| 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 | 47.5 | Very low | 58.7 | Low | 231 Ų | 231 | 163.3 Ų | 163.3 | 100% | 1.138 | 84% | 0.837 | S | S | * | * | 0 | 109 | 0 | -76.9 | 169.3 | 175.5 | 0 | 0 | 107.3 | Y3 | M1-Y3 PolarHBondContact O-N 2.98Š| |||
| 2 | N | 46 | Very low | 57.7 | Low | 164 Ų | 164 | 165.7 Ų | 165.7 | 88% | 0.877 | 84% | 0.842 | S | S | * | * | trans | -71.1 | 118.4 | 179.8 | -92.5 | -17.9 | 0 | 0 | 0 | 109.6 | ||||
| 3 | Y | 53.3 | Low | 56.5 | Low | 217 Ų | 217 | 161.5 Ų | 161.5 | 85% | 0.851 | 84% | 0.838 | S | S | * | * | trans | -111.5 | 95.5 | 160 | -87.9 | -84.8 | 0 | 0 | 0 | 107.4 | M1 R5 | M1-Y3 PolarHBondContact O-N 2.98Å; Y3-R5 PolarHBondContact O-N 3.14Å | ||
| 4 | S | 54.4 | Low | 55.4 | Low | 104 Ų | 104 | 158.1 Ų | 158.1 | 73% | 0.727 | 85% | 0.845 | S | S | * | * | trans | -64.7 | 117.6 | 164.3 | -61.4 | 0 | 0 | 0 | 0 | 107.9 | ||||
| 5 | R | 64.5 | Low | 54.6 | Low | 240 Ų | 240 | 152.7 Ų | 152.7 | 91% | 0.906 | 83% | 0.831 | S | S | * | * | trans | -88.6 | 103.8 | 169.7 | -77 | -178.8 | 174.9 | 154.9 | -1.8 | 107.6 | Y3 | Y3-R5 PolarHBondContact O-N 3.14Š| ||
| 6 | D | 67.3 | Low | 53.6 | Low | 149 Ų | 149 | 153.2 Ų | 153.2 | 80% | 0.797 | 83% | 0.833 | S | S | * | * | P | Polyproline II helix | trans | -75.2 | 141.9 | 164.9 | -73.3 | -42.8 | 0 | 0 | 0 | 110.1 | ||
| 7 | P | 73.7 | Confident | 52.8 | Low | 113 Ų | 113 | 154.5 Ų | 154.5 | 73% | 0.734 | 84% | 0.836 | S | S | * | * | P | Polyproline II helix | trans | -73.5 | 155 | 178.7 | 29.8 | -33 | 0 | 0 | 0 | 111.9 | ||
| 8 | P | 66.3 | Low | 52.1 | Low | 120 Ų | 120 | 155.9 Ų | 155.9 | 78% | 0.779 | 84% | 0.836 | S | S | * | * | P | Polyproline II helix | trans | -69.4 | 150.8 | 179.4 | 28.8 | -33.4 | 0 | 0 | 0 | 112 | ||
| 9 | P | 68.9 | Low | 51.5 | Low | 119 Ų | 119 | 153.6 Ų | 153.6 | 77% | 0.773 | 83% | 0.833 | S | S | * | * | P | Polyproline II helix | trans | -68.5 | 157 | 179.4 | 27.8 | -33.5 | 0 | 0 | 0 | 112.5 | ||
| 10 | P | 58.3 | Low | 50.9 | Low | 116 Ų | 116 | 149.9 Ų | 149.9 | 75% | 0.753 | 82% | 0.824 | S | S | * | * | P | Polyproline II helix | trans | -71.7 | 152.4 | -180 | -0.9 | 17.5 | 0 | 0 | 0 | 111.5 | E12 | P10-E12 PolarHBondContact O-N 3.42Š|
| 11 | Y | 45.4 | Very low | 50.5 | Low | 223 Ų | 223 | 148.7 Ų | 148.7 | 88% | 0.875 | 82% | 0.824 | S | S | * | * | trans | -68.9 | 114.5 | 174.8 | 54.2 | -83.2 | 0 | 0 | 0 | 110.4 | ||||
| 12 | E | 46.5 | Very low | 50.2 | Low | 192 Ų | 192 | 148 Ų | 148 | 90% | 0.897 | 81% | 0.81 | S | S | * | * | trans | -83.9 | 129.1 | 166.1 | -84.9 | -175 | 159 | 0 | 0 | 110.3 | P10 A14 | P10-E12 PolarHBondContact O-N 3.42Å; E12-A14 PolarHBondContact O-N 2.92Å | ||
| 13 | S | 42.1 | Very low | 50.1 | Low | 112 Ų | 112 | 146.1 Ų | 146.1 | 78% | 0.783 | 81% | 0.807 | S | S | * | * | trans | -64.2 | 116.1 | 175.4 | 50.3 | 0 | 0 | 0 | 0 | 111.7 | A15 | S13-A15 PolarHBondContact O-N 3.5Š| ||
| 14 | A | 41.7 | Very low | 49.6 | Very low | 114 Ų | 114 | 143.4 Ų | 143.4 | 94% | 0.942 | 81% | 0.807 | S | S | * | * | trans | -76.1 | 87.6 | 169.7 | 0 | 0 | 0 | 0 | 0 | 110.6 | E12 | E12-A14 PolarHBondContact O-N 2.92Š| ||
| 15 | A | 42.5 | Very low | 49.1 | Very low | 76 Ų | 76 | 145.1 Ų | 145.1 | 63% | 0.628 | 81% | 0.807 | S | S | * | * | trans | -98.8 | