWaalsContact O-CB 3.31Å; F220-A223 WeakPolarHBondContact O-CB 3.44Å; F220-A223 PolarHBondContact O-N 3.48Å; F220-A223 VanDerWaalsContact O-N 3.16Å; F220-F224 HydrophobicContact CD1-CE2 4.06Å; F220-F224 HydrophobicContact CD2-CE2 4.34Å; F220-F224 AromaticContact CE1-CE2 3.7Å; F220-F224 HydrophobicContact CE1-CE2 3.7Å; F220-F224 HydrophobicContact CE1-CZ 4.31Å; F220-F224 HydrophobicContact CE2-CE2 4.03Å; F220-F224 HydrophobicContact CG-CE2 4.39Å; F220-F224 AromaticContact CZ-CE2 3.7Å; F220-F224 HydrophobicContact CZ-CE2 3.7Å; F220-F224 HydrophobicContact CZ-CZ 4.09Å; F220-F224 VanDerWaalsContact O-CD2 3.29Å; F220-F224 WeakPolarHBondContact O-CD2 3.45Å; F220-L285 HydrophobicContact CB-CD2 3.54Å; F220-L285 HydrophobicContact CD1-CD2 4.34Å; F220-L285 HydrophobicContact CD2-CD2 3.13Å; F220-L285 HydrophobicContact CD2-CG 4.19Å; F220-L285 HydrophobicContact CE2-CD2 3.8Å; F220-L285 HydrophobicContact CG-CD2 3.43Å; F220-L285 VanDerWaalsContact CG-CD2 3.43Å; F220-L285 HydrophobicContact CG-CG 4.36Å |
| 221 | R | 83.2 | Confident | 84.6 | Confident | 39 Ų | 39 | 62.2 Ų | 62.2 | 15% | 0.147 | 30% | 0.299 | C | S | . | . | H | α-helix | trans | -56.7 | -42.2 | 174.7 | -178.1 | -158.5 | 63.1 | -149.9 | -10.4 | 110.4 | F214 S218 A223 F224 F227 I235 | F214-R221 HydrophobicContact CB-CB 4Å; F214-R221 HydrophobicContact CB-CG 4.47Å; F214-R221 HydrophobicContact CD1-CB 3.65Å; F214-R221 HydrophobicContact CD1-CG 4.38Å; F214-R221 HydrophobicContact CD2-CB 3.94Å; F214-R221 HydrophobicContact CD2-CG 3.77Å; F214-R221 HydrophobicContact CE1-CB 4.03Å; F214-R221 HydrophobicContact CE2-CB 4.25Å; F214-R221 HydrophobicContact CE2-CG 3.94Å; F214-R221 HydrophobicContact CG-CB 3.62Å; F214-R221 HydrophobicContact CG-CG 4Å; F214-R221 HydrophobicContact CZ-CB 4.32Å; F214-R221 HydrophobicContact CZ-CG 4.37Å; S218-R221 WeakPolarHBondContact O-CB 3.25Å; S218-R221 PolarHBondContact O-N 3.43Å; R221-A223 VanDerWaalsContact C-N 3.26Å; R221-A223 PolarHBondContact O-N 2.89Å; R221-F224 WeakPolarHBondContact O-CB 3.44Å; R221-F224 PolarHBondContact O-N 2.88Å; R221-F224 VanDerWaalsContact O-N 3.09Å; R221-F224 VanDerWaalsContact O-O 3.13Å; R221-F227 WeakPolarHBondContact CD-O 3.16Å; R221-F227 HydrophobicContact CG-CB 3.99Å; R221-I235 HydrophobicContact CG-CD1 4.24Å |
| 222 | D | 81.5 | Confident | 84.3 | Confident | 46 Ų | 46 | 64.4 Ų | 64.4 | 25% | 0.246 | 31% | 0.308 | C | S | . | . | H | α-helix | trans | -75.2 | -15.4 | -176.3 | -67.8 | -13.7 | 0 | 0 | 0 | 113.5 | S218 D219 F220 F224 R228 K229 | S218-D222 PolarHBondContact O-N 3.1Å; S218-D222 VanDerWaalsContact O-N 3.1Å; D219-D222 PolarHBondContact O-N 3.39Å; F220-D222 PolarHBondContact O-N 3.41Å; D222-F224 VanDerWaalsContact C-N 3.32Å; D222-R228 HydrophobicContact CB-CG 4.07Å; D222-R228 PolarHBondContact O-NE 3.27Å; D222-R228 PolarHBondContact O-NH2 2.79Å; D222-R228 WeakPolarHBondContact OD1-CA 3.43Å; D222-K229 PolarHBondContact OD1-N 3.14Å |
| 223 | A | 78.8 | Confident | 83.9 | Confident | 38 Ų | 38 | 68.9 Ų | 68.9 | 31% | 0.314 | 33% | 0.334 | S | S | . | . | H | α-helix | trans | -68.8 | -29.6 | 166.3 | 0 | 0 | 0 | 0 | 0 | 112.2 | D219 F220 R221 T225 Y279 | D219-A223 PolarHBondContact O-N 3.2Å; F220-A223 VanDerWaalsContact O-CB 3.31Å; F220-A223 WeakPolarHBondContact O-CB 3.44Å; F220-A223 PolarHBondContact O-N 3.48Å; F220-A223 VanDerWaalsContact O-N 3.16Å; R221-A223 VanDerWaalsContact C-N 3.26Å; R221-A223 PolarHBondContact O-N 2.89Å; A223-T225 PolarHBondContact O-N 3.23Å; A223-Y279 WeakPolarHBondContact CB-O 3.38Å |
| 224 | F | 81.3 | Confident | 83.7 | Confident | 40 Ų | 40 | 72.6 Ų | 72.6 | 18% | 0.175 | 35% | 0.354 | C | S | . | . | S | Bend | trans | -80.1 | 106.2 | 167.9 | -65.8 | -94 | 0 | 0 | 0 | 109.7 | F210 F214 F220 R221 D222 E226 F227 R228 H244 | F210-F224 HydrophobicContact CE1-CZ 4.4Å; F214-F224 AromaticContact CE1-CD2 3.87Å; F214-F224 HydrophobicContact CE1-CD2 3.87Å; F214-F224 AromaticContact CE1-CE2 3.92Å; F214-F224 HydrophobicContact CE1-CE2 3.92Å; F214-F224 AromaticContact CZ-CD2 3.78Å; F214-F224 HydrophobicContact CZ-CD2 3.78Å; F214-F224 HydrophobicContact CZ-CE2 4.06Å; F214-F224 HydrophobicContact CZ-CG 4.42Å; F220-F224 HydrophobicContact CD1-CE2 4.06Å; F220-F224 HydrophobicContact CD2-CE2 4.34Å; F220-F224 AromaticContact CE1-CE2 3.7Å; F220-F224 HydrophobicContact CE1-CE2 3.7Å; F220-F224 HydrophobicContact CE1-CZ 4.31Å; F220-F224 HydrophobicContact CE2-CE2 4.03Å; F220-F224 HydrophobicContact CG-CE2 4.39Å; F220-F224 AromaticContact CZ-CE2 3.7Å; F220-F224 HydrophobicContact CZ-CE2 3.7Å; F220-F224 HydrophobicContact CZ-CZ 4.09Å; F220-F224 VanDerWaalsContact O-CD2 3.29Å; F220-F224 WeakPolarHBondContact O-CD2 3.45Å; R221-F224 WeakPolarHBondContact O-CB 3.44Å; R221-F224 PolarHBondContact O-N 2.88Å; R221-F224 VanDerWaalsContact O-N 3.09Å; R221-F224 VanDerWaalsContact O-O 3.13Å; D222-F224 VanDerWaalsContact C-N 3.32Å; F224-E226 PolarHBondContact O-N 3.42Å; F224-E226 VanDerWaalsContact O-N 3.12Å; F224-F227 HydrophobicContact CB-CB 4.18Å; F224-F227 HydrophobicContact CB-CD2 3.52Å; F224-F227 HydrophobicContact CB-CE2 4.23Å; F224-F227 HydrophobicContact CB-CG 4.19Å; F224-F227 HydrophobicContact CD1-CD2 4.21Å; F224-F227 HydrophobicContact CD1-CE2 4.14Å; F224-F227 AromaticContact CG-CD2 3.88Å; F224-F227 HydrophobicContact CG-CD2 3.88Å; F224-F227 HydrophobicContact CG-CE2 4.29Å; F224-F227 PolarHBondContact O-N 3.47Å; F224-R228 PolarHBondContact O-N 2.92Å; F224-H244 AromaticContact CE1-CD2 3.96Å; F224-H244 AromaticContact CE1-NE2 3.79Å; F224-H244 AromaticContact CZ-NE2 3.71Å |
| 225 | T | 81.3 | Confident | 83.6 | Confident | 86 Ų | 86 | 72.5 Ų | 72.5 | 53% | 0.528 | 35% | 0.354 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -51.6 | -37.8 | -179.3 | 32.8 | 0 | 0 | 0 | 0 | 113.4 | A223 F227 | A223-T225 PolarHBondContact O-N 3.23Å; T225-F227 VanDerWaalsContact C-N 3.34Å; T225-F227 PolarHBondContact O-N 2.91Å |
| 226 | E | 81.8 | Confident | 83.5 | Confident | 113 Ų | 113 | 70.5 Ų | 70.5 | 53% | 0.528 | 34% | 0.344 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -72.4 | -22.6 | -177.5 | -67.3 | 76.7 | -173.8 | 0 | 0 | 113.6 | F224 R230 | F224-E226 PolarHBondContact O-N 3.42Å; F224-E226 VanDerWaalsContact O-N 3.12Å; E226-R230 WeakPolarHBondContact O-CD 3.37Å; E226-R230 PolarHBondContact O-NH1 2.99Å |
| 227 | F | 86.1 | Confident | 83.6 | Confident | 4 Ų | 4 | 72.1 Ų | 72.1 | 2% | 0.018 | 35% | 0.351 | C | S | . | . | T | Hydrogen-bonded Turn | trans | -112.8 | -7.6 | -174.6 | -52.7 | -37.6 | 0 | 0 | 0 | 113.5 | F214 R221 F224 T225 K229 R230 I235 D238 A240 M241 | F214-F227 HydrophobicContact CE2-CB 4.41Å; F214-F227 AromaticContact CE2-CD2 3.97Å; F214-F227 HydrophobicContact CE2-CD2 3.97Å; F214-F227 HydrophobicContact CE2-CG 4.45Å; F214-F227 AromaticContact CZ-CD2 3.99Å; F214-F227 HydrophobicContact CZ-CD2 3.99Å; R221-F227 WeakPolarHBondContact CD-O 3.16Å; R221-F227 HydrophobicContact CG-CB 3.99Å; F224-F227 HydrophobicContact CB-CB 4.18Å; F224-F227 HydrophobicContact CB-CD2 3.52Å; F224-F227 HydrophobicContact CB-CE2 4.23Å; F224-F227 HydrophobicContact CB-CG 4.19Å; F224-F227 HydrophobicContact CD1-CD2 4.21Å; F224-F227 HydrophobicContact CD1-CE2 4.14Å; F224-F227 AromaticContact CG-CD2 3.88Å; F224-F227 HydrophobicContact CG-CD2 3.88Å; F224-F227 HydrophobicContact CG-CE2 4.29Å; F224-F227 PolarHBondContact O-N 3.47Å; T225-F227 VanDerWaalsContact C-N 3.34Å; T225-F227 PolarHBondContact O-N 2.91Å; F227-K229 PolarHBondContact O-N 2.83Å; F227-R230 WeakPolarHBondContact O-CB 3.32Å; F227-R230 PolarHBondContact O-N 3.05Å; F227-I235 HydrophobicContact CB-CD1 3.94Å; F227-I235 HydrophobicContact CB-CG1 4.2Å; F227-I235 HydrophobicContact CD1-CG1 4.14Å; F227-I235 HydrophobicContact CD1-CG2 4.12Å; F227-I235 HydrophobicContact CE1-CG2 4.44Å; F227-I235 HydrophobicContact CG-CD1 4.5Å; F227-I235 HydrophobicContact CG-CG1 4.34Å; F227-I235 HydrophobicContact CG-CG2 4.21Å; F227-D238 HydrophobicContact CE1-CB 4.16Å; F227-A240 HydrophobicContact CE1-CB 4.29Å; F227-A240 HydrophobicContact CZ-CB 3.94Å; F227-M241 HydrophobicContact CD2-CE 3.75Å; F227-M241 HydrophobicContact CE1-CB 4.27Å; F227-M241 HydrophobicContact CE2-CB 4.3Å; F227-M241 HydrophobicContact CE2-CE 3.51Å; F227-M241 HydrophobicContact CZ-CB 3.76Å; F227-M241 HydrophobicContact CZ-CE 4.14Å |
| 228 | R | 84.4 | Confident | 83.8 | Confident | 120 Ų | 120 | 70.5 Ų | 70.5 | 45% | 0.453 | 35% | 0.345 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -49.6 | 125 | 179.2 | -172.8 | 176.9 | -61.8 | 134.4 | 2.3 | 111 | D222 F224 R230 | D222-R228 HydrophobicContact CB-CG 4.07Å; D222-R228 PolarHBondContact O-NE 3.27Å; D222-R228 PolarHBondContact O-NH2 2.79Å; D222-R228 WeakPolarHBondContact OD1-CA 3.43Å; F224-R228 PolarHBondContact O-N 2.92Å; R228-R230 PolarHBondContact O-N 3.05Å |
| 229 | K | 81.3 | Confident | 84.1 | Confident | 176 Ų | 176 | 71.5 Ų | 71.5 | 77% | 0.765 | 35% | 0.349 | S | S | * | . | T | Hydrogen-bonded Turn | trans | 58.6 | 8.9 | -179.6 | -59.3 | 172.1 | -178.2 | -177.2 | 0 | 116.4 | D222 F227 | D222-K229 PolarHBondContact OD1-N 3.14Å; F227-K229 PolarHBondContact O-N 2.83Å |
| 230 | R | 85.6 | Confident | 84.5 | Confident | 77 Ų | 77 | 70 Ų | 70 | 29% | 0.291 | 35% | 0.347 | S | S | . | . | trans | -79.8 | 151.8 | 174.7 | -69.7 | -179.4 | 63.9 | -164.8 | -1.1 | 111.3 | E226 F227 R228 D234 I235 D238 | E226-R230 WeakPolarHBondContact O-CD 3.37Å; E226-R230 PolarHBondContact O-NH1 2.99Å; F227-R230 WeakPolarHBondContact O-CB 3.32Å; F227-R230 PolarHBondContact O-N 3.05Å; R228-R230 PolarHBondContact O-N 3.05Å; R230-D234 PolarHBondContact NH2-O 2.89Å; R230-D234 VanDerWaalsContact NH2-O 3.17Å; R230-I235 HydrophobicContact CB-CD1 3.96Å; R230-I235 HydrophobicContact CB-CG1 3.84Å; R230-D238 IonicContact CZ-OD2 2.88Å; R230-D238 IonicContact NH1-OD2 2.86Å; R230-D238 PolarHBondContact NH1-OD2 3.17Å; R230-D238 IonicContact NH2-OD2 2.78Å; R230-D238 PolarHBondContact NH2-OD2 3.48Å; R230-D238 VanDerWaalsContact NH2-OD2 3.13Å | ||
| 231 | K | 85.1 | Confident | 85 | Confident | 154 Ų | 154 | 69.3 Ų | 69.3 | 67% | 0.67 | 34% | 0.344 | S | S | * | . | trans | -76.4 | 150.2 | 175.5 | -62.2 | 178.3 | -179.2 | 176 | 0 | 109.6 | V233 D234 I235 | K231-V233 HydrophobicContact CB-CG1 4.08Å; K231-V233 PolarHBondContact O-N 2.76Å; K231-D234 PolarHBondContact O-N 3.4Å; K231-I235 PolarHBondContact O-N 3.27Å | ||
| 232 | F | 84.6 | Confident | 85.4 | Confident | 70 Ų | 70 | 69.8 Ų | 69.8 | 31% | 0.307 | 35% | 0.348 | S | S | . | . | H | α-helix | trans | -59.6 | -32.5 | -179.6 | -63.2 | -28.7 | 0 | 0 | 0 | 113.7 | L211 F214 E215 D234 I235 K236 | L211-F232 HydrophobicContact CD2-CB 4.11Å; L211-F232 HydrophobicContact CD2-CD1 4.12Å; L211-F232 HydrophobicContact CD2-CG 4.31Å; F214-F232 HydrophobicContact CB-CE1 3.67Å; F214-F232 HydrophobicContact CB-CZ 4.16Å; E215-F232 HydrophobicContact CB-CE2 4.04Å; E215-F232 HydrophobicContact CB-CZ 4.16Å; E215-F232 HydrophobicContact CG-CE2 4.41Å; F232-D234 VanDerWaalsContact C-N 3.26Å; F232-D234 PolarHBondContact O-N 3.4Å; F232-I235 HydrophobicContact CD1-CD1 4.36Å; F232-I235 PolarHBondContact O-N 2.9Å; F232-K236 VanDerWaalsContact O-CB 3.29Å; F232-K236 WeakPolarHBondContact O-CB 3.32Å; F232-K236 PolarHBondContact O-N 3.28Å |
| 233 | V | 84 | Confident | 85.9 | Confident | 94 Ų | 94 | 70.6 Ų | 70.6 | 57% | 0.57 | 35% | 0.354 | S | S | * | . | H | α-helix | trans | -60.4 | -37 | 176 | 66.3 | 0 | 0 | 0 | 0 | 112 | K231 | K231-V233 HydrophobicContact CB-CG1 4.08Å; K231-V233 PolarHBondContact O-N 2.76Å |
| 234 | D | 86.5 | Confident | 86.5 | Confident | 78 Ų | 78 | 70.2 Ų | 70.2 | 42% | 0.417 | 35% | 0.346 | S | S | . | . | H | α-helix | trans | -77.5 | -37.2 | -179.9 | -51.7 | -40.2 | 0 | 0 | 0 | 111.2 | R230 K231 F232 | R230-D234 PolarHBondContact NH2-O 2.89Å; R230-D234 VanDerWaalsContact NH2-O 3.17Å; K231-D234 PolarHBondContact O-N 3.4Å; F232-D234 VanDerWaalsContact C-N 3.26Å; F232-D234 PolarHBondContact O-N 3.4Å |
| 235 | I | 87.5 | Confident | 87 | Confident | 0 Ų | 0 | 68.3 Ų | 68.3 | 0% | 0 | 34% | 0.338 | C | S | . | . | H | α-helix | trans | -71.5 | -35.7 | -179.6 | -62.8 | 165.7 | 0 | 0 | 0 | 111.1 | L211 F214 R221 F227 R230 K231 F232 H237 D238 M241 | L211-I235 HydrophobicContact CD2-CB 4.28Å; L211-I235 HydrophobicContact CD2-CG2 4.06Å; F214-I235 HydrophobicContact CD2-CD1 4.45Å; F214-I235 HydrophobicContact CE2-CG2 4.2Å; R221-I235 HydrophobicContact CG-CD1 4.24Å; F227-I235 HydrophobicContact CB-CD1 3.94Å; F227-I235 HydrophobicContact CB-CG1 4.2Å; F227-I235 HydrophobicContact CD1-CG1 4.14Å; F227-I235 HydrophobicContact CD1-CG2 4.12Å; F227-I235 HydrophobicContact CE1-CG2 4.44Å; F227-I235 HydrophobicContact CG-CD1 4.5Å; F227-I235 HydrophobicContact CG-CG1 4.34Å; F227-I235 HydrophobicContact CG-CG2 4.21Å; R230-I235 HydrophobicContact CB-CD1 3.96Å; R230-I235 HydrophobicContact CB-CG1 3.84Å; K231-I235 PolarHBondContact O-N 3.27Å; F232-I235 HydrophobicContact CD1-CD1 4.36Å; F232-I235 PolarHBondContact O-N 2.9Å; I235-H237 PolarHBondContact O-N 3.16Å; I235-D238 VanDerWaalsContact O-CB 3.24Å; I235-D238 WeakPolarHBondContact O-CB 3.18Å; I235-D238 PolarHBondContact O-N 3.39Å; I235-M241 HydrophobicContact CG2-CB 4.15Å; I235-M241 HydrophobicContact CG2-CE 3.49Å; I235-M241 VanDerWaalsContact CG2-CE 3.49Å; I235-M241 HydrophobicContact CG2-CG 4.03Å; I235-M241 WeakPolarHBondContact O-CB 3.24Å |
| 236 | K | 86.1 | Confident | 87.6 | Confident | 47 Ų | 47 | 65.7 Ų | 65.7 | 20% | 0.204 | 32% | 0.32 | C | S | . | . | H | α-helix | trans | -55.4 | -36.2 | -177.8 | 174.7 | 171.6 | 169 | -108.6 | 0 | 113.4 | H96 V207 L211 F232 | H96-K236 WeakPolarHBondContact CE1-CE 3.49Å; H96-K236 PolarHBondContact CE1-NZ 3.44Å; H96-K236 WeakPolarHBondContact ND1-CE 3.46Å; H96-K236 PolarHBondContact ND1-NZ 3.12Å; H96-K236 WeakPolarHBondContact NE2-CE 3.44Å; V207-K236 HydrophobicContact CG1-CB 4.47Å; V207-K236 HydrophobicContact CG1-CG 4.15Å; L211-K236 HydrophobicContact CD1-CB 4Å; L211-K236 HydrophobicContact CD1-CG 4.29Å; F232-K236 VanDerWaalsContact O-CB 3.29Å; F232-K236 WeakPolarHBondContact O-CB 3.32Å; F232-K236 PolarHBondContact O-N 3.28Å |
| 237 | H | 86.5 | Confident | 88.2 | Confident | 119 Ų | 119 | 66.9 Ų | 66.9 | 55% | 0.551 | 32% | 0.32 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -101.8 | 6.4 | -178.1 | -64.9 | -71.7 | 0 | 0 | 0 | 112.5 | I235 P239 | I235-H237 PolarHBondContact O-N 3.16Å; H237-P239 WeakPolarHBondContact O-CD 3.31Å |
| 238 | D | 88.8 | Confident | 88.6 | Confident | 28 Ų | 28 | 68.1 Ų | 68.1 | 15% | 0.15 | 33% | 0.328 | C | S | . | . | trans | -75.9 | 125.5 | -178.1 | -164.4 | -74.3 | 0 | 0 | 0 | 111.1 | F227 R230 I235 A240 M241 Q242 | F227-D238 HydrophobicContact CE1-CB 4.16Å; R230-D238 IonicContact CZ-OD2 2.88Å; R230-D238 IonicContact NH1-OD2 2.86Å; R230-D238 PolarHBondContact NH1-OD2 3.17Å; R230-D238 IonicContact NH2-OD2 2.78Å; R230-D238 PolarHBondContact NH2-OD2 3.48Å; R230-D238 VanDerWaalsContact NH2-OD2 3.13Å; I235-D238 VanDerWaalsContact O-CB 3.24Å; I235-D238 WeakPolarHBondContact O-CB 3.18Å; I235-D238 PolarHBondContact O-N 3.39Å; D238-A240 PolarHBondContact O-N 2.94Å; D238-A240 VanDerWaalsContact OD1-CB 3.22Å; D238-A240 WeakPolarHBondContact OD1-CB 3.42Å; D238-A240 PolarHBondContact OD1-N 3.47Å; D238-M241 HydrophobicContact CB-CB 4.19Å; D238-M241 WeakPolarHBondContact O-CB 3.36Å; D238-M241 PolarHBondContact O-N 3.06Å; D238-M241 VanDerWaalsContact O-N 3.1Å; D238-Q242 PolarHBondContact O-N 3.06Å; D238-Q242 VanDerWaalsContact O-N 3.13Å | ||
| 239 | P | 90.5 | Very high | 89.1 | Confident | 87 Ų | 87 | 62.5 Ų | 62.5 | 57% | 0.565 | 31% | 0.307 | S | S | * | . | H | α-helix | trans | -58 | -34.6 | 178.7 | -26.5 | 35.4 | 0 | 0 | 0 | 113.4 | H237 M241 Q242 V243 | H237-P239 WeakPolarHBondContact O-CD 3.31Å; P239-M241 VanDerWaalsContact C-N 3.3Å; P239-M241 PolarHBondContact O-N 2.81Å; P239-Q242 PolarHBondContact O-N 3.05Å; P239-V243 WeakPolarHBondContact O-CB 3.23Å; P239-V243 WeakPolarHBondContact O-CG2 3.45Å; P239-V243 PolarHBondContact O-N 3.32Å |
| 240 | A | 89.4 | Confident | 89.8 | Confident | 40 Ų | 40 | 55 Ų | 55 | 33% | 0.331 | 28% | 0.276 | S | S | . | . | H | α-helix | trans | -66.1 | -36.7 | 179.2 | 0 | 0 | 0 | 0 | 0 | 111.2 | F227 D238 H244 | F227-A240 HydrophobicContact CE1-CB 4.29Å; F227-A240 HydrophobicContact CZ-CB 3.94Å; D238-A240 PolarHBondContact O-N 2.94Å; D238-A240 VanDerWaalsContact OD1-CB 3.22Å; D238-A240 WeakPolarHBondContact OD1-CB 3.42Å; D238-A240 PolarHBondContact OD1-N 3.47Å; A240-H244 WeakPolarHBondContact O-CB 3.07Å; A240-H244 PolarHBondContact O-N 3.22Å |
| 241 | M | 90.5 | Very high | 90.2 | Very high | 0 Ų | 0 | 52.3 Ų | 52.3 | 0% | 0 | 27% | 0.269 | C | S | . | . | H | α-helix | trans | -66.4 | -47.3 | 175.9 | 175.9 | 51.8 | 74.8 | 0 | 0 | 110.7 | V207 F210 F214 F227 I235 D238 P239 V243 H244 G245 | V207-M241 HydrophobicContact CG2-CG 4.3Å; F210-M241 HydrophobicContact CB-CE 3.81Å; F210-M241 HydrophobicContact CB-SD 3.48Å; F210-M241 WeakPolarHBondContact CB-SD 3.44Å; F210-M241 HydrophobicContact CD2-SD 4.14Å; F210-M241 HydrophobicContact CG-CE 4.44Å; F210-M241 HydrophobicContact CG-SD 3.92Å; F214-M241 HydrophobicContact CD2-CE 4.17Å; F214-M241 HydrophobicContact CE2-CE 3.18Å; F214-M241 HydrophobicContact CZ-CE 3.56Å; F227-M241 HydrophobicContact CD2-CE 3.75Å; F227-M241 HydrophobicContact CE1-CB 4.27Å; F227-M241 HydrophobicContact CE2-CB 4.3Å; F227-M241 HydrophobicContact CE2-CE 3.51Å; F227-M241 HydrophobicContact CZ-CB 3.76Å; F227-M241 HydrophobicContact CZ-CE 4.14Å; I235-M241 HydrophobicContact CG2-CB 4.15Å; I235-M241 HydrophobicContact CG2-CE 3.49Å; I235-M241 VanDerWaalsContact CG2-CE 3.49Å; I235-M241 HydrophobicContact CG2-CG 4.03Å; I235-M241 WeakPolarHBondContact O-CB 3.24Å; D238-M241 HydrophobicContact CB-CB 4.19Å; D238-M241 WeakPolarHBondContact O-CB 3.36Å; D238-M241 PolarHBondContact O-N 3.06Å; D238-M241 VanDerWaalsContact O-N 3.1Å; P239-M241 VanDerWaalsContact C-N 3.3Å; P239-M241 PolarHBondContact O-N 2.81Å; M241-V243 PolarHBondContact O-N 3.36Å; M241-H244 PolarHBondContact O-N 3.09Å; M241-G245 PolarHBondContact O-N 3.44Å |
| 242 | Q | 91.6 | Very high | 90.7 | Very high | 48 Ų | 48 | 45 Ų | 45 | 22% | 0.224 | 24% | 0.237 | C | C | . | . | H | α-helix | trans | -58.9 | -47.5 | 177.6 | -67.6 | 175.7 | -8.7 | 0 | 0 | 111.4 | V207 D238 P239 H244 G245 L246 | V207-Q242 HydrophobicContact CG2-CG 3.91Å; D238-Q242 PolarHBondContact O-N 3.06Å; D238-Q242 VanDerWaalsContact O-N 3.13Å; P239-Q242 PolarHBondContact O-N 3.05Å; Q242-H244 VanDerWaalsContact C-N 3.3Å; Q242-H244 PolarHBondContact O-N 3.33Å; Q242-G245 PolarHBondContact O-N 3.39Å; Q242-L246 WeakPolarHBondContact O-CB 3.33Å; Q242-L246 VanDerWaalsContact O-CG 3.31Å; Q242-L246 WeakPolarHBondContact O-CG 3.42Å; Q242-L246 PolarHBondContact O-N 3.15Å |
| 243 | V | 91.7 | Very high | 91.2 | Very high | 63 Ų | 63 | 43.5 Ų | 43.5 | 38% | 0.382 | 23% | 0.232 | S | C | . | . | H | α-helix | trans | -64.2 | -34.6 | 178.7 | 173.3 | 0 | 0 | 0 | 0 | 111.7 | P239 M241 R247 | P239-V243 WeakPolarHBondContact O-CB 3.23Å; P239-V243 WeakPolarHBondContact O-CG2 3.45Å; P239-V243 PolarHBondContact O-N 3.32Å; M241-V243 PolarHBondContact O-N 3.36Å; V243-R247 WeakPolarHBondContact O-CG 3.35Å; V243-R247 PolarHBondContact O-N 3.35Å; V243-R247 VanDerWaalsContact O-N 3.1Å; V243-R247 PolarHBondContact O-NE 3.48Å |
| 244 | H | 90.9 | Very high | 91.7 | Very high | 31 Ų | 31 | 41.8 Ų | 41.8 | 14% | 0.144 | 22% | 0.217 | C | C | . | . | H | α-helix | trans | -70.1 | -45.7 | 174.9 | -169.5 | 65.8 | 0 | 0 | 0 | 112 | F210 F224 A240 M241 Q242 L246 R247 V248 | F210-H244 AromaticContact CE1-CD2 3.55Å; F210-H244 AromaticContact CE1-NE2 3.53Å; F210-H244 AromaticContact CE2-CD2 3.43Å; F210-H244 VanDerWaalsContact CE2-CD2 3.43Å; F210-H244 WeakPolarHBondContact CE2-CD2 3.49Å; F210-H244 AromaticContact CE2-NE2 3.93Å; F210-H244 AromaticContact CZ-CD2 3.13Å; F210-H244 WeakPolarHBondContact CZ-CD2 3.3Å; F210-H244 AromaticContact CZ-NE2 3.17Å; F210-H244 WeakPolarHBondContact CZ-NE2 3.22Å; F224-H244 AromaticContact CE1-CD2 3.96Å; F224-H244 AromaticContact CE1-NE2 3.79Å; F224-H244 AromaticContact CZ-NE2 3.71Å; A240-H244 WeakPolarHBondContact O-CB 3.07Å; A240-H244 PolarHBondContact O-N 3.22Å; M241-H244 PolarHBondContact O-N 3.09Å; Q242-H244 VanDerWaalsContact C-N 3.3Å; Q242-H244 PolarHBondContact O-N 3.33Å; H244-L246 VanDerWaalsContact C-N 3.32Å; H244-L246 PolarHBondContact O-N 2.77Å; H244-R247 WeakPolarHBondContact O-CB 3.24Å; H244-R247 PolarHBondContact O-N 3.4Å; H244-R247 VanDerWaalsContact O-N 3.11Å; H244-V248 PolarHBondContact O-N 2.98Å; H244-V248 VanDerWaalsContact O-N 3.14Å |
| 245 | G | 93.1 | Very high | 92.1 | Very high | 0 Ų | 0 | 38 Ų | 38 | 0% | 0 | 20% | 0.197 | C | C | . | . | H | α-helix | trans | -55.3 | -45.4 | 173.6 | 0 | 0 | 0 | 0 | 0 | 112.7 | M241 Q242 R247 V248 L249 | M241-G245 PolarHBondContact O-N 3.44Å; Q242-G245 PolarHBondContact O-N 3.39Å; G245-R247 PolarHBondContact O-N 3.17Å; G245-V248 PolarHBondContact O-N 3.37Å; G245-L249 PolarHBondContact O-N 2.89Å |
| 246 | L | 94.2 | Very high | 92.4 | Very high | 30 Ų | 30 | 38.1 Ų | 38.1 | 16% | 0.157 | 20% | 0.197 | C | C | . | . | H | α-helix | trans | -62.8 | -38.5 | 175.8 | -72.1 | 175.9 | 0 | 0 | 0 | 112.9 | L105 I202 E203 Q242 H244 V248 L249 S250 | L105-L246 HydrophobicContact CB-CD1 4.45Å; I202-L246 HydrophobicContact CB-CD2 4.48Å; I202-L246 HydrophobicContact CD1-CD2 4.31Å; I202-L246 HydrophobicContact CG1-CD2 4.13Å; I202-L246 HydrophobicContact CG2-CD2 3.79Å; E203-L246 HydrophobicContact CG-CD1 4.49Å; E203-L246 HydrophobicContact CG-CD2 3.97Å; Q242-L246 WeakPolarHBondContact O-CB 3.33Å; Q242-L246 VanDerWaalsContact O-CG 3.31Å; Q242-L246 WeakPolarHBondContact O-CG 3.42Å; Q242-L246 PolarHBondContact O-N 3.15Å; H244-L246 VanDerWaalsContact C-N 3.32Å; H244-L246 PolarHBondContact O-N 2.77Å; L246-V248 PolarHBondContact O-N 2.83Å; L246-L249 PolarHBondContact O-N 3.43Å; L246-S250 WeakPolarHBondContact O-CB 3.43Å; L246-S250 PolarHBondContact O-N 3.3Å; L246-S250 PolarHBondContact O-OG 2.75Å |
| 247 | R | 93.9 | Very high | 92.6 | Very high | 138 Ų | 138 | 39.5 Ų | 39.5 | 52% | 0.521 | 21% | 0.21 | S | C | . | . | H | α-helix | trans | -61.5 | -42.9 | 176.1 | -82 | 179.9 | -86.4 | 172.2 | -9.7 | 111.8 | V243 H244 G245 S250 V251 | V243-R247 WeakPolarHBondContact O-CG 3.35Å; V243-R247 PolarHBondContact O-N 3.35Å; V243-R247 VanDerWaalsContact O-N 3.1Å; V243-R247 PolarHBondContact O-NE 3.48Å; H244-R247 WeakPolarHBondContact O-CB 3.24Å; H244-R247 PolarHBondContact O-N 3.4Å; H244-R247 VanDerWaalsContact O-N 3.11Å; G245-R247 PolarHBondContact O-N 3.17Å; R247-S250 PolarHBondContact O-N 3.38Å; R247-V251 PolarHBondContact O-N 3.02Å |
| 248 | V | 93.8 | Very high | 92.7 | Very high | 31 Ų | 31 | 38.7 Ų | 38.7 | 19% | 0.188 | 20% | 0.202 | C | C | . | . | H | α-helix | trans | -64.6 | -47.7 | 176.2 | 174.7 | 0 | 0 | 0 | 0 | 111.1 | F210 H244 G245 L246 S250 V251 V252 L293 | F210-V248 HydrophobicContact CE2-CB 4.47Å; F210-V248 HydrophobicContact CE2-CG2 3.87Å; F210-V248 HydrophobicContact CZ-CG2 3.77Å; H244-V248 PolarHBondContact O-N 2.98Å; H244-V248 VanDerWaalsContact O-N 3.14Å; G245-V248 PolarHBondContact O-N 3.37Å; L246-V248 PolarHBondContact O-N 2.83Å; V248-S250 VanDerWaalsContact C-N 3.25Å; V248-S250 PolarHBondContact O-N 3.42Å; V248-V251 WeakPolarHBondContact O-CA 3.36Å; V248-V251 WeakPolarHBondContact O-CB 3.31Å; V248-V251 PolarHBondContact O-N 3.13Å; V248-V252 PolarHBondContact O-N 2.82Å; V248-V252 VanDerWaalsContact O-N 3.16Å; V248-L293 HydrophobicContact CG1-CD1 4.46Å |
| 249 | L | 95.8 | Very high | 92.6 | Very high | 1 Ų | 1 | 37.8 Ų | 37.8 | 1% | 0.005 | 20% | 0.197 | C | C | . | . | H | α-helix | trans | -69.7 | -23.8 | -178.5 | -66 | 175.5 | 0 | 0 | 0 | 113.1 | W195 I202 I205 G245 L246 V251 V252 D253 L293 | W195-L249 HydrophobicContact CH2-CB 4.33Å; W195-L249 HydrophobicContact CH2-CD2 4.34Å; I202-L249 HydrophobicContact CB-CD1 4.33Å; I202-L249 HydrophobicContact CD1-CB 3.69Å; I202-L249 HydrophobicContact CD1-CD1 4.49Å; I202-L249 HydrophobicContact CG1-CB 3.51Å; I202-L249 HydrophobicContact CG1-CD1 3.39Å; I202-L249 HydrophobicContact CG1-CG 4.07Å; I202-L249 WeakPolarHBondContact O-CD1 3.15Å; I205-L249 HydrophobicContact CB-CD1 3.98Å; I205-L249 HydrophobicContact CG2-CD1 3.84Å; I205-L249 HydrophobicContact CG2-CD2 4.1Å; G245-L249 PolarHBondContact O-N 2.89Å; L246-L249 PolarHBondContact O-N 3.43Å; L249-V251 VanDerWaalsContact C-N 3.3Å; L249-V252 HydrophobicContact CD2-CG2 4.33Å; L249-V252 WeakPolarHBondContact O-CB 3.15Å; L249-V252 PolarHBondContact O-N 3.48Å; L249-D253 PolarHBondContact O-N 3.45Å; L249-L293 HydrophobicContact CD2-CD2 3.68Å |
| 250 | S | 95.1 | Very high | 92.1 | Very high | 18 Ų | 18 | 37.4 Ų | 37.4 | 13% | 0.126 | 19% | 0.194 | C | C | . | . | H | α-helix | trans | -67.8 | -29.8 | 168.7 | -59.3 | 0 | 0 | 0 | 0 | 112.6 | L246 R247 V248 K254 | L246-S250 WeakPolarHBondContact O-CB 3.43Å; L246-S250 PolarHBondContact O-N 3.3Å; L246-S250 PolarHBondContact O-OG 2.75Å; R247-S250 PolarHBondContact O-N 3.38Å; V248-S250 VanDerWaalsContact C-N 3.25Å; V248-S250 PolarHBondContact O-N 3.42Å; S250-K254 WeakPolarHBondContact O-CG 3.16Å; S250-K254 PolarHBondContact O-N 3.01Å; S250-K254 VanDerWaalsContact O-N 3.13Å |
| 251 | V | 94.7 | Very high | 91.8 | Very high | 22 Ų | 22 | 43.8 Ų | 43.8 | 13% | 0.133 | 22% | 0.215 | C | C | . | . | H | α-helix | trans | -71.1 | -40.5 | 172.2 | 175.8 | 0 | 0 | 0 | 0 | 110.2 | R247 V248 L249 K254 L255 L269 I272 L322 | R247-V251 PolarHBondContact O-N 3.02Å; V248-V251 WeakPolarHBondContact O-CA 3.36Å; V248-V251 WeakPolarHBondContact O-CB 3.31Å; V248-V251 PolarHBondContact O-N 3.13Å; L249-V251 VanDerWaalsContact C-N 3.3Å; V251-K254 PolarHBondContact O-N 2.82Å; V251-L255 WeakPolarHBondContact O-CB 3.47Å; V251-L255 PolarHBondContact O-N 3.49Å; V251-L269 HydrophobicContact CG1-CD2 3.38Å; V251-I272 HydrophobicContact CG1-CD1 4.07Å; V251-I272 HydrophobicContact CG2-CD1 3.73Å; V251-L322 HydrophobicContact CG1-CD1 3.95Å |
| 252 | V | 95.9 | Very high | 91.5 | Very high | 1 Ų | 1 | 44.2 Ų | 44.2 | 1% | 0.006 | 22% | 0.217 | C | C | . | . | H | α-helix | trans | -60.2 | -44.2 | 173.1 | 180 | 0 | 0 | 0 | 0 | 111 | W195 V248 L249 K254 L255 I256 W315 L322 | W195-V252 HydrophobicContact CE3-CG1 4.47Å; W195-V252 HydrophobicContact CH2-CB 4.07Å; W195-V252 HydrophobicContact CH2-CG1 3.85Å; W195-V252 HydrophobicContact CZ2-CB 4.44Å; W195-V252 HydrophobicContact CZ2-CG1 4.3Å; W195-V252 HydrophobicContact CZ3-CG1 3.94Å; V248-V252 PolarHBondContact O-N 2.82Å; V248-V252 VanDerWaalsContact O-N 3.16Å; L249-V252 HydrophobicContact CD2-CG2 4.33Å; L249-V252 WeakPolarHBondContact O-CB 3.15Å; L249-V252 PolarHBondContact O-N 3.48Å; V252-K254 PolarHBondContact O-N 3.27Å; V252-L255 WeakPolarHBondContact O-CB 3.28Å; V252-L255 PolarHBondContact O-N 3.37Å; V252-I256 HydrophobicContact CG1-CD1 3.77Å; V252-I256 HydrophobicContact CG1-CG1 4.42Å; V252-I256 WeakPolarHBondContact O-CG1 3.4Å; V252-I256 PolarHBondContact O-N 2.85Å; V252-W315 HydrophobicContact CG1-CZ3 4.21Å; V252-L322 HydrophobicContact CG2-CD2 3.87Å |
| 253 | D | 95.4 | Very high | 91.3 | Very high | 38 Ų | 38 | 47 Ų | 47 | 20% | 0.203 | 23% | 0.234 | C | C | . | . | H | α-helix | trans | -57 | -48.9 | 174.7 | -172.8 | 69.5 | 0 | 0 | 0 | 111.6 | W195 K199 L249 L255 I256 T257 | W195-D253 HydrophobicContact CZ2-CB 3.73Å; W195-D253 PolarHBondContact NE1-OD1 3.03Å; K199-D253 IonicContact NZ-OD1 2.75Å; K199-D253 PolarHBondContact NZ-OD1 2.96Å; K199-D253 VanDerWaalsContact NZ-OD1 3.14Å; L249-D253 PolarHBondContact O-N 3.45Å; D253-L255 VanDerWaalsContact C-N 3.28Å; D253-L255 PolarHBondContact O-N 3.47Å; D253-I256 PolarHBondContact O-N 3.41Å; D253-T257 WeakPolarHBondContact O-CB 3.24Å; D253-T257 VanDerWaalsContact O-CG2 3.25Å; D253-T257 WeakPolarHBondContact O-CG2 3.32Å; D253-T257 PolarHBondContact O-N 2.88Å; D253-T257 PolarHBondContact O-OG1 3.24Å |
| 254 | K | 93.5 | Very high | 91.1 | Very high | 57 Ų | 57 | 49 Ų | 49 | 25% | 0.248 | 24% | 0.243 | C | C | . | . | H | α-helix | trans | -61.7 | -37.1 | 177.9 | -73.5 | 173.5 | -177.5 | -179.9 | 0 | 112.2 | S250 V251 V252 T257 R258 I265 | S250-K254 WeakPolarHBondContact O-CG 3.16Å; S250-K254 PolarHBondContact O-N 3.01Å; S250-K254 VanDerWaalsContact O-N 3.13Å; V251-K254 PolarHBondContact O-N 2.82Å; V252-K254 PolarHBondContact O-N 3.27Å; K254-T257 WeakPolarHBondContact CA-OG1 3.32Å; K254-T257 PolarHBondContact O-OG1 3.13Å; K254-R258 VanDerWaalsContact O-CB 3.24Å; K254-R258 WeakPolarHBondContact O-CB 3.12Å; K254-R258 WeakPolarHBondContact O-CD 3.17Å; K254-R258 WeakPolarHBondContact O-CG 3.41Å; K254-R258 PolarHBondContact O-N 3.18Å; K254-R258 VanDerWaalsContact O-N 3.14Å; K254-I265 HydrophobicContact CB-CD1 3.99Å |
| 255 | L | 94.2 | Very high | 91.1 | Very high | 0 Ų | 0 | 47.5 Ų | 47.5 | 0% | 0 | 24% | 0.236 | C | C | . | . | H | α-helix | trans | -65.1 | -50.2 | 176.9 | 177.7 | 56.1 | 0 | 0 | 0 | 111.4 | V251 V252 D253 T257 R258 L259 I265 I318 Y321 L322 | V251-L255 WeakPolarHBondContact O-CB 3.47Å; V251-L255 PolarHBondContact O-N 3.49Å; V252-L255 WeakPolarHBondContact O-CB 3.28Å; V252-L255 PolarHBondContact O-N 3.37Å; D253-L255 VanDerWaalsContact C-N 3.28Å; D253-L255 PolarHBondContact O-N 3.47Å; L255-T257 VanDerWaalsContact C-N 3.32Å; L255-T257 PolarHBondContact O-N 3.05Å; L255-R258 PolarHBondContact O-N 3.2Å; L255-L259 HydrophobicContact CD1-CD1 4.23Å; L255-L259 HydrophobicContact CD1-CG 4.35Å; L255-L259 HydrophobicContact CG-CD1 4.45Å; L255-L259 WeakPolarHBondContact O-CG 3.34Å; L255-L259 PolarHBondContact O-N 3.49Å; L255-I265 HydrophobicContact CB-CG1 4.19Å; L255-I265 HydrophobicContact CD1-CG1 3.95Å; L255-I265 HydrophobicContact CD1-CG2 4.08Å; L255-I318 HydrophobicContact CD2-CG2 3.72Å; L255-I318 HydrophobicContact CG-CG2 4.21Å; L255-Y321 HydrophobicContact CD1-CD1 3.71Å; L255-Y321 HydrophobicContact CD1-CE1 3.54Å; L255-Y321 HydrophobicContact CD2-CD1 4.03Å; L255-Y321 HydrophobicContact CG-CD1 4.5Å; L255-L322 HydrophobicContact CD2-CB 4.07Å |
| 256 | I | 94.6 | Very high | 91.2 | Very high | 1 Ų | 1 | 49.7 Ų | 49.7 | 1% | 0.005 | 25% | 0.246 | C | C | . | . | H | α-helix | trans | -65.3 | -36.9 | -179 | -65.3 | 172.5 | 0 | 0 | 0 | 111.8 | L191 Q192 W195 V252 D253 W315 I318 | L191-I256 HydrophobicContact CD1-CD1 4.24Å; L191-I256 HydrophobicContact CD1-CG1 4.41Å; L191-I256 HydrophobicContact CD2-CB 4.43Å; L191-I256 HydrophobicContact CD2-CG1 3.97Å; L191-I256 HydrophobicContact CD2-CG2 4.09Å; L191-I256 HydrophobicContact CG-CD1 4.25Å; L191-I256 HydrophobicContact CG-CG1 4.07Å; L191-I256 HydrophobicContact CG-CG2 3.93Å; Q192-I256 HydrophobicContact CG-CG2 4Å; W195-I256 HydrophobicContact CB-CD1 3.86Å; W195-I256 HydrophobicContact CB-CG2 4.23Å; W195-I256 HydrophobicContact CD2-CD1 3.7Å; W195-I256 HydrophobicContact CE3-CD1 4.06Å; W195-I256 HydrophobicContact CG-CD1 3.62Å; W195-I256 HydrophobicContact CG-CG2 4.33Å; V252-I256 HydrophobicContact CG1-CD1 3.77Å; V252-I256 HydrophobicContact CG1-CG1 4.42Å; V252-I256 WeakPolarHBondContact O-CG1 3.4Å; V252-I256 PolarHBondContact O-N 2.85Å; D253-I256 PolarHBondContact O-N 3.41Å; I256-W315 HydrophobicContact CD1-CH2 3.35Å; I256-W315 HydrophobicContact CD1-CZ2 4.18Å; I256-W315 HydrophobicContact CD1-CZ3 3.81Å; I256-I318 HydrophobicContact CG1-CG2 4.39Å |
| 257 | T | 91.2 | Very high | 91.2 | Very high | 76 Ų | 76 | 54.9 Ų | 54.9 | 47% | 0.466 | 27% | 0.267 | S | S | . | . | H | α-helix | trans | -79 | -21.5 | -177.7 | 52.6 | 0 | 0 | 0 | 0 | 114.1 | D253 K254 L255 | D253-T257 WeakPolarHBondContact O-CB 3.24Å; D253-T257 VanDerWaalsContact O-CG2 3.25Å; D253-T257 WeakPolarHBondContact O-CG2 3.32Å; D253-T257 PolarHBondContact O-N 2.88Å; D253-T257 PolarHBondContact O-OG1 3.24Å; K254-T257 WeakPolarHBondContact CA-OG1 3.32Å; K254-T257 PolarHBondContact O-OG1 3.13Å; L255-T257 VanDerWaalsContact C-N 3.32Å; L255-T257 PolarHBondContact O-N 3.05Å |
| 258 | R | 88 | Confident | 91.2 | Very high | 102 Ų | 102 | 50.9 Ų | 50.9 | 39% | 0.385 | 25% | 0.254 | S | S | . | . | H | α-helix | trans | -98.9 | -14.6 | -177.4 | -68.1 | 176.5 | 179.2 | -161.9 | -3.5 | 114.2 | K254 L255 K261 | K254-R258 VanDerWaalsContact O-CB 3.24Å; K254-R258 WeakPolarHBondContact O-CB 3.12Å; K254-R258 WeakPolarHBondContact O-CD 3.17Å; K254-R258 WeakPolarHBondContact O-CG 3.41Å; K254-R258 PolarHBondContact O-N 3.18Å; K254-R258 VanDerWaalsContact O-N 3.14Å; L255-R258 PolarHBondContact O-N 3.2Å; R258-K261 CarbonylContact O-C 3.6Å; R258-K261 WeakPolarHBondContact O-CA 3.37Å; R258-K261 PolarHBondContact O-N 2.82Å |
| 259 | L | 86.6 | Confident | 91.3 | Very high | 9 Ų | 9 | 49.4 Ų | 49.4 | 5% | 0.047 | 25% | 0.245 | C | C | . | . | T | Hydrogen-bonded Turn | trans | -63.1 | 135.9 | 174.2 | -76.7 | 164.2 | 0 | 0 | 0 | 111 | V180 L188 L255 T262 I318 | V180-L259 HydrophobicContact CB-CD2 4.11Å; V180-L259 HydrophobicContact CG2-CD2 4.11Å; L188-L259 HydrophobicContact CD2-CB 3.87Å; L255-L259 HydrophobicContact CD1-CD1 4.23Å; L255-L259 HydrophobicContact CD1-CG 4.35Å; L255-L259 HydrophobicContact CG-CD1 4.45Å; L255-L259 WeakPolarHBondContact O-CG 3.34Å; L255-L259 PolarHBondContact O-N 3.49Å; L259-T262 HydrophobicContact CD2-CG2 3.43Å; L259-T262 VanDerWaalsContact CD2-CG2 3.43Å; L259-I318 HydrophobicContact CD1-CD1 3.12Å |
| 260 | P | 79.3 | Confident | 91.3 | Very high | 79 Ų | 79 | 50.9 Ų | 50.9 | 51% | 0.513 | 25% | 0.253 | S | S | . | . | T | Hydrogen-bonded Turn | cis | -91.9 | 2.5 | 13.3 | 35.1 | -36.5 | 0 | 0 | 0 | 116 | T262 | P260-T262 PolarHBondContact O-N 3.47Š|
| 261 | K | 83.6 | Confident | 91.3 | Very high | 174 Ų | 174 | 55.2 Ų | 55.2 | 76% | 0.757 | 27% | 0.272 | S | S | * | . | trans | -82.3 | 84.9 | -177.6 | -64.7 | -176.5 | -179.5 | -178.3 | 0 | 111 | R258 | R258-K261 CarbonylContact O-C 3.6Å; R258-K261 WeakPolarHBondContact O-CA 3.37Å; R258-K261 PolarHBondContact O-N 2.82Å | ||
| 262 | T | 84 | Confident | 91.3 | Very high | 9 Ų | 9 | 56.1 Ų | 56.1 | 6% | 0.055 | 28% | 0.276 | C | S | . | . | trans | -79.8 | -20.3 | -169.2 | 46.5 | 0 | 0 | 0 | 0 | 115.8 | L177 V180 T181 L259 P260 D264 I265 E266 | L177-T262 HydrophobicContact CD1-CG2 3.98Å; V180-T262 HydrophobicContact CG2-CG2 4.32Å; T181-T262 HydrophobicContact CG2-CG2 3.72Å; L259-T262 HydrophobicContact CD2-CG2 3.43Å; L259-T262 VanDerWaalsContact CD2-CG2 3.43Å; P260-T262 PolarHBondContact O-N 3.47Å; T262-D264 VanDerWaalsContact C-N 3.33Å; T262-D264 PolarHBondContact O-N 2.8Å; T262-D264 VanDerWaalsContact O-N 3.17Å; T262-I265 WeakPolarHBondContact O-CG2 3.28Å; T262-I265 PolarHBondContact O-N 2.61Å; T262-I265 VanDerWaalsContact O-N 3.1Å; T262-E266 WeakPolarHBondContact O-CB 3.13Å; T262-E266 PolarHBondContact O-N 2.91Å | ||
| 263 | D | 88.1 | Confident | 91.3 | Very high | 106 Ų | 106 | 56 Ų | 56 | 57% | 0.567 | 28% | 0.275 | S | S | * | . | H | α-helix | trans | -54.8 | -43.9 | -167.6 | -59.5 | -9.7 | 0 | 0 | 0 | 114.1 | K267 | D263-K267 VanDerWaalsContact O-CG 3.31Å; D263-K267 WeakPolarHBondContact O-CG 3.44Å; D263-K267 PolarHBondContact O-N 3.02Å |
| 264 | D | 86.7 | Confident | 91.2 | Very high | 106 Ų | 106 | 56 Ų | 56 | 57% | 0.567 | 28% | 0.278 | S | S | * | . | H | α-helix | trans | -74.4 | -37.9 | -178.6 | -73.2 | -19.5 | 0 | 0 | 0 | 112.3 | T262 Q268 | T262-D264 VanDerWaalsContact C-N 3.33Å; T262-D264 PolarHBondContact O-N 2.8Å; T262-D264 VanDerWaalsContact O-N 3.17Å; D264-Q268 PolarHBondContact O-N 3.17Å |
| 265 | I | 91.4 | Very high | 91 | Very high | 0 Ų | 0 | 58.9 Ų | 58.9 | 0% | 0 | 29% | 0.29 | C | S | . | . | H | α-helix | trans | -73.5 | -36.9 | 179 | -171.8 | 65.6 | 0 | 0 | 0 | 110.6 | K254 L255 T262 K267 Q268 L269 | K254-I265 HydrophobicContact CB-CD1 3.99Å; L255-I265 HydrophobicContact CB-CG1 4.19Å; L255-I265 HydrophobicContact CD1-CG1 3.95Å; L255-I265 HydrophobicContact CD1-CG2 4.08Å; T262-I265 WeakPolarHBondContact O-CG2 3.28Å; T262-I265 PolarHBondContact O-N 2.61Å; T262-I265 VanDerWaalsContact O-N 3.1Å; I265-K267 PolarHBondContact O-N 3.19Å; I265-Q268 HydrophobicContact CD1-CB 4.47Å; I265-Q268 WeakPolarHBondContact O-CB 3.43Å; I265-Q268 PolarHBondContact O-N 2.92Å; I265-Q268 VanDerWaalsContact O-N 3.15Å; I265-L269 HydrophobicContact CG1-CD1 4.33Å; I265-L269 HydrophobicContact CG1-CG 4.25Å; I265-L269 VanDerWaalsContact O-CG 3.29Å; I265-L269 WeakPolarHBondContact O-CG 3.43Å; I265-L269 PolarHBondContact O-N 3.46Å |
| 266 | E | 94.8 | Very high | 90.8 | Very high | 46 Ų | 46 | 61.6 Ų | 61.6 | 22% | 0.215 | 30% | 0.303 | C | S | . | . | H | α-helix | trans | -58.2 | -51 | 175 | -172.2 | -175.1 | -173.4 | 0 | 0 | 110.8 | H173 T262 Q268 L269 M270 Y321 T325 | H173-E266 IonicContact CD2-OE1 3.13Å; H173-E266 IonicContact CE1-OE1 3.37Å; H173-E266 PolarHBondContact CE1-OE1 3.13Å; H173-E266 IonicContact NE2-OE1 2.61Å; H173-E266 PolarHBondContact NE2-OE1 2.68Å; T262-E266 WeakPolarHBondContact O-CB 3.13Å; T262-E266 PolarHBondContact O-N 2.91Å; E266-Q268 VanDerWaalsContact C-N 3.25Å; E266-Q268 PolarHBondContact O-N 2.81Å; E266-L269 PolarHBondContact O-N 3.44Å; E266-L269 VanDerWaalsContact O-N 3.1Å; E266-M270 HydrophobicContact CG-CG 4.39Å; E266-M270 WeakPolarHBondContact O-CB 3.47Å; E266-M270 VanDerWaalsContact O-CG 3.3Å; E266-M270 WeakPolarHBondContact O-CG 3.31Å; E266-M270 PolarHBondContact O-N 2.95Å; E266-Y321 WeakPolarHBondContact CB-OH 3.35Å; E266-T325 HydrophobicContact CG-CG2 4.16Å |
| 267 | K | 94 | Very high | 90.4 | Very high | 139 Ų | 139 | 61.9 Ų | 61.9 | 60% | 0.604 | 31% | 0.305 | S | S | * | . | H | α-helix | trans | -55.9 | -41.9 | 175.7 | -71.4 | 169 | -170.4 | 164.5 | 0 | 111.7 | D263 I265 M271 | D263-K267 VanDerWaalsContact O-CG 3.31Å; D263-K267 WeakPolarHBondContact O-CG 3.44Å; D263-K267 PolarHBondContact O-N 3.02Å; I265-K267 PolarHBondContact O-N 3.19Å; K267-M271 WeakPolarHBondContact O-CB 3.48Å; K267-M271 PolarHBondContact O-N 3.12Å |
| 268 | Q | 93.6 | Very high | 89.9 | Confident | 53 Ų | 53 | 66.7 Ų | 66.7 | 25% | 0.248 | 32% | 0.315 | C | S | . | . | H | α-helix | trans | -64.6 | -43.8 | 177.2 | -172.4 | -175.5 | -14.6 | 0 | 0 | 111.9 | D264 I265 E266 M271 I272 | D264-Q268 PolarHBondContact O-N 3.17Å; I265-Q268 HydrophobicContact CD1-CB 4.47Å; I265-Q268 WeakPolarHBondContact O-CB 3.43Å; I265-Q268 PolarHBondContact O-N 2.92Å; I265-Q268 VanDerWaalsContact O-N 3.15Å; E266-Q268 VanDerWaalsContact C-N 3.25Å; E266-Q268 PolarHBondContact O-N 2.81Å; Q268-M271 WeakPolarHBondContact O-CB 3.47Å; Q268-M271 PolarHBondContact O-N 3.21Å; Q268-I272 HydrophobicContact CG-CD1 4.28Å; Q268-I272 VanDerWaalsContact O-CG1 3.29Å; Q268-I272 WeakPolarHBondContact O-CG1 3.34Å; Q268-I272 PolarHBondContact O-N 3.46Å |
| 269 | L | 96.4 | Very high | 89.6 | Confident | 0 Ų | 0 | 68.6 Ų | 68.6 | 0% | 0 | 32% | 0.323 | C | S | . | . | H | α-helix | trans | -66.1 | -41.2 | 177.8 | -68.8 | -177.8 | 0 | 0 | 0 | 111.9 | V251 I265 E266 M271 I272 G273 Y321 L322 T325 V326 | V251-L269 HydrophobicContact CG1-CD2 3.38Å; I265-L269 HydrophobicContact CG1-CD1 4.33Å; I265-L269 HydrophobicContact CG1-CG 4.25Å; I265-L269 VanDerWaalsContact O-CG 3.29Å; I265-L269 WeakPolarHBondContact O-CG 3.43Å; I265-L269 PolarHBondContact O-N 3.46Å; E266-L269 PolarHBondContact O-N 3.44Å; E266-L269 VanDerWaalsContact O-N 3.1Å; L269-M271 VanDerWaalsContact C-N 3.33Å; L269-M271 PolarHBondContact O-N 3.09Å; L269-I272 HydrophobicContact CD2-CD1 4.26Å; L269-I272 WeakPolarHBondContact O-CB 3.45Å; L269-I272 PolarHBondContact O-N 2.96Å; L269-I272 VanDerWaalsContact O-N 3.16Å; L269-G273 PolarHBondContact O-N 2.85Å; L269-Y321 HydrophobicContact CD1-CD1 4.43Å; L269-Y321 HydrophobicContact CD1-CE1 3.92Å; L269-L322 HydrophobicContact CD1-CD1 4.25Å; L269-L322 HydrophobicContact CD2-CD1 3.39Å; L269-L322 HydrophobicContact CG-CD1 4.45Å; L269-T325 HydrophobicContact CB-CG2 3.38Å; L269-T325 HydrophobicContact CD1-CG2 4.13Å; L269-T325 HydrophobicContact CG-CG2 4.4Å; L269-V326 HydrophobicContact CB-CG2 4.49Å; L269-V326 HydrophobicContact CD2-CG2 4.35Å |
| 270 | M | 96.4 | Very high | 89.5 | Confident | 32 Ų | 32 | 68.4 Ų | 68.4 | 16% | 0.158 | 32% | 0.322 | C | S | . | . | H | α-helix | trans | -60.3 | -42.9 | 174 | -72 | -63.4 | -73.8 | 0 | 0 | 111.6 | E266 G273 S274 T325 Y328 G329 K332 | E266-M270 HydrophobicContact CG-CG 4.39Å; E266-M270 WeakPolarHBondContact O-CB 3.47Å; E266-M270 VanDerWaalsContact O-CG 3.3Å; E266-M270 WeakPolarHBondContact O-CG 3.31Å; E266-M270 PolarHBondContact O-N 2.95Å; M270-G273 PolarHBondContact O-N 3.31Å; M270-S274 PolarHBondContact O-N 3.06Å; M270-T325 HydrophobicContact CG-CG2 3.88Å; M270-T325 HydrophobicContact SD-CG2 3.88Å; M270-T325 VanDerWaalsContact SD-O 3.39Å; M270-Y328 HydrophobicContact CE-CD1 3.32Å; M270-Y328 HydrophobicContact CE-CE1 3.47Å; M270-Y328 VanDerWaalsContact CE-CE1 3.47Å; M270-Y328 HydrophobicContact CE-CG 4.11Å; M270-Y328 HydrophobicContact SD-CD1 3.49Å; M270-Y328 WeakPolarHBondContact SD-CD1 3.22Å; M270-Y328 HydrophobicContact SD-CE1 4.18Å; M270-Y328 HydrophobicContact SD-CG 4.24Å; M270-G329 VanDerWaalsContact SD-CA 3.55Å; M270-G329 PolarHBondContact SD-N 3.05Å; M270-G329 VanDerWaalsContact SD-N 3.4Å; M270-K332 HydrophobicContact CE-CD 3.88Å |
| 271 | M | 95.1 | Very high | 89.7 | Confident | 110 Ų | 110 | 65.9 Ų | 65.9 | 54% | 0.542 | 31% | 0.306 | S | S | . | . | H | α-helix | trans | -63.7 | -39.4 | 174.3 | -176.9 | 66 | 67.1 | 0 | 0 | 112 | K267 Q268 L269 S274 K275 | K267-M271 WeakPolarHBondContact O-CB 3.48Å; K267-M271 PolarHBondContact O-N 3.12Å; Q268-M271 WeakPolarHBondContact O-CB 3.47Å; Q268-M271 PolarHBondContact O-N 3.21Å; L269-M271 VanDerWaalsContact C-N 3.33Å; L269-M271 PolarHBondContact O-N 3.09Å; M271-S274 WeakPolarHBondContact O-CB 2.95Å; M271-S274 PolarHBondContact O-N 2.78Å; M271-K275 WeakPolarHBondContact O-CG 3.43Å; M271-K275 PolarHBondContact O-N 3.08Å; M271-K275 VanDerWaalsContact O-N 3.09Å |
| 272 | I | 94.6 | Very high | 89.9 | Confident | 40 Ų | 40 | 59.1 Ų | 59.1 | 21% | 0.205 | 28% | 0.279 | C | S | . | . | H | α-helix | trans | -61.4 | -47.2 | 173.5 | -71.2 | 164.1 | 0 | 0 | 0 | 109.9 | V251 Q268 L269 S274 K275 H276 V326 | V251-I272 HydrophobicContact CG1-CD1 4.07Å; V251-I272 HydrophobicContact CG2-CD1 3.73Å; Q268-I272 HydrophobicContact CG-CD1 4.28Å; Q268-I272 VanDerWaalsContact O-CG1 3.29Å; Q268-I272 WeakPolarHBondContact O-CG1 3.34Å; Q268-I272 PolarHBondContact O-N 3.46Å; L269-I272 HydrophobicContact CD2-CD1 4.26Å; L269-I272 WeakPolarHBondContact O-CB 3.45Å; L269-I272 PolarHBondContact O-N 2.96Å; L269-I272 VanDerWaalsContact O-N 3.16Å; I272-S274 VanDerWaalsContact C-N 3.34Å; I272-S274 PolarHBondContact O-N 3.09Å; I272-K275 PolarHBondContact O-N 2.92Å; I272-H276 PolarHBondContact O-N 2.88Å; I272-H276 PolarHBondContact O-ND1 3.5Å; I272-V326 HydrophobicContact CG2-CG1 4.42Å; I272-V326 HydrophobicContact CG2-CG2 4.11Å |
| 273 | G | 95 | Very high | 90.2 | Very high | 0 Ų | 0 | 59 Ų | 59 | 0% | 0 | 28% | 0.278 | C | S | . | . | H | α-helix | trans | -55.5 | -46.8 | 174.5 | 0 | 0 | 0 | 0 | 0 | 113 | L269 M270 K275 H276 C277 V326 L330 | L269-G273 PolarHBondContact O-N 2.85Å; M270-G273 PolarHBondContact O-N 3.31Å; G273-K275 VanDerWaalsContact C-N 3.32Å; G273-K275 PolarHBondContact O-N 3.28Å; G273-H276 PolarHBondContact O-N 3.41Å; G273-C277 PolarHBondContact O-N 2.97Å; G273-C277 VanDerWaalsContact O-N 3.15Å; G273-V326 WeakPolarHBondContact CA-O 3.04Å; G273-L330 WeakPolarHBondContact O-CA 3.29Å; G273-L330 WeakPolarHBondContact O-CB 2.97Å |
| 274 | S | 93.7 | Very high | 90.2 | Very high | 36 Ų | 36 | 56.6 Ų | 56.6 | 25% | 0.252 | 27% | 0.273 | S | S | . | . | H | α-helix | trans | -55.4 | -44.9 | 176.3 | -173.5 | 0 | 0 | 0 | 0 | 112.8 | M270 M271 I272 H276 C277 T333 | M270-S274 PolarHBondContact O-N 3.06Å; M271-S274 WeakPolarHBondContact O-CB 2.95Å; M271-S274 PolarHBondContact O-N 2.78Å; I272-S274 VanDerWaalsContact C-N 3.34Å; I272-S274 PolarHBondContact O-N 3.09Å; S274-H276 VanDerWaalsContact C-N 3.34Å; S274-H276 PolarHBondContact O-N 3.4Å; S274-C277 WeakPolarHBondContact O-CB 3.17Å; S274-C277 PolarHBondContact O-N 3.43Å; S274-T333 VanDerWaalsContact CA-OG1 3.24Å; S274-T333 WeakPolarHBondContact CA-OG1 3.45Å; S274-T333 WeakPolarHBondContact CB-OG1 3.43Å; S274-T333 VanDerWaalsContact OG-CG2 3.23Å; S274-T333 WeakPolarHBondContact OG-CG2 3.24Å; S274-T333 PolarHBondContact OG-OG1 2.7Å |
| 275 | K | 90.5 | Very high | 90.3 | Very high | 118 Ų | 118 | 51.8 Ų | 51.8 | 51% | 0.513 | 25% | 0.247 | S | C | . | . | H | α-helix | trans | -65.6 | -37.1 | 176.6 | -69 | 175.8 | -179.3 | -176.4 | 0 | 112.2 | M271 I272 G273 C277 R278 Y279 | M271-K275 WeakPolarHBondContact O-CG 3.43Å; M271-K275 PolarHBondContact O-N 3.08Å; M271-K275 VanDerWaalsContact O-N 3.09Å; I272-K275 PolarHBondContact O-N 2.92Å; G273-K275 VanDerWaalsContact C-N 3.32Å; G273-K275 PolarHBondContact O-N 3.28Å; K275-C277 PolarHBondContact O-N 3.47Å; K275-R278 PolarHBondContact O-N 3.45Å; K275-Y279 VanDerWaalsContact O-CD2 3.24Å; K275-Y279 WeakPolarHBondContact O-CD2 3.29Å; K275-Y279 WeakPolarHBondContact O-CE2 3.49Å |
| 276 | H | 90.1 | Very high | 90.3 | Very high | 58 Ų | 58 | 52.3 Ų | 52.3 | 27% | 0.269 | 25% | 0.25 | S | C | . | . | H | α-helix | trans | -70.9 | -17.8 | -179.9 | -78.5 | 80.6 | 0 | 0 | 0 | 113.7 | I272 G273 S274 R278 Y279 V280 L330 | I272-H276 PolarHBondContact O-N 2.88Å; I272-H276 PolarHBondContact O-ND1 3.5Å; G273-H276 PolarHBondContact O-N 3.41Å; S274-H276 VanDerWaalsContact C-N 3.34Å; S274-H276 PolarHBondContact O-N 3.4Å; H276-R278 PolarHBondContact O-N 2.87Å; H276-Y279 PolarHBondContact O-N 3.12Å; H276-V280 HydrophobicContact CB-CG2 3.75Å; H276-V280 WeakPolarHBondContact O-CG2 3.48Å; H276-V280 PolarHBondContact O-N 3.42Å; H276-L330 HydrophobicContact CB-CD1 4.15Å |
| 277 | C | 85.8 | Confident | 90.2 | Very high | 7 Ų | 7 | 52.1 Ų | 52.1 | 5% | 0.047 | 25% | 0.254 | C | S | . | . | T | Hydrogen-bonded Turn | trans | -53.6 | -21.8 | 170.3 | -171.5 | 0 | 0 | 0 | 0 | 113.3 | L158 G273 S274 K275 L330 T333 | L158-C277 WeakPolarHBondContact CD2-O 3.5Å; G273-C277 PolarHBondContact O-N 2.97Å; G273-C277 VanDerWaalsContact O-N 3.15Å; S274-C277 WeakPolarHBondContact O-CB 3.17Å; S274-C277 PolarHBondContact O-N 3.43Å; K275-C277 PolarHBondContact O-N 3.47Å; C277-L330 HydrophobicContact CB-CG 4.1Å; C277-T333 HydrophobicContact CB-CG2 4.29Å |
| 278 | R | 80.3 | Confident | 90 | Very high | 177 Ų | 177 | 46.5 Ų | 46.5 | 67% | 0.668 | 23% | 0.232 | S | C | * | . | T | Hydrogen-bonded Turn | trans | -97.2 | -3.4 | 179.8 | -62.2 | -175.9 | -175 | 175 | 1.3 | 115.4 | L158 K275 H276 | L158-R278 WeakPolarHBondContact CD2-O 3.27Å; K275-R278 PolarHBondContact O-N 3.45Å; H276-R278 PolarHBondContact O-N 2.87Å |
| 279 | Y | 81.9 | Confident | 90 | Very high | 142 Ų | 142 | 45.2 Ų | 45.2 | 56% | 0.557 | 23% | 0.228 | S | C | * | . | T | Hydrogen-bonded Turn | trans | -134.3 | -23.6 | -174.7 | -50.5 | -69.4 | 0 | 0 | 0 | 114.6 | A223 K275 H276 | A223-Y279 WeakPolarHBondContact CB-O 3.38Å; K275-Y279 VanDerWaalsContact O-CD2 3.24Å; K275-Y279 WeakPolarHBondContact O-CD2 3.29Å; K275-Y279 WeakPolarHBondContact O-CE2 3.49Å; H276-Y279 PolarHBondContact O-N 3.12Å |
| 280 | V | 84.4 | Confident | 90 | Very high | 5 Ų | 5 | 45.9 Ų | 45.9 | 3% | 0.03 | 23% | 0.232 | C | C | . | . | trans | -83.7 | 125.5 | -176.6 | 176.2 | 0 | 0 | 0 | 0 | 110.2 | L158 T159 H276 T282 V286 L330 | L158-V280 WeakPolarHBondContact CD1-O 3.28Å; L158-V280 WeakPolarHBondContact CG-O 3.24Å; T159-V280 WeakPolarHBondContact CG2-O 3.24Å; H276-V280 HydrophobicContact CB-CG2 3.75Å; H276-V280 WeakPolarHBondContact O-CG2 3.48Å; H276-V280 PolarHBondContact O-N 3.42Å; V280-T282 WeakPolarHBondContact CG1-O 3.42Å; V280-V286 HydrophobicContact CG1-CG2 4.19Å; V280-L330 HydrophobicContact CB-CD1 4.09Å; V280-L330 HydrophobicContact CG1-CD1 4.49Å; V280-L330 HydrophobicContact CG2-CD1 4.35Å | ||
| 281 | P | 82.6 | Confident | 89.9 | Confident | 26 Ų | 26 | 49.7 Ų | 49.7 | 17% | 0.169 | 25% | 0.254 | C | S | . | . | S | Bend | trans | -68.6 | -37 | -177.2 | 24.9 | -32.7 | 0 | 0 | 0 | 113.4 | T159 L285 | T159-P281 WeakPolarHBondContact CA-O 3.26Å; T159-P281 PolarHBondContact N-O 3.15Å; P281-L285 HydrophobicContact CG-CD2 4.04Å |
| 282 | T | 88 | Confident | 89.9 | Confident | 31 Ų | 31 | 45.8 Ų | 45.8 | 19% | 0.19 | 23% | 0.234 | C | C | . | . | trans | -139.2 | 137.5 | -178.1 | 153.1 | 0 | 0 | 0 | 0 | 110.1 | D161 V280 A284 L285 | D161-T282 VanDerWaalsContact OD1-CA 3.26Å; D161-T282 WeakPolarHBondContact OD1-CA 3.42Å; D161-T282 WeakPolarHBondContact OD2-CB 3.48Å; D161-T282 PolarHBondContact OD2-OG1 3.19Å; V280-T282 WeakPolarHBondContact CG1-O 3.42Å; T282-A284 PolarHBondContact O-N 3.37Å; T282-A284 WeakPolarHBondContact OG1-CB 3.23Å; T282-A284 PolarHBondContact OG1-N 3.33Å; T282-A284 VanDerWaalsContact OG1-N 3.16Å; T282-L285 HydrophobicContact CG2-CB 3.87Å; T282-L285 HydrophobicContact CG2-CD2 4.49Å; T282-L285 WeakPolarHBondContact O-CB 3.48Å; T282-L285 PolarHBondContact O-N 2.87Å | ||
| 283 | I | 91.2 | Very high | 90 | Very high | 8 Ų | 8 | 44 Ų | 44 | 4% | 0.041 | 22% | 0.224 | C | C | . | . | T | Hydrogen-bonded Turn | trans | -63.6 | -29.9 | 178.4 | -170.4 | 166.1 | 0 | 0 | 0 | 112.3 | D161 V162 I169 L285 V286 K327 L330 A331 | D161-I283 PolarHBondContact OD1-N 3.17Å; D161-I283 PolarHBondContact OD2-N 2.75Å; V162-I283 HydrophobicContact CG2-CB 4.02Å; V162-I283 HydrophobicContact CG2-CD1 3.99Å; V162-I283 HydrophobicContact CG2-CG2 4.23Å; I169-I283 HydrophobicContact CD1-CD1 3.81Å; I283-L285 PolarHBondContact O-N 3.09Å; I283-V286 WeakPolarHBondContact O-CB 3.47Å; I283-V286 PolarHBondContact O-N 3.47Å; I283-K327 HydrophobicContact CD1-CG 3.78Å; I283-K327 HydrophobicContact CG1-CD 4.5Å; I283-K327 HydrophobicContact CG1-CG 3.62Å; I283-L330 HydrophobicContact CB-CD2 4.28Å; I283-L330 HydrophobicContact CD1-CD2 3.87Å; I283-L330 HydrophobicContact CG1-CD2 4.03Å; I283-A331 HydrophobicContact CD1-CB 3.74Å |
| 284 | A | 87.8 | Confident | 90.1 | Very high | 55 Ų | 55 | 44.9 Ų | 44.9 | 46% | 0.455 | 23% | 0.228 | S | C | . | . | H | α-helix | trans | -57.8 | -35.3 | 179.4 | 0 | 0 | 0 | 0 | 0 | 112.1 | T282 V286 S287 | T282-A284 PolarHBondContact O-N 3.37Å; T282-A284 WeakPolarHBondContact OG1-CB 3.23Å; T282-A284 PolarHBondContact OG1-N 3.33Å; T282-A284 VanDerWaalsContact OG1-N 3.16Å; A284-V286 VanDerWaalsContact C-N 3.26Å; A284-V286 PolarHBondContact O-N 3.22Å; A284-S287 VanDerWaalsContact O-CB 3.3Å; A284-S287 WeakPolarHBondContact O-CB 3.45Å; A284-S287 PolarHBondContact O-N 3.41Å; A284-S287 PolarHBondContact O-OG 2.93Å |
| 285 | L | 88.3 | Confident | 90.2 | Very high | 4 Ų | 4 | 44.3 Ų | 44.3 | 2% | 0.021 | 23% | 0.228 | C | C | . | . | H | α-helix | trans | -66.3 | -24 | -176.8 | -175.9 | 65.1 | 0 | 0 | 0 | 114.3 | I213 H217 F220 P281 T282 I283 S287 S288 | I213-L285 HydrophobicContact CG2-CD1 3.87Å; H217-L285 HydrophobicContact CB-CD1 3.76Å; H217-L285 WeakPolarHBondContact CD2-CD1 3.34Å; H217-L285 VanDerWaalsContact CG-CD1 3.47Å; F220-L285 HydrophobicContact CB-CD2 3.54Å; F220-L285 HydrophobicContact CD1-CD2 4.34Å; F220-L285 HydrophobicContact CD2-CD2 3.13Å; F220-L285 HydrophobicContact CD2-CG 4.19Å; F220-L285 HydrophobicContact CE2-CD2 3.8Å; F220-L285 HydrophobicContact CG-CD2 3.43Å; F220-L285 VanDerWaalsContact CG-CD2 3.43Å; F220-L285 HydrophobicContact CG-CG 4.36Å; P281-L285 HydrophobicContact CG-CD2 4.04Å; T282-L285 HydrophobicContact CG2-CB 3.87Å; T282-L285 HydrophobicContact CG2-CD2 4.49Å; T282-L285 WeakPolarHBondContact O-CB 3.48Å; T282-L285 PolarHBondContact O-N 2.87Å; I283-L285 PolarHBondContact O-N 3.09Å; L285-S287 PolarHBondContact O-N 2.85Å; L285-S288 WeakPolarHBondContact O-CB 3.47Å; L285-S288 PolarHBondContact O-N 3.34Å; L285-S288 VanDerWaalsContact O-N 3.11Å |
| 286 | V | 92.7 | Very high | 90.4 | Very high | 11 Ų | 11 | 38.9 Ų | 38.9 | 7% | 0.067 | 21% | 0.205 | C | C | . | . | H | α-helix | trans | -58.4 | -35.1 | 172.8 | -178.1 | 0 | 0 | 0 | 0 | 110.2 | V280 I283 A284 V289 T323 V326 K327 L330 | V280-V286 HydrophobicContact CG1-CG2 4.19Å; I283-V286 WeakPolarHBondContact O-CB 3.47Å; I283-V286 PolarHBondContact O-N 3.47Å; A284-V286 VanDerWaalsContact C-N 3.26Å; A284-V286 PolarHBondContact O-N 3.22Å; V286-V289 WeakPolarHBondContact O-CB 3.35Å; V286-V289 PolarHBondContact O-N 3.13Å; V286-T323 WeakPolarHBondContact CG1-O 3.04Å; V286-T323 WeakPolarHBondContact O-CG2 3.07Å; V286-V326 HydrophobicContact CG1-CB 4.1Å; V286-V326 HydrophobicContact CG1-CG1 3.8Å; V286-K327 HydrophobicContact CB-CB 4.34Å; V286-K327 HydrophobicContact CG1-CB 4.01Å; V286-L330 HydrophobicContact CG2-CD1 4.28Å |
| 287 | S | 91.6 | Very high | 90.7 | Very high | 43 Ų | 43 | 36.1 Ų | 36.1 | 30% | 0.301 | 19% | 0.192 | S | C | . | . | H | α-helix | trans | -70.1 | -31.9 | 178.8 | -38.3 | 0 | 0 | 0 | 0 | 111.9 | A284 L285 V289 S290 | A284-S287 VanDerWaalsContact O-CB 3.3Å; A284-S287 WeakPolarHBondContact O-CB 3.45Å; A284-S287 PolarHBondContact O-N 3.41Å; A284-S287 PolarHBondContact O-OG 2.93Å; L285-S287 PolarHBondContact O-N 2.85Å; S287-V289 PolarHBondContact O-N 2.9Å; S287-V289 VanDerWaalsContact O-N 3.16Å; S287-S290 PolarHBondContact O-N 3.22Å; S287-S290 PolarHBondContact O-OG 2.95Å |
| 288 | S | 91.2 | Very high | 91.2 | Very high | 20 Ų | 20 | 37.9 Ų | 37.9 | 14% | 0.14 | 20% | 0.199 | C | C | . | . | H | α-helix | trans | -64.5 | -20.8 | 177.9 | -50.3 | 0 | 0 | 0 | 0 | 112.9 | L285 S290 D291 Q292 | L285-S288 WeakPolarHBondContact O-CB 3.47Å; L285-S288 PolarHBondContact O-N 3.34Å; L285-S288 VanDerWaalsContact O-N 3.11Å; S288-S290 VanDerWaalsContact C-N 3.34Å; S288-S290 PolarHBondContact O-N 2.84Å; S288-D291 PolarHBondContact O-N 2.88Å; S288-Q292 VanDerWaalsContact O-CG 3.29Å; S288-Q292 WeakPolarHBondContact O-CG 3.45Å; S288-Q292 PolarHBondContact O-N 3.4Å; S288-Q292 VanDerWaalsContact O-N 3.1Å |
| 289 | V | 93.1 | Very high | 91.9 | Very high | 27 Ų | 27 | 30.9 Ų | 30.9 | 16% | 0.164 | 18% | 0.177 | C | C | . | . | H | α-helix | trans | -63.6 | -39 | 179 | -179.7 | 0 | 0 | 0 | 0 | 111.4 | I213 V286 S287 Q292 L293 T323 | I213-V289 HydrophobicContact CD1-CG2 3.96Å; V286-V289 WeakPolarHBondContact O-CB 3.35Å; V286-V289 PolarHBondContact O-N 3.13Å; S287-V289 PolarHBondContact O-N 2.9Å; S287-V289 VanDerWaalsContact O-N 3.16Å; V289-Q292 PolarHBondContact O-N 2.94Å; V289-L293 HydrophobicContact CG1-CD1 3.87Å; V289-L293 HydrophobicContact CG1-CG 4.29Å; V289-L293 WeakPolarHBondContact O-CB 3.24Å; V289-L293 WeakPolarHBondContact O-CG 3.49Å; V289-L293 PolarHBondContact O-N 3.38Å; V289-T323 HydrophobicContact CB-CG2 4.01Å; V289-T323 HydrophobicContact CG1-CG2 4.5Å |
| 290 | S | 95.5 | Very high | 92.5 | Very high | 13 Ų | 13 | 24.4 Ų | 24.4 | 9% | 0.091 | 15% | 0.152 | C | C | . | . | H | α-helix | trans | -66.3 | -40.8 | 179.4 | 45.8 | 0 | 0 | 0 | 0 | 111.3 | S287 S288 Q292 L293 W294 | S287-S290 PolarHBondContact O-N 3.22Å; S287-S290 PolarHBondContact O-OG 2.95Å; S288-S290 VanDerWaalsContact C-N 3.34Å; S288-S290 PolarHBondContact O-N 2.84Å; S290-Q292 VanDerWaalsContact C-N 3.35Å; S290-Q292 PolarHBondContact O-N 2.97Å; S290-L293 PolarHBondContact O-N 3.12Å; S290-W294 VanDerWaalsContact O-CB 3.28Å; S290-W294 WeakPolarHBondContact O-CB 3.39Å; S290-W294 PolarHBondContact O-N 3Å |
| 291 | D | 94.6 | Very high | 93 | Very high | 113 Ų | 113 | 24.2 Ų | 24.2 | 60% | 0.604 | 15% | 0.151 | S | C | * | . | H | α-helix | trans | -65.4 | -39.6 | 178.5 | -67.7 | -20.8 | 0 | 0 | 0 | 111.6 | S288 W294 G295 | S288-D291 PolarHBondContact O-N 2.88Å; D291-W294 PolarHBondContact O-N 2.97Å; D291-G295 PolarHBondContact O-N 3.03Å |
| 292 | Q | 95.2 | Very high | 93.6 | Very high | 28 Ų | 28 | 27.6 Ų | 27.6 | 13% | 0.131 | 16% | 0.163 | C | C | . | . | H | α-helix | trans | -76 | -33.2 | 179.6 | -66.5 | -66.2 | -22.1 | 0 | 0 | 112.8 | T209 G212 I213 S288 V289 S290 A296 | T209-Q292 HydrophobicContact CG2-CB 3.86Å; T209-Q292 PolarHBondContact OG1-O 3.1Å; G212-Q292 VanDerWaalsContact CA-OE1 3.31Å; I213-Q292 HydrophobicContact CD1-CB 4.46Å; I213-Q292 HydrophobicContact CG1-CB 3.84Å; I213-Q292 HydrophobicContact CG1-CG 3.58Å; S288-Q292 VanDerWaalsContact O-CG 3.29Å; S288-Q292 WeakPolarHBondContact O-CG 3.45Å; S288-Q292 PolarHBondContact O-N 3.4Å; S288-Q292 VanDerWaalsContact O-N 3.1Å; V289-Q292 PolarHBondContact O-N 2.94Å; S290-Q292 VanDerWaalsContact C-N 3.35Å; S290-Q292 PolarHBondContact O-N 2.97Å; Q292-A296 WeakPolarHBondContact O-CB 3.44Å; Q292-A296 PolarHBondContact O-N 3.27Å |
| 293 | L | 96.8 | Very high | 93.8 | Very high | 1 Ų | 1 | 32.1 Ų | 32.1 | 1% | 0.005 | 18% | 0.182 | C | C | . | . | H | α-helix | trans | -64.7 | -48.8 | 168.8 | -79.3 | 170.4 | 0 | 0 | 0 | 110.3 | T209 V248 L249 V289 S290 G295 A296 I297 L319 L322 | T209-L293 HydrophobicContact CG2-CD2 3.9Å; T209-L293 HydrophobicContact CG2-CG 3.86Å; V248-L293 HydrophobicContact CG1-CD1 4.46Å; L249-L293 HydrophobicContact CD2-CD2 3.68Å; V289-L293 HydrophobicContact CG1-CD1 3.87Å; V289-L293 HydrophobicContact CG1-CG 4.29Å; V289-L293 WeakPolarHBondContact O-CB 3.24Å; V289-L293 WeakPolarHBondContact O-CG 3.49Å; V289-L293 PolarHBondContact O-N 3.38Å; S290-L293 PolarHBondContact O-N 3.12Å; L293-G295 PolarHBondContact O-N 2.78Å; L293-A296 PolarHBondContact O-N 3.36Å; L293-A296 VanDerWaalsContact O-N 3.13Å; L293-I297 HydrophobicContact CB-CD1 4.44Å; L293-I297 WeakPolarHBondContact O-CB 3.08Å; L293-I297 VanDerWaalsContact O-CG1 3.25Å; L293-I297 WeakPolarHBondContact O-CG1 3.42Å; L293-I297 PolarHBondContact O-N 3.21Å; L293-L319 HydrophobicContact CB-CD1 4.07Å; L293-L319 HydrophobicContact CB-CD2 3.96Å; L293-L319 HydrophobicContact CD1-CD2 3.84Å; L293-L322 HydrophobicContact CD1-CD2 4.05Å |
| 294 | W | 96.8 | Very high | 93.8 | Very high | 20 Ų | 20 | 36.2 Ų | 36.2 | 8% | 0.076 | 20% | 0.201 | C | C | . | . | H | α-helix | trans | -60.3 | -46.9 | 178.7 | 178.1 | -110.2 | 0 | 0 | 0 | 111.6 | S290 D291 A296 I297 E298 L301 W307 A312 W315 K316 L319 | S290-W294 VanDerWaalsContact O-CB 3.28Å; S290-W294 WeakPolarHBondContact O-CB 3.39Å; S290-W294 PolarHBondContact O-N 3Å; D291-W294 PolarHBondContact O-N 2.97Å; W294-A296 PolarHBondContact O-N 3.27Å; W294-I297 HydrophobicContact CZ3-CG2 4.47Å; W294-I297 PolarHBondContact O-N 2.82Å; W294-I297 VanDerWaalsContact O-N 3.1Å; W294-E298 HydrophobicContact CD2-CB 4.1Å; W294-E298 HydrophobicContact CE3-CB 4.4Å; W294-E298 HydrophobicContact CH2-CB 3.97Å; W294-E298 HydrophobicContact CZ2-CB 3.64Å; W294-E298 HydrophobicContact CZ2-CG 4.02Å; W294-E298 HydrophobicContact CZ3-CB 4.32Å; W294-E298 PolarHBondContact NE1-OE2 3.02Å; W294-E298 WeakPolarHBondContact O-CB 3.49Å; W294-E298 PolarHBondContact O-N 3.16Å; W294-L301 HydrophobicContact CZ3-CD1 4.45Å; W294-W307 HydrophobicContact CH2-CH2 4.22Å; W294-W307 AromaticContact CH2-CZ3 3.64Å; W294-W307 HydrophobicContact CH2-CZ3 3.64Å; W294-W307 AromaticContact CZ2-CH2 3.75Å; W294-W307 HydrophobicContact CZ2-CH2 3.75Å; W294-W307 AromaticContact CZ2-CZ3 3.56Å; W294-W307 HydrophobicContact CZ2-CZ3 3.56Å; W294-A312 HydrophobicContact CH2-CB 3.76Å; W294-A312 HydrophobicContact CZ2-CB 3.85Å; W294-W315 HydrophobicContact CE3-CB 3.91Å; W294-W315 HydrophobicContact CH2-CB 4.28Å; W294-W315 HydrophobicContact CZ3-CB 3.4Å; W294-W315 VanDerWaalsContact CZ3-CB 3.4Å; W294-W315 AromaticContact CZ3-CG 3.89Å; W294-W315 HydrophobicContact CZ3-CG 3.89Å; W294-K316 HydrophobicContact CD2-CG 4.14Å; W294-K316 VanDerWaalsContact CE2-CE 3.47Å; W294-K316 HydrophobicContact CE3-CG 4.48Å; W294-K316 HydrophobicContact CG-CG 4.4Å; W294-L319 HydrophobicContact CB-CD1 3.81Å; W294-L319 HydrophobicContact CE3-CD1 4.33Å |
| 295 | G | 95.5 | Very high | 94 | Very high | 24 Ų | 24 | 36.7 Ų | 36.7 | 25% | 0.247 | 21% | 0.212 | C | C | . | . | H | α-helix | trans | -57.6 | -31.9 | 176.5 | 0 | 0 | 0 | 0 | 0 | 113.1 | F89 D291 L293 P299 | F89-G295 WeakPolarHBondContact CE2-O 3.16Å; F89-G295 WeakPolarHBondContact CZ-O 3.24Å; D291-G295 PolarHBondContact O-N 3.03Å; L293-G295 PolarHBondContact O-N 2.78Å; G295-P299 WeakPolarHBondContact O-CD 3.29Å |
| 296 | A | 95.7 | Very high | 94.1 | Very high | 3 Ų | 3 | 39.6 Ų | 39.6 | 3% | 0.025 | 23% | 0.227 | C | C | . | . | H | α-helix | trans | -80.1 | -35.2 | 175.1 | 0 | 0 | 0 | 0 | 0 | 114 | I205 I208 Q292 L293 W294 | I205-A296 HydrophobicContact CG2-CB 3.88Å; I208-A296 HydrophobicContact CB-CB 4.42Å; I208-A296 HydrophobicContact CG2-CB 3.99Å; Q292-A296 WeakPolarHBondContact O-CB 3.44Å; Q292-A296 PolarHBondContact O-N 3.27Å; L293-A296 PolarHBondContact O-N 3.36Å; L293-A296 VanDerWaalsContact O-N 3.13Å; W294-A296 PolarHBondContact O-N 3.27Å |
| 297 | I | 96.5 | Very high | 94 | Very high | 0 Ų | 0 | 43.9 Ų | 43.9 | 0% | 0 | 24% | 0.242 | C | C | . | . | H | α-helix | trans | -81.7 | -46 | -175.7 | -70.4 | 165.5 | 0 | 0 | 0 | 112 | V198 I205 L293 W294 P299 V300 L301 W315 L319 | V198-I297 HydrophobicContact CG1-CG1 4.06Å; V198-I297 HydrophobicContact CG1-CG2 4.46Å; V198-I297 HydrophobicContact CG2-CG2 3.95Å; I205-I297 HydrophobicContact CD1-CG1 4.38Å; I205-I297 HydrophobicContact CG2-CG1 4.14Å; L293-I297 HydrophobicContact CB-CD1 4.44Å; L293-I297 WeakPolarHBondContact O-CB 3.08Å; L293-I297 VanDerWaalsContact O-CG1 3.25Å; L293-I297 WeakPolarHBondContact O-CG1 3.42Å; L293-I297 PolarHBondContact O-N 3.21Å; W294-I297 HydrophobicContact CZ3-CG2 4.47Å; W294-I297 PolarHBondContact O-N 2.82Å; W294-I297 VanDerWaalsContact O-N 3.1Å; I297-P299 VanDerWaalsContact C-N 3.33Å; I297-V300 WeakPolarHBondContact O-CB 3.47Å; I297-V300 PolarHBondContact O-N 3.18Å; I297-V300 VanDerWaalsContact O-N 3.09Å; I297-L301 HydrophobicContact CG2-CD1 3.68Å; I297-L301 HydrophobicContact CG2-CG 4.02Å; I297-L301 PolarHBondContact O-N 3.31Å; I297-L301 VanDerWaalsContact O-N 3.13Å; I297-W315 HydrophobicContact CD1-CE3 4.17Å; I297-W315 HydrophobicContact CD1-CZ3 3.95Å; I297-W315 HydrophobicContact CG2-CD2 4.34Å; I297-W315 HydrophobicContact CG2-CE3 4.49Å; I297-L319 HydrophobicContact CD1-CD1 4.45Å |
| 298 | E | 96.5 | Very high | 94.2 | Very high | 44 Ų | 44 | 43.7 Ų | 43.7 | 21% | 0.206 | 24% | 0.241 | C | C | . | . | H | α-helix | trans | -51.4 | -45.8 | -173.1 | 158.6 | 174.6 | -164.6 | 0 | 0 | 112.8 | W294 V300 L301 K302 W307 | W294-E298 HydrophobicContact CD2-CB 4.1Å; W294-E298 HydrophobicContact CE3-CB 4.4Å; W294-E298 HydrophobicContact CH2-CB 3.97Å; W294-E298 HydrophobicContact CZ2-CB 3.64Å; W294-E298 HydrophobicContact CZ2-CG 4.02Å; W294-E298 HydrophobicContact CZ3-CB 4.32Å; W294-E298 PolarHBondContact NE1-OE2 3.02Å; W294-E298 WeakPolarHBondContact O-CB 3.49Å; W294-E298 PolarHBondContact O-N 3.16Å; E298-V300 PolarHBondContact O-N 3.11Å; E298-L301 PolarHBondContact O-N 3.12Å; E298-K302 HydrophobicContact CG-CD 4.03Å; E298-K302 WeakPolarHBondContact O-CG 3.46Å; E298-K302 PolarHBondContact O-N 3.07Å; E298-K302 VanDerWaalsContact OE1-CE 3.31Å; E298-K302 WeakPolarHBondContact OE1-CE 3.3Å; E298-K302 IonicContact OE1-NZ 3.27Å; E298-K302 PolarHBondContact OE1-NZ 3.32Å; E298-W307 HydrophobicContact CB-CZ3 4.31Å; E298-W307 HydrophobicContact CG-CE3 4.39Å; E298-W307 HydrophobicContact CG-CH2 4.18Å; E298-W307 HydrophobicContact CG-CZ3 3.65Å; E298-W307 WeakPolarHBondContact OE1-CH2 3.48Å |
| 299 | P | 94.6 | Very high | 94.4 | Very high | 30 Ų | 30 | 46.1 Ų | 46.1 | 20% | 0.195 | 26% | 0.262 | C | S | . | . | H | α-helix | trans | -74.1 | -27.1 | -176.1 | -29.7 | 46.9 | 0 | 0 | 0 | 113.4 | F89 I93 G295 I297 K302 E303 | F89-P299 HydrophobicContact CD1-CB 4.05Å; F89-P299 HydrophobicContact CD1-CG 3.61Å; F89-P299 HydrophobicContact CE1-CB 3.41Å; F89-P299 VanDerWaalsContact CE1-CB 3.41Å; F89-P299 HydrophobicContact CE1-CG 3.18Å; F89-P299 HydrophobicContact CZ-CB 4.27Å; F89-P299 HydrophobicContact CZ-CG 3.88Å; I93-P299 HydrophobicContact CD1-CB 3.6Å; G295-P299 WeakPolarHBondContact O-CD 3.29Å; I297-P299 VanDerWaalsContact C-N 3.33Å; P299-K302 PolarHBondContact O-N 2.92Å; P299-E303 WeakPolarHBondContact O-CB 3.47Å; P299-E303 PolarHBondContact O-N 3.33Å |
| 300 | V | 94.5 | Very high | 94.5 | Very high | 7 Ų | 7 | 50 Ų | 50 | 4% | 0.042 | 28% | 0.281 | C | S | . | . | H | α-helix | trans | -63.1 | -47.3 | 170.2 | 176.7 | 0 | 0 | 0 | 0 | 109.5 | I205 I297 E298 K302 E303 E304 | I205-V300 HydrophobicContact CD1-CG2 4.35Å; I297-V300 WeakPolarHBondContact O-CB 3.47Å; I297-V300 PolarHBondContact O-N 3.18Å; I297-V300 VanDerWaalsContact O-N 3.09Å; E298-V300 PolarHBondContact O-N 3.11Å; V300-K302 VanDerWaalsContact C-N 3.29Å; V300-K302 PolarHBondContact O-N 3.39Å; V300-E303 PolarHBondContact O-N 3.1Å; V300-E304 WeakPolarHBondContact O-CB 3.29Å; V300-E304 VanDerWaalsContact O-CG 3.3Å; V300-E304 WeakPolarHBondContact O-CG 3.41Å; V300-E304 PolarHBondContact O-N 3.15Å |
| 301 | L | 95.1 | Very high | 94.6 | Very high | 0 Ų | 0 | 49.5 Ų | 49.5 | 0% | 0 | 28% | 0.278 | C | S | . | . | H | α-helix | trans | -63.1 | -35.7 | 178.2 | -63.8 | 177.7 | 0 | 0 | 0 | 112.8 | V198 W294 I297 E298 G305 L306 L311 W315 | V198-L301 HydrophobicContact CG2-CD2 3.58Å; V198-L301 HydrophobicContact CG2-CG 4.12Å; W294-L301 HydrophobicContact CZ3-CD1 4.45Å; I297-L301 HydrophobicContact CG2-CD1 3.68Å; I297-L301 HydrophobicContact CG2-CG 4.02Å; I297-L301 PolarHBondContact O-N 3.31Å; I297-L301 VanDerWaalsContact O-N 3.13Å; E298-L301 PolarHBondContact O-N 3.12Å; L301-G305 PolarHBondContact O-N 3.09Å; L301-L306 PolarHBondContact O-N 3.43Å; L301-L311 HydrophobicContact CD1-CD2 4.08Å; L301-L311 HydrophobicContact CD1-CG 4.48Å; L301-W315 HydrophobicContact CD1-CG 4.47Å |
| 302 | K | 95.1 | Very high | 94.7 | Very high | 98 Ų | 98 | 44.5 Ų | 44.5 | 43% | 0.426 | 25% | 0.252 | S | S | . | . | H | α-helix | trans | -70.2 | -42.3 | 175.9 | -76.7 | 177.1 | 170 | 175.9 | 0 | 112.6 | E298 P299 V300 E304 G305 W307 | E298-K302 HydrophobicContact CG-CD 4.03Å; E298-K302 WeakPolarHBondContact O-CG 3.46Å; E298-K302 PolarHBondContact O-N 3.07Å; E298-K302 VanDerWaalsContact OE1-CE 3.31Å; E298-K302 WeakPolarHBondContact OE1-CE 3.3Å; E298-K302 IonicContact OE1-NZ 3.27Å; E298-K302 PolarHBondContact OE1-NZ 3.32Å; P299-K302 PolarHBondContact O-N 2.92Å; V300-K302 VanDerWaalsContact C-N 3.29Å; V300-K302 PolarHBondContact O-N 3.39Å; K302-E304 VanDerWaalsContact C-N 3.32Å; K302-G305 PolarHBondContact O-N 2.91Å; K302-W307 HydrophobicContact CD-CD2 4.31Å; K302-W307 HydrophobicContact CD-CE3 4.22Å; K302-W307 VanDerWaalsContact CE-CD2 3.44Å; K302-W307 HydrophobicContact CG-CB 3.87Å; K302-W307 HydrophobicContact CG-CD2 3.8Å; K302-W307 HydrophobicContact CG-CE3 3.71Å; K302-W307 HydrophobicContact CG-CG 3.87Å; K302-W307 HydrophobicContact CG-CZ3 4.48Å |
| 303 | E | 92.4 | Very high | 94.8 | Very high | 125 Ų | 125 | 47.2 Ų | 47.2 | 58% | 0.584 | 27% | 0.271 | S | S | * | . | H | α-helix | trans | -65.5 | -37.2 | 179.1 | -173.2 | 166.5 | -168.7 | 0 | 0 | 111.6 | P299 V300 G305 | P299-E303 WeakPolarHBondContact O-CB 3.47Å; P299-E303 PolarHBondContact O-N 3.33Å; V300-E303 PolarHBondContact O-N 3.1Å; E303-G305 PolarHBondContact O-N 3.39Å |
| 304 | E | 91.2 | Very high | 94.8 | Very high | 94 Ų | 94 | 47.2 Ų | 47.2 | 44% | 0.439 | 27% | 0.27 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -81.7 | 3.9 | 177.8 | -64.3 | -70.9 | 149.8 | 0 | 0 | 113.5 | I197 V300 K302 L306 | I197-E304 HydrophobicContact CG2-CB 3.94Å; I197-E304 HydrophobicContact CG2-CG 3.55Å; V300-E304 WeakPolarHBondContact O-CB 3.29Å; V300-E304 VanDerWaalsContact O-CG 3.3Å; V300-E304 WeakPolarHBondContact O-CG 3.41Å; V300-E304 PolarHBondContact O-N 3.15Å; K302-E304 VanDerWaalsContact C-N 3.32Å; E304-L306 VanDerWaalsContact C-N 3.26Å; E304-L306 PolarHBondContact O-N 3.03Å |
| 305 | G | 92.3 | Very high | 94.9 | Very high | 66 Ų | 66 | 46.2 Ų | 46.2 | 68% | 0.68 | 27% | 0.267 | S | S | * | . | T | Hydrogen-bonded Turn | trans | 70.4 | 14.5 | 175.5 | 0 | 0 | 0 | 0 | 0 | 115.5 | L301 K302 E303 | L301-G305 PolarHBondContact O-N 3.09Å; K302-G305 PolarHBondContact O-N 2.91Å; E303-G305 PolarHBondContact O-N 3.39Å |
| 306 | L | 90.3 | Very high | 94.9 | Very high | 65 Ų | 65 | 50.3 Ų | 50.3 | 34% | 0.34 | 28% | 0.278 | S | S | . | . | trans | -89.9 | 0.4 | -179.1 | -69.3 | -177.3 | 0 | 0 | 0 | 114.1 | I197 L301 E304 S308 L311 | I197-L306 HydrophobicContact CB-CD1 4.17Å; I197-L306 HydrophobicContact CG1-CD1 3.64Å; L301-L306 PolarHBondContact O-N 3.43Å; E304-L306 VanDerWaalsContact C-N 3.26Å; E304-L306 PolarHBondContact O-N 3.03Å; L306-S308 PolarHBondContact O-N 3.3Å; L306-L311 HydrophobicContact CB-CD2 4.42Å; L306-L311 WeakPolarHBondContact O-CD2 3.39Å | ||
| 307 | W | 90.6 | Very high | 95 | Very high | 100 Ų | 100 | 51.3 Ų | 51.3 | 38% | 0.379 | 29% | 0.285 | S | S | . | . | trans | -65.8 | 128.9 | -171.7 | 176.9 | -95.3 | 0 | 0 | 0 | 113.7 | W294 E298 K302 A312 | W294-W307 HydrophobicContact CH2-CH2 4.22Å; W294-W307 AromaticContact CH2-CZ3 3.64Å; W294-W307 HydrophobicContact CH2-CZ3 3.64Å; W294-W307 AromaticContact CZ2-CH2 3.75Å; W294-W307 HydrophobicContact CZ2-CH2 3.75Å; W294-W307 AromaticContact CZ2-CZ3 3.56Å; W294-W307 HydrophobicContact CZ2-CZ3 3.56Å; E298-W307 HydrophobicContact CB-CZ3 4.31Å; E298-W307 HydrophobicContact CG-CE3 4.39Å; E298-W307 HydrophobicContact CG-CH2 4.18Å; E298-W307 HydrophobicContact CG-CZ3 3.65Å; E298-W307 WeakPolarHBondContact OE1-CH2 3.48Å; K302-W307 HydrophobicContact CD-CD2 4.31Å; K302-W307 HydrophobicContact CD-CE3 4.22Å; K302-W307 VanDerWaalsContact CE-CD2 3.44Å; K302-W307 HydrophobicContact CG-CB 3.87Å; K302-W307 HydrophobicContact CG-CD2 3.8Å; K302-W307 HydrophobicContact CG-CE3 3.71Å; K302-W307 HydrophobicContact CG-CG 3.87Å; K302-W307 HydrophobicContact CG-CZ3 4.48Å; W307-A312 HydrophobicContact CH2-CB 3.55Å; W307-A312 HydrophobicContact CZ2-CB 4.07Å; W307-A312 HydrophobicContact CZ3-CB 3.89Å | ||
| 308 | S | 94.7 | Very high | 95 | Very high | 40 Ų | 40 | 51.3 Ų | 51.3 | 28% | 0.28 | 29% | 0.285 | S | S | . | . | trans | -144.5 | 162 | 165 | 76.9 | 0 | 0 | 0 | 0 | 111 | L306 D310 L311 A312 | L306-S308 PolarHBondContact O-N 3.3Å; S308-D310 VanDerWaalsContact C-N 3.34Å; S308-L311 PolarHBondContact O-N 3.48Å; S308-L311 VanDerWaalsContact OG-CB 3.22Å; S308-L311 WeakPolarHBondContact OG-CB 3.15Å; S308-L311 PolarHBondContact OG-N 3.32Å; S308-A312 PolarHBondContact O-N 2.86Å; S308-A312 VanDerWaalsContact O-N 3.09Å | ||
| 309 | A | 95.7 | Very high | 95.1 | Very high | 70 Ų | 70 | 49.3 Ų | 49.3 | 58% | 0.579 | 28% | 0.275 | S | S | * | . | H | α-helix | trans | -62.8 | -42.9 | 176 | 0 | 0 | 0 | 0 | 0 | 111.4 | L311 A312 V313 | A309-L311 VanDerWaalsContact C-N 3.34Å; A309-L311 PolarHBondContact O-N 3.01Å; A309-A312 PolarHBondContact O-N 2.91Å; A309-V313 WeakPolarHBondContact O-CG2 3.45Å; A309-V313 PolarHBondContact O-N 3.37Å |
| 310 | D | 95.6 | Very high | 95.2 | Very high | 108 Ų | 108 | 50.2 Ų | 50.2 | 58% | 0.578 | 28% | 0.278 | S | S | * | . | H | α-helix | trans | -64.9 | -39.2 | 179.3 | -59.7 | -31 | 0 | 0 | 0 | 111.8 | S308 A312 V313 T314 | S308-D310 VanDerWaalsContact C-N 3.34Å; D310-A312 VanDerWaalsContact C-N 3.34Å; D310-A312 PolarHBondContact O-N 3Å; D310-V313 PolarHBondContact O-N 3.24Å; D310-T314 WeakPolarHBondContact O-CB 3.31Å; D310-T314 PolarHBondContact O-N 3.43Å; D310-T314 PolarHBondContact O-OG1 3.32Å |
| 311 | L | 96.9 | Very high | 95.4 | Very high | 4 Ų | 4 | 49.9 Ų | 49.9 | 2% | 0.021 | 28% | 0.276 | C | S | . | . | H | α-helix | trans | -62.6 | -43.7 | 174.7 | -179.3 | 62.9 | 0 | 0 | 0 | 111 | L190 S194 L301 L306 S308 A309 T314 W315 | L190-L311 HydrophobicContact CB-CD1 4.24Å; S194-L311 WeakPolarHBondContact OG-CD1 3.44Å; L301-L311 HydrophobicContact CD1-CD2 4.08Å; L301-L311 HydrophobicContact CD1-CG 4.48Å; L306-L311 HydrophobicContact CB-CD2 4.42Å; L306-L311 WeakPolarHBondContact O-CD2 3.39Å; S308-L311 PolarHBondContact O-N 3.48Å; S308-L311 VanDerWaalsContact OG-CB 3.22Å; S308-L311 WeakPolarHBondContact OG-CB 3.15Å; S308-L311 PolarHBondContact OG-N 3.32Å; A309-L311 VanDerWaalsContact C-N 3.34Å; A309-L311 PolarHBondContact O-N 3.01Å; L311-T314 PolarHBondContact O-N 3.19Å; L311-W315 VanDerWaalsContact CD1-CD1 3.46Å; L311-W315 WeakPolarHBondContact O-CB 3.47Å; L311-W315 PolarHBondContact O-N 3.04Å |
| 312 | A | 97.2 | Very high | 95.5 | Very high | 8 Ų | 8 | 50.5 Ų | 50.5 | 7% | 0.066 | 28% | 0.279 | C | S | . | . | H | α-helix | trans | -64.1 | -41.8 | 179 | 0 | 0 | 0 | 0 | 0 | 112.4 | W294 W307 S308 A309 D310 K316 | W294-A312 HydrophobicContact CH2-CB 3.76Å; W294-A312 HydrophobicContact CZ2-CB 3.85Å; W307-A312 HydrophobicContact CH2-CB 3.55Å; W307-A312 HydrophobicContact CZ2-CB 4.07Å; W307-A312 HydrophobicContact CZ3-CB 3.89Å; S308-A312 PolarHBondContact O-N 2.86Å; S308-A312 VanDerWaalsContact O-N 3.09Å; A309-A312 PolarHBondContact O-N 2.91Å; D310-A312 VanDerWaalsContact C-N 3.34Å; D310-A312 PolarHBondContact O-N 3Å; A312-K316 WeakPolarHBondContact O-CB 3.47Å; A312-K316 VanDerWaalsContact O-CG 3.25Å; A312-K316 WeakPolarHBondContact O-CG 3.21Å; A312-K316 PolarHBondContact O-N 2.92Å |
| 313 | V | 97 | Very high | 95.6 | Very high | 85 Ų | 85 | 46.1 Ų | 46.1 | 52% | 0.515 | 26% | 0.261 | S | S | . | . | H | α-helix | trans | -62.4 | -48.2 | 174.3 | 172.7 | 0 | 0 | 0 | 0 | 110.3 | A309 D310 W315 K316 S317 | A309-V313 WeakPolarHBondContact O-CG2 3.45Å; A309-V313 PolarHBondContact O-N 3.37Å; D310-V313 PolarHBondContact O-N 3.24Å; V313-W315 PolarHBondContact O-N 3.22Å; V313-K316 PolarHBondContact O-N 2.87Å; V313-S317 PolarHBondContact O-N 3.5Å; V313-S317 PolarHBondContact O-OG 3.01Å |
| 314 | T | 96.9 | Very high | 95.8 | Very high | 0 Ų | 0 | 43.6 Ų | 43.6 | 0% | 0 | 25% | 0.246 | C | C | . | . | H | α-helix | trans | -59 | -46.8 | -179.3 | -54.9 | 0 | 0 | 0 | 0 | 111.8 | F183 Q187 L191 D310 L311 S317 I318 | F183-T314 HydrophobicContact CD2-CG2 4.2Å; F183-T314 HydrophobicContact CE2-CG2 3.57Å; F183-T314 HydrophobicContact CZ-CG2 3.89Å; Q187-T314 HydrophobicContact CB-CG2 4.1Å; L191-T314 HydrophobicContact CB-CG2 4.14Å; L191-T314 HydrophobicContact CD1-CG2 4.39Å; D310-T314 WeakPolarHBondContact O-CB 3.31Å; D310-T314 PolarHBondContact O-N 3.43Å; D310-T314 PolarHBondContact O-OG1 3.32Å; L311-T314 PolarHBondContact O-N 3.19Å; T314-S317 PolarHBondContact O-N 3.42Å; T314-I318 WeakPolarHBondContact O-CG1 3.33Å; T314-I318 PolarHBondContact O-N 3.41Å |
| 315 | W | 97.7 | Very high | 96.1 | Very high | 0 Ų | 0 | 39.1 Ų | 39.1 | 0% | 0 | 23% | 0.225 | C | C | . | . | H | α-helix | trans | -61.7 | -45.8 | 175.9 | -93.6 | 100.9 | 0 | 0 | 0 | 112.8 | L191 S194 W195 V198 V252 I256 W294 I297 L301 L311 V313 S317 I318 L319 | L191-W315 HydrophobicContact CD1-CD2 3.78Å; L191-W315 HydrophobicContact CD1-CE3 4.15Å; L191-W315 HydrophobicContact CD1-CG 4.16Å; L191-W315 HydrophobicContact CD1-CH2 4.2Å; L191-W315 HydrophobicContact CD1-CZ2 3.9Å; L191-W315 HydrophobicContact CD1-CZ3 4.35Å; S194-W315 PolarHBondContact OG-NE1 3.37Å; W195-W315 HydrophobicContact CB-CH2 4.18Å; W195-W315 HydrophobicContact CB-CZ2 4.03Å; W195-W315 HydrophobicContact CD2-CH2 4.11Å; W195-W315 AromaticContact CE3-CH2 3.4Å; W195-W315 HydrophobicContact CE3-CH2 3.4Å; W195-W315 HydrophobicContact CE3-CZ2 4.11Å; W195-W315 HydrophobicContact CE3-CZ3 4.35Å; W195-W315 HydrophobicContact CG-CH2 4.47Å; W195-W315 HydrophobicContact CZ3-CH2 4.05Å; V198-W315 HydrophobicContact CG2-CZ2 4.37Å; V252-W315 HydrophobicContact CG1-CZ3 4.21Å; I256-W315 HydrophobicContact CD1-CH2 3.35Å; I256-W315 HydrophobicContact CD1-CZ2 4.18Å; I256-W315 HydrophobicContact CD1-CZ3 3.81Å; W294-W315 HydrophobicContact CE3-CB 3.91Å; W294-W315 HydrophobicContact CH2-CB 4.28Å; W294-W315 HydrophobicContact CZ3-CB 3.4Å; W294-W315 VanDerWaalsContact CZ3-CB 3.4Å; W294-W315 AromaticContact CZ3-CG 3.89Å; W294-W315 HydrophobicContact CZ3-CG 3.89Å; I297-W315 HydrophobicContact CD1-CE3 4.17Å; I297-W315 HydrophobicContact CD1-CZ3 3.95Å; I297-W315 HydrophobicContact CG2-CD2 4.34Å; I297-W315 HydrophobicContact CG2-CE3 4.49Å; L301-W315 HydrophobicContact CD1-CG 4.47Å; L311-W315 VanDerWaalsContact CD1-CD1 3.46Å; L311-W315 WeakPolarHBondContact O-CB 3.47Å; L311-W315 PolarHBondContact O-N 3.04Å; V313-W315 PolarHBondContact O-N 3.22Å; W315-S317 VanDerWaalsContact C-N 3.33Å; W315-S317 PolarHBondContact O-N 3.32Å; W315-I318 PolarHBondContact O-N 3.42Å; W315-L319 HydrophobicContact CE3-CG 4.46Å; W315-L319 WeakPolarHBondContact O-CG 3.39Å; W315-L319 PolarHBondContact O-N 2.98Å |
| 316 | K | 97.5 | Very high | 96.3 | Very high | 110 Ų | 110 | 36.7 Ų | 36.7 | 48% | 0.478 | 20% | 0.197 | S | C | . | . | H | α-helix | trans | -61.5 | -42.5 | 179.4 | -75.6 | 175.9 | -179.6 | -176 | 0 | 111.5 | W294 A312 V313 I318 L319 D320 | W294-K316 HydrophobicContact CD2-CG 4.14Å; W294-K316 VanDerWaalsContact CE2-CE 3.47Å; W294-K316 HydrophobicContact CE3-CG 4.48Å; W294-K316 HydrophobicContact CG-CG 4.4Å; A312-K316 WeakPolarHBondContact O-CB 3.47Å; A312-K316 VanDerWaalsContact O-CG 3.25Å; A312-K316 WeakPolarHBondContact O-CG 3.21Å; A312-K316 PolarHBondContact O-N 2.92Å; V313-K316 PolarHBondContact O-N 2.87Å; K316-I318 VanDerWaalsContact C-N 3.3Å; K316-I318 PolarHBondContact O-N 2.58Å; K316-L319 PolarHBondContact O-N 3.31Å; K316-D320 WeakPolarHBondContact O-CB 3.37Å; K316-D320 PolarHBondContact O-N 2.98Å |
| 317 | S | 97.1 | Very high | 96.6 | Very high | 24 Ų | 24 | 35 Ų | 35 | 17% | 0.168 | 19% | 0.187 | C | C | . | . | H | α-helix | trans | -60 | -37.3 | 175.9 | -68.2 | 0 | 0 | 0 | 0 | 112.9 | V313 T314 W315 Y321 | V313-S317 PolarHBondContact O-N 3.5Å; V313-S317 PolarHBondContact O-OG 3.01Å; T314-S317 PolarHBondContact O-N 3.42Å; W315-S317 VanDerWaalsContact C-N 3.33Å; W315-S317 PolarHBondContact O-N 3.32Å; S317-Y321 WeakPolarHBondContact O-CB 3.11Å; S317-Y321 PolarHBondContact O-N 3.24Å |
| 318 | I | 96.9 | Very high | 96.9 | Very high | 0 Ų | 0 | 31.2 Ų | 31.2 | 0% | 0 | 17% | 0.173 | C | C | . | . | H | α-helix | trans | -68.8 | -45.5 | 176 | -68.9 | -74.5 | 0 | 0 | 0 | 112 | V180 F183 L191 L255 I256 L259 T314 W315 K316 D320 Y321 L322 | V180-I318 HydrophobicContact CB-CD1 4.41Å; V180-I318 HydrophobicContact CG1-CD1 3.94Å; F183-I318 HydrophobicContact CD2-CD1 4.42Å; F183-I318 HydrophobicContact CE2-CD1 3.59Å; F183-I318 HydrophobicContact CE2-CG1 3.64Å; F183-I318 HydrophobicContact CZ-CD1 4.2Å; F183-I318 HydrophobicContact CZ-CG1 4.03Å; L191-I318 HydrophobicContact CD1-CG1 4.12Å; L191-I318 HydrophobicContact CD2-CD1 3.67Å; L191-I318 HydrophobicContact CD2-CG1 3.58Å; L255-I318 HydrophobicContact CD2-CG2 3.72Å; L255-I318 HydrophobicContact CG-CG2 4.21Å; I256-I318 HydrophobicContact CG1-CG2 4.39Å; L259-I318 HydrophobicContact CD1-CD1 3.12Å; T314-I318 WeakPolarHBondContact O-CG1 3.33Å; T314-I318 PolarHBondContact O-N 3.41Å; W315-I318 PolarHBondContact O-N 3.42Å; K316-I318 VanDerWaalsContact C-N 3.3Å; K316-I318 PolarHBondContact O-N 2.58Å; I318-D320 VanDerWaalsContact C-N 3.3Å; I318-Y321 PolarHBondContact O-N 2.91Å; I318-L322 WeakPolarHBondContact O-CB 3.49Å; I318-L322 PolarHBondContact O-N 3Å |
| 319 | L | 97.7 | Very high | 97 | Very high | 2 Ų | 2 | 29.3 Ų | 29.3 | 1% | 0.01 | 16% | 0.16 | C | C | . | . | H | α-helix | trans | -67.2 | -35.4 | 178.9 | -64.8 | 177.6 | 0 | 0 | 0 | 111.4 | L293 W294 I297 W315 K316 L322 T323 | L293-L319 HydrophobicContact CB-CD1 4.07Å; L293-L319 HydrophobicContact CB-CD2 3.96Å; L293-L319 HydrophobicContact CD1-CD2 3.84Å; W294-L319 HydrophobicContact CB-CD1 3.81Å; W294-L319 HydrophobicContact CE3-CD1 4.33Å; I297-L319 HydrophobicContact CD1-CD1 4.45Å; W315-L319 HydrophobicContact CE3-CG 4.46Å; W315-L319 WeakPolarHBondContact O-CG 3.39Å; W315-L319 PolarHBondContact O-N 2.98Å; K316-L319 PolarHBondContact O-N 3.31Å; L319-L322 WeakPolarHBondContact O-CB 3.4Å; L319-L322 PolarHBondContact O-N 3.29Å; L319-T323 PolarHBondContact O-N 3.48Å; L319-T323 PolarHBondContact O-OG1 3.02Å; L319-T323 VanDerWaalsContact O-OG1 3.13Å |
| 320 | D | 97.3 | Very high | 97 | Very high | 48 Ų | 48 | 26 Ų | 26 | 26% | 0.257 | 13% | 0.132 | S | C | . | . | H | α-helix | trans | -67.3 | -45.2 | 174.9 | -172.4 | 67.1 | 0 | 0 | 0 | 111.4 | K316 I318 L322 T323 R324 | K316-D320 WeakPolarHBondContact O-CB 3.37Å; K316-D320 PolarHBondContact O-N 2.98Å; I318-D320 VanDerWaalsContact C-N 3.3Å; D320-L322 VanDerWaalsContact C-N 3.34Å; D320-L322 PolarHBondContact O-N 3.5Å; D320-T323 PolarHBondContact O-N 3.49Å; D320-T323 PolarHBondContact O-OG1 3.34Å; D320-R324 VanDerWaalsContact O-CB 3.28Å; D320-R324 WeakPolarHBondContact O-CB 3.12Å; D320-R324 VanDerWaalsContact O-CG 3.24Å; D320-R324 WeakPolarHBondContact O-CG 3.48Å; D320-R324 PolarHBondContact O-N 2.78Å; D320-R324 IonicContact OD1-CZ 3.14Å; D320-R324 VanDerWaalsContact OD1-CZ 3.27Å; D320-R324 IonicContact OD1-NE 3.33Å; D320-R324 PolarHBondContact OD1-NE 3.28Å; D320-R324 IonicContact OD1-NH2 2.75Å; D320-R324 PolarHBondContact OD1-NH2 3.31Å; D320-R324 IonicContact OD2-CZ 2.68Å; D320-R324 IonicContact OD2-NE 3.72Å; D320-R324 PolarHBondContact OD2-NE 3.38Å; D320-R324 IonicContact OD2-NH2 2.95Å; D320-R324 PolarHBondContact OD2-NH2 3.26Å |
| 321 | Y | 97.3 | Very high | 97 | Very high | 0 Ų | 0 | 20.9 Ų | 20.9 | 0% | 0 | 11% | 0.105 | C | C | . | . | H | α-helix | trans | -59.5 | -44 | 171.9 | 172.8 | -113.7 | 0 | 0 | 0 | 112.3 | A176 L177 V180 L255 E266 L269 S317 I318 T325 | A176-Y321 HydrophobicContact CB-CD2 4.27Å; L177-Y321 HydrophobicContact CB-CD2 4.18Å; L177-Y321 HydrophobicContact CB-CE2 3.78Å; L177-Y321 HydrophobicContact CD1-CE2 3.6Å; L177-Y321 HydrophobicContact CG-CE2 4.26Å; V180-Y321 HydrophobicContact CG1-CD1 4.29Å; V180-Y321 HydrophobicContact CG1-CG 4Å; V180-Y321 HydrophobicContact CG2-CD1 3.84Å; V180-Y321 HydrophobicContact CG2-CD2 4.02Å; V180-Y321 HydrophobicContact CG2-CE1 4.17Å; V180-Y321 HydrophobicContact CG2-CE2 4.35Å; V180-Y321 HydrophobicContact CG2-CG 3.75Å; L255-Y321 HydrophobicContact CD1-CD1 3.71Å; L255-Y321 HydrophobicContact CD1-CE1 3.54Å; L255-Y321 HydrophobicContact CD2-CD1 4.03Å; L255-Y321 HydrophobicContact CG-CD1 4.5Å; E266-Y321 WeakPolarHBondContact CB-OH 3.35Å; L269-Y321 HydrophobicContact CD1-CD1 4.43Å; L269-Y321 HydrophobicContact CD1-CE1 3.92Å; S317-Y321 WeakPolarHBondContact O-CB 3.11Å; S317-Y321 PolarHBondContact O-N 3.24Å; I318-Y321 PolarHBondContact O-N 2.91Å; Y321-T325 WeakPolarHBondContact CD2-OG1 3.42Å; Y321-T325 WeakPolarHBondContact CE2-OG1 3.47Å; Y321-T325 WeakPolarHBondContact O-CB 3.42Å; Y321-T325 PolarHBondContact O-N 3.22Å; Y321-T325 PolarHBondContact O-OG1 3.2Å |
| 322 | L | 97.4 | Very high | 96.9 | Very high | 13 Ų | 13 | 25.3 Ų | 25.3 | 7% | 0.068 | 12% | 0.124 | C | C | . | . | H | α-helix | trans | -55.2 | -55.2 | 175.5 | 170.5 | 65.3 | 0 | 0 | 0 | 111.5 | V251 V252 L255 L269 L293 I318 L319 D320 V326 | V251-L322 HydrophobicContact CG1-CD1 3.95Å; V252-L322 HydrophobicContact CG2-CD2 3.87Å; L255-L322 HydrophobicContact CD2-CB 4.07Å; L269-L322 HydrophobicContact CD1-CD1 4.25Å; L269-L322 HydrophobicContact CD2-CD1 3.39Å; L269-L322 HydrophobicContact CG-CD1 4.45Å; L293-L322 HydrophobicContact CD1-CD2 4.05Å; I318-L322 WeakPolarHBondContact O-CB 3.49Å; I318-L322 PolarHBondContact O-N 3Å; L319-L322 WeakPolarHBondContact O-CB 3.4Å; L319-L322 PolarHBondContact O-N 3.29Å; D320-L322 VanDerWaalsContact C-N 3.34Å; D320-L322 PolarHBondContact O-N 3.5Å; L322-V326 HydrophobicContact CD1-CG2 4.47Å; L322-V326 VanDerWaalsContact O-CG2 3.31Å; L322-V326 WeakPolarHBondContact O-CG2 3.43Å; L322-V326 PolarHBondContact O-N 2.8Å; L322-V326 VanDerWaalsContact O-N 3.17Å |
| 323 | T | 97.3 | Very high | 96.7 | Very high | 6 Ų | 6 | 26.4 Ų | 26.4 | 4% | 0.037 | 13% | 0.13 | C | C | . | . | H | α-helix | trans | -71.9 | -38.8 | -174.5 | 53.5 | 0 | 0 | 0 | 0 | 112.2 | V286 V289 L319 D320 V326 K327 | V286-T323 WeakPolarHBondContact CG1-O 3.04Å; V286-T323 WeakPolarHBondContact O-CG2 3.07Å; V289-T323 HydrophobicContact CB-CG2 4.01Å; V289-T323 HydrophobicContact CG1-CG2 4.5Å; L319-T323 PolarHBondContact O-N 3.48Å; L319-T323 PolarHBondContact O-OG1 3.02Å; L319-T323 VanDerWaalsContact O-OG1 3.13Å; D320-T323 PolarHBondContact O-N 3.49Å; D320-T323 PolarHBondContact O-OG1 3.34Å; T323-V326 PolarHBondContact O-N 2.88Å; T323-K327 WeakPolarHBondContact O-CB 2.97Å; T323-K327 PolarHBondContact O-N 2.92Å |
| 324 | R | 97.6 | Very high | 96.4 | Very high | 72 Ų | 72 | 23.7 Ų | 23.7 | 27% | 0.272 | 11% | 0.111 | S | C | . | . | H | α-helix | trans | -66 | -38.3 | 176.8 | -69.1 | -178.8 | -165.6 | -104.9 | -2.1 | 112.9 | E172 A176 D320 K327 Y328 | E172-R324 VanDerWaalsContact CB-NH1 3.32Å; E172-R324 VanDerWaalsContact O-CD 3.22Å; E172-R324 WeakPolarHBondContact O-CD 3.31Å; E172-R324 IonicContact OE2-NH1 3.23Å; A176-R324 HydrophobicContact CB-CB 4.5Å; D320-R324 VanDerWaalsContact O-CB 3.28Å; D320-R324 WeakPolarHBondContact O-CB 3.12Å; D320-R324 VanDerWaalsContact O-CG 3.24Å; D320-R324 WeakPolarHBondContact O-CG 3.48Å; D320-R324 PolarHBondContact O-N 2.78Å; D320-R324 IonicContact OD1-CZ 3.14Å; D320-R324 VanDerWaalsContact OD1-CZ 3.27Å; D320-R324 IonicContact OD1-NE 3.33Å; D320-R324 PolarHBondContact OD1-NE 3.28Å; D320-R324 IonicContact OD1-NH2 2.75Å; D320-R324 PolarHBondContact OD1-NH2 3.31Å; D320-R324 IonicContact OD2-CZ 2.68Å; D320-R324 IonicContact OD2-NE 3.72Å; D320-R324 PolarHBondContact OD2-NE 3.38Å; D320-R324 IonicContact OD2-NH2 2.95Å; D320-R324 PolarHBondContact OD2-NH2 3.26Å; R324-K327 PolarHBondContact O-N 3.05Å; R324-Y328 WeakPolarHBondContact O-CB 3.5Å; R324-Y328 PolarHBondContact O-N 2.93Å |
| 325 | T | 97.5 | Very high | 96 | Very high | 0 Ų | 0 | 26.9 Ų | 26.9 | 0% | 0 | 13% | 0.126 | C | C | . | . | H | α-helix | trans | -65.8 | -44.7 | 175.5 | -51.3 | 0 | 0 | 0 | 0 | 111.4 | H173 E266 L269 M270 Y321 K327 Y328 G329 | H173-T325 VanDerWaalsContact CE1-CG2 3.5Å; H173-T325 WeakPolarHBondContact CE1-CG2 3.37Å; H173-T325 PolarHBondContact CE1-OG1 3.41Å; H173-T325 VanDerWaalsContact CE1-OG1 3.28Å; H173-T325 VanDerWaalsContact ND1-CA 3.3Å; H173-T325 WeakPolarHBondContact ND1-CA 3.12Å; H173-T325 PolarHBondContact ND1-OG1 3.46Å; H173-T325 VanDerWaalsContact ND1-OG1 3.12Å; E266-T325 HydrophobicContact CG-CG2 4.16Å; L269-T325 HydrophobicContact CB-CG2 3.38Å; L269-T325 HydrophobicContact CD1-CG2 4.13Å; L269-T325 HydrophobicContact CG-CG2 4.4Å; M270-T325 HydrophobicContact CG-CG2 3.88Å; M270-T325 HydrophobicContact SD-CG2 3.88Å; M270-T325 VanDerWaalsContact SD-O 3.39Å; Y321-T325 WeakPolarHBondContact CD2-OG1 3.42Å; Y321-T325 WeakPolarHBondContact CE2-OG1 3.47Å; Y321-T325 WeakPolarHBondContact O-CB 3.42Å; Y321-T325 PolarHBondContact O-N 3.22Å; Y321-T325 PolarHBondContact O-OG1 3.2Å; T325-K327 VanDerWaalsContact C-N 3.34Å; T325-K327 PolarHBondContact O-N 3.16Å; T325-Y328 PolarHBondContact O-N 3.4Å; T325-G329 PolarHBondContact O-N 3.32Å |
| 326 | V | 96.9 | Very high | 95.5 | Very high | 16 Ų | 16 | 31.2 Ų | 31.2 | 10% | 0.097 | 16% | 0.157 | C | C | . | . | H | α-helix | trans | -63.1 | -42.1 | 175.9 | 172.4 | 0 | 0 | 0 | 0 | 110.8 | L269 I272 G273 V286 L322 T323 G329 L330 | L269-V326 HydrophobicContact CB-CG2 4.49Å; L269-V326 HydrophobicContact CD2-CG2 4.35Å; I272-V326 HydrophobicContact CG2-CG1 4.42Å; I272-V326 HydrophobicContact CG2-CG2 4.11Å; G273-V326 WeakPolarHBondContact CA-O 3.04Å; V286-V326 HydrophobicContact CG1-CB 4.1Å; V286-V326 HydrophobicContact CG1-CG1 3.8Å; L322-V326 HydrophobicContact CD1-CG2 4.47Å; L322-V326 VanDerWaalsContact O-CG2 3.31Å; L322-V326 WeakPolarHBondContact O-CG2 3.43Å; L322-V326 PolarHBondContact O-N 2.8Å; L322-V326 VanDerWaalsContact O-N 3.17Å; T323-V326 PolarHBondContact O-N 2.88Å; V326-G329 PolarHBondContact O-N 3.23Å; V326-L330 WeakPolarHBondContact O-CB 3.38Å; V326-L330 PolarHBondContact O-N 3.1Å |
| 327 | K | 96.4 | Very high | 94.9 | Very high | 28 Ų | 28 | 30 Ų | 30 | 12% | 0.122 | 16% | 0.159 | C | C | . | . | H | α-helix | trans | -61.5 | -44.9 | 176.8 | -173.6 | -175.3 | 173.9 | -167.1 | 0 | 111.5 | I169 E172 I283 V286 T323 R324 T325 L330 A331 | I169-K327 HydrophobicContact CG2-CD 4.35Å; I169-K327 HydrophobicContact CG2-CG 4.07Å; E172-K327 IonicContact OE2-NZ 2.92Å; E172-K327 PolarHBondContact OE2-NZ 3.16Å; I283-K327 HydrophobicContact CD1-CG 3.78Å; I283-K327 HydrophobicContact CG1-CD 4.5Å; I283-K327 HydrophobicContact CG1-CG 3.62Å; V286-K327 HydrophobicContact CB-CB 4.34Å; V286-K327 HydrophobicContact CG1-CB 4.01Å; T323-K327 WeakPolarHBondContact O-CB 2.97Å; T323-K327 PolarHBondContact O-N 2.92Å; R324-K327 PolarHBondContact O-N 3.05Å; T325-K327 VanDerWaalsContact C-N 3.34Å; T325-K327 PolarHBondContact O-N 3.16Å; K327-L330 PolarHBondContact O-N 3.3Å; K327-A331 WeakPolarHBondContact O-CB 3.29Å; K327-A331 PolarHBondContact O-N 3.3Å |
| 328 | Y | 97.2 | Very high | 93.9 | Very high | 21 Ų | 21 | 34.5 Ų | 34.5 | 8% | 0.082 | 18% | 0.176 | C | C | . | . | H | α-helix | trans | -66.1 | -44.1 | 176.2 | 178.6 | -128 | 0 | 0 | 0 | 112.1 | I166 I169 Q170 H173 M270 R324 T325 L330 A331 K332 | I166-Y328 HydrophobicContact CD1-CE2 4.19Å; I169-Y328 HydrophobicContact CG2-CD2 4.31Å; Q170-Y328 HydrophobicContact CB-CD2 3.98Å; Q170-Y328 HydrophobicContact CB-CE2 3.51Å; Q170-Y328 HydrophobicContact CG-CE1 4.35Å; Q170-Y328 HydrophobicContact CG-CE2 3.81Å; Q170-Y328 PolarHBondContact OE1-OH 3.16Å; Q170-Y328 VanDerWaalsContact OE1-OH 3.14Å; H173-Y328 HydrophobicContact CB-CD1 4.19Å; H173-Y328 HydrophobicContact CB-CG 4.12Å; H173-Y328 AromaticContact CD2-CD1 3.59Å; H173-Y328 AromaticContact CG-CD1 3.8Å; M270-Y328 HydrophobicContact CE-CD1 3.32Å; M270-Y328 HydrophobicContact CE-CE1 3.47Å; M270-Y328 VanDerWaalsContact CE-CE1 3.47Å; M270-Y328 HydrophobicContact CE-CG 4.11Å; M270-Y328 HydrophobicContact SD-CD1 3.49Å; M270-Y328 WeakPolarHBondContact SD-CD1 3.22Å; M270-Y328 HydrophobicContact SD-CE1 4.18Å; M270-Y328 HydrophobicContact SD-CG 4.24Å; R324-Y328 WeakPolarHBondContact O-CB 3.5Å; R324-Y328 PolarHBondContact O-N 2.93Å; T325-Y328 PolarHBondContact O-N 3.4Å; Y328-L330 VanDerWaalsContact C-N 3.28Å; Y328-L330 PolarHBondContact O-N 3.06Å; Y328-A331 PolarHBondContact O-N 2.79Å; Y328-K332 HydrophobicContact CE1-CD 4.4Å; Y328-K332 HydrophobicContact CE2-CB 4.37Å; Y328-K332 VanDerWaalsContact O-CB 3.23Å; Y328-K332 WeakPolarHBondContact O-CB 3.4Å; Y328-K332 PolarHBondContact O-N 3.3Å |
| 329 | G | 96.6 | Very high | 92.5 | Very high | 1 Ų | 1 | 40.6 Ų | 40.6 | 1% | 0.01 | 20% | 0.203 | C | C | . | . | H | α-helix | trans | -58.5 | -39 | 174.6 | 0 | 0 | 0 | 0 | 0 | 113.2 | M270 T325 V326 T333 | M270-G329 VanDerWaalsContact SD-CA 3.55Å; M270-G329 PolarHBondContact SD-N 3.05Å; M270-G329 VanDerWaalsContact SD-N 3.4Å; T325-G329 PolarHBondContact O-N 3.32Å; V326-G329 PolarHBondContact O-N 3.23Å; G329-T333 WeakPolarHBondContact O-CB 3.26Å; G329-T333 PolarHBondContact O-N 3.41Å; G329-T333 VanDerWaalsContact O-N 3.13Å; G329-T333 PolarHBondContact O-OG1 3.49Å |
| 330 | L | 94.9 | Very high | 92.2 | Very high | 0 Ų | 0 | 42.5 Ų | 42.5 | 0% | 0 | 21% | 0.213 | C | C | . | . | H | α-helix | trans | -63.9 | -54.3 | 172.9 | -174.2 | 151.9 | 0 | 0 | 0 | 111 | T159 V162 G273 H276 C277 V280 I283 V286 V326 K327 Y328 K332 T333 F334 | T159-L330 HydrophobicContact CG2-CD1 4.2Å; T159-L330 HydrophobicContact CG2-CD2 3.81Å; T159-L330 HydrophobicContact CG2-CG 4.46Å; V162-L330 HydrophobicContact CG2-CD2 3.98Å; G273-L330 WeakPolarHBondContact O-CA 3.29Å; G273-L330 WeakPolarHBondContact O-CB 2.97Å; H276-L330 HydrophobicContact CB-CD1 4.15Å; C277-L330 HydrophobicContact CB-CG 4.1Å; V280-L330 HydrophobicContact CB-CD1 4.09Å; V280-L330 HydrophobicContact CG1-CD1 4.49Å; V280-L330 HydrophobicContact CG2-CD1 4.35Å; I283-L330 HydrophobicContact CB-CD2 4.28Å; I283-L330 HydrophobicContact CD1-CD2 3.87Å; I283-L330 HydrophobicContact CG1-CD2 4.03Å; V286-L330 HydrophobicContact CG2-CD1 4.28Å; V326-L330 WeakPolarHBondContact O-CB 3.38Å; V326-L330 PolarHBondContact O-N 3.1Å; K327-L330 PolarHBondContact O-N 3.3Å; Y328-L330 VanDerWaalsContact C-N 3.28Å; Y328-L330 PolarHBondContact O-N 3.06Å; L330-K332 PolarHBondContact O-N 3.34Å; L330-T333 PolarHBondContact O-N 3.21Å; L330-F334 WeakPolarHBondContact O-CB 3.31Å; L330-F334 PolarHBondContact O-N 3.44Å |
| 331 | A | 95.1 | Very high | 92 | Very high | 0 Ų | 0 | 42.2 Ų | 42.2 | 0% | 0 | 21% | 0.21 | C | C | . | . | H | α-helix | trans | -60.3 | -45.1 | -176.5 | 0 | 0 | 0 | 0 | 0 | 111.8 | V162 I166 I169 I283 K327 Y328 T333 F334 H335 | V162-A331 HydrophobicContact CG1-CB 4.08Å; I166-A331 HydrophobicContact CB-CB 4.38Å; I166-A331 HydrophobicContact CG2-CB 3.98Å; I169-A331 HydrophobicContact CD1-CB 3.92Å; I169-A331 HydrophobicContact CG2-CB 4.3Å; I283-A331 HydrophobicContact CD1-CB 3.74Å; K327-A331 WeakPolarHBondContact O-CB 3.29Å; K327-A331 PolarHBondContact O-N 3.3Å; Y328-A331 PolarHBondContact O-N 2.79Å; A331-T333 PolarHBondContact O-N 3.21Å; A331-F334 PolarHBondContact O-N 3.39Å; A331-H335 WeakPolarHBondContact O-CB 3.4Å; A331-H335 PolarHBondContact O-N 3.16Å |
| 332 | K | 94.9 | Very high | 91.7 | Very high | 98 Ų | 98 | 44.6 Ų | 44.6 | 43% | 0.426 | 22% | 0.222 | S | C | . | . | H | α-helix | trans | -61.7 | -42.1 | 177.6 | -175.6 | 175.1 | -176.3 | 168.7 | 0 | 112.1 | I166 M270 Y328 L330 S336 | I166-K332 HydrophobicContact CD1-CB 4.24Å; M270-K332 HydrophobicContact CE-CD 3.88Å; Y328-K332 HydrophobicContact CE1-CD 4.4Å; Y328-K332 HydrophobicContact CE2-CB 4.37Å; Y328-K332 VanDerWaalsContact O-CB 3.23Å; Y328-K332 WeakPolarHBondContact O-CB 3.4Å; Y328-K332 PolarHBondContact O-N 3.3Å; L330-K332 PolarHBondContact O-N 3.34Å; K332-S336 WeakPolarHBondContact O-CB 3.25Å; K332-S336 PolarHBondContact O-N 3.23Å; K332-S336 VanDerWaalsContact O-N 3.09Å; K332-S336 PolarHBondContact O-OG 3.45Å |
| 333 | T | 93.6 | Very high | 91.3 | Very high | 31 Ų | 31 | 46.4 Ų | 46.4 | 19% | 0.19 | 23% | 0.231 | C | C | . | . | H | α-helix | trans | -66.9 | -48.2 | 176.9 | -59.6 | 0 | 0 | 0 | 0 | 110.7 | S274 C277 G329 L330 A331 H335 S336 T337 | S274-T333 VanDerWaalsContact CA-OG1 3.24Å; S274-T333 WeakPolarHBondContact CA-OG1 3.45Å; S274-T333 WeakPolarHBondContact CB-OG1 3.43Å; S274-T333 VanDerWaalsContact OG-CG2 3.23Å; S274-T333 WeakPolarHBondContact OG-CG2 3.24Å; S274-T333 PolarHBondContact OG-OG1 2.7Å; C277-T333 HydrophobicContact CB-CG2 4.29Å; G329-T333 WeakPolarHBondContact O-CB 3.26Å; G329-T333 PolarHBondContact O-N 3.41Å; G329-T333 VanDerWaalsContact O-N 3.13Å; G329-T333 PolarHBondContact O-OG1 3.49Å; L330-T333 PolarHBondContact O-N 3.21Å; A331-T333 PolarHBondContact O-N 3.21Å; T333-H335 VanDerWaalsContact C-N 3.27Å; T333-H335 PolarHBondContact O-N 3.06Å; T333-S336 PolarHBondContact O-N 3.33Å; T333-S336 VanDerWaalsContact O-N 3.08Å; T333-T337 HydrophobicContact CG2-CG2 4.27Å; T333-T337 WeakPolarHBondContact O-CG2 3.41Å; T333-T337 PolarHBondContact O-N 3.17Å; T333-T337 PolarHBondContact O-OG1 3.01Å; T333-T337 VanDerWaalsContact O-OG1 3.09Å |
| 334 | F | 91 | Very high | 91 | Very high | 27 Ų | 27 | 48.9 Ų | 48.9 | 12% | 0.118 | 24% | 0.243 | C | C | . | . | H | α-helix | trans | -55.8 | -45.2 | 177.8 | -174.9 | -95.5 | 0 | 0 | 0 | 111.4 | T159 V162 L330 A331 S336 T337 H338 | T159-F334 WeakPolarHBondContact OG1-CD2 3.49Å; T159-F334 WeakPolarHBondContact OG1-CE2 3.25Å; V162-F334 HydrophobicContact CB-CD1 3.67Å; V162-F334 HydrophobicContact CB-CE1 3.98Å; V162-F334 HydrophobicContact CB-CG 4.25Å; V162-F334 HydrophobicContact CG1-CB 4.4Å; V162-F334 HydrophobicContact CG1-CD1 3.77Å; V162-F334 HydrophobicContact CG1-CE1 4.47Å; V162-F334 HydrophobicContact CG1-CG 4.36Å; V162-F334 HydrophobicContact CG2-CB 4.41Å; V162-F334 HydrophobicContact CG2-CD1 4.05Å; V162-F334 HydrophobicContact CG2-CG 4.13Å; L330-F334 WeakPolarHBondContact O-CB 3.31Å; L330-F334 PolarHBondContact O-N 3.44Å; A331-F334 PolarHBondContact O-N 3.39Å; F334-S336 VanDerWaalsContact C-N 3.32Å; F334-S336 PolarHBondContact O-N 3.5Å; F334-T337 PolarHBondContact O-N 2.54Å; F334-T337 PolarHBondContact O-OG1 2.91Å; F334-H338 AromaticContact CD2-CD2 3.49Å; F334-H338 VanDerWaalsContact CD2-CD2 3.49Å; F334-H338 WeakPolarHBondContact CD2-CD2 3.34Å; F334-H338 HydrophobicContact CE1-CB 4.39Å; F334-H338 HydrophobicContact CE2-CB 4.32Å; F334-H338 AromaticContact CE2-CD2 3.59Å; F334-H338 HydrophobicContact CZ-CB 4.23Å; F334-H338 WeakPolarHBondContact O-CB 3.26Å; F334-H338 PolarHBondContact O-N 2.81Å |
| 335 | H | 88.4 | Confident | 90.5 | Very high | 67 Ų | 67 | 47.4 Ų | 47.4 | 31% | 0.31 | 24% | 0.241 | S | C | . | . | H | α-helix | trans | -61.9 | -41.2 | 178.2 | -157.7 | -164.4 | 0 | 0 | 0 | 111.7 | D164 I166 A331 T333 T337 K339 | D164-H335 PolarHBondContact O-CE1 3.34Å; D164-H335 VanDerWaalsContact O-CE1 3.26Å; D164-H335 PolarHBondContact O-NE2 2.63Å; I166-H335 HydrophobicContact CD1-CB 4.49Å; A331-H335 WeakPolarHBondContact O-CB 3.4Å; A331-H335 PolarHBondContact O-N 3.16Å; T333-H335 VanDerWaalsContact C-N 3.27Å; T333-H335 PolarHBondContact O-N 3.06Å; H335-T337 PolarHBondContact O-N 3.42Å; H335-K339 PolarHBondContact O-N 2.92Å |
| 336 | S | 87.8 | Confident | 90 | Very high | 92 Ų | 92 | 50.8 Ų | 50.8 | 64% | 0.643 | 26% | 0.259 | S | S | * | . | H | α-helix | trans | -73.1 | -23.9 | -179.8 | -53.2 | 0 | 0 | 0 | 0 | 114.1 | K332 T333 F334 | K332-S336 WeakPolarHBondContact O-CB 3.25Å; K332-S336 PolarHBondContact O-N 3.23Å; K332-S336 VanDerWaalsContact O-N 3.09Å; K332-S336 PolarHBondContact O-OG 3.45Å; T333-S336 PolarHBondContact O-N 3.33Å; T333-S336 VanDerWaalsContact O-N 3.08Å; F334-S336 VanDerWaalsContact C-N 3.32Å; F334-S336 PolarHBondContact O-N 3.5Å |
| 337 | T | 84.7 | Confident | 89.5 | Confident | 85 Ų | 85 | 53.5 Ų | 53.5 | 52% | 0.521 | 27% | 0.271 | S | S | . | . | H | α-helix | trans | -103.3 | -18.9 | -175.8 | 58.9 | 0 | 0 | 0 | 0 | 114.3 | T333 F334 H335 | T333-T337 HydrophobicContact CG2-CG2 4.27Å; T333-T337 WeakPolarHBondContact O-CG2 3.41Å; T333-T337 PolarHBondContact O-N 3.17Å; T333-T337 PolarHBondContact O-OG1 3.01Å; T333-T337 VanDerWaalsContact O-OG1 3.09Å; F334-T337 PolarHBondContact O-N 2.54Å; F334-T337 PolarHBondContact O-OG1 2.91Å; H335-T337 PolarHBondContact O-N 3.42Å |
| 338 | H | 76.2 | Confident | 88.9 | Confident | 117 Ų | 117 | 55.6 Ų | 55.6 | 54% | 0.542 | 28% | 0.283 | S | S | . | . | H | α-helix | trans | -127.1 | -8.5 | -171.1 | -66.6 | -67.3 | 0 | 0 | 0 | 115.9 | F334 | F334-H338 AromaticContact CD2-CD2 3.49Å; F334-H338 VanDerWaalsContact CD2-CD2 3.49Å; F334-H338 WeakPolarHBondContact CD2-CD2 3.34Å; F334-H338 HydrophobicContact CE1-CB 4.39Å; F334-H338 HydrophobicContact CE2-CB 4.32Å; F334-H338 AromaticContact CE2-CD2 3.59Å; F334-H338 HydrophobicContact CZ-CB 4.23Å; F334-H338 WeakPolarHBondContact O-CB 3.26Å; F334-H338 PolarHBondContact O-N 2.81Å |
| 339 | K | 66.7 | Low | 88.2 | Confident | 128 Ų | 128 | 58.7 Ų | 58.7 | 56% | 0.557 | 30% | 0.302 | S | S | * | . | trans | -124.5 | 0 | 175.1 | -51.7 | -165.7 | -168.7 | 164 | 0 | 110.2 | V162 P163 D164 H335 | V162-K339 PolarHBondContact O-NZ 3.16Å; P163-K339 PolarHBondContact O-NZ 3.36Å; D164-K339 WeakPolarHBondContact OD1-CD 3.36Å; D164-K339 VanDerWaalsContact OD1-CE 3.25Å; D164-K339 WeakPolarHBondContact OD1-CE 3.47Å; D164-K339 IonicContact OD1-NZ 3.42Å; D164-K339 PolarHBondContact OD1-NZ 2.75Å; H335-K339 PolarHBondContact O-N 2.92Å |
Retrieved 339 of 339 residues in 62.3 ms
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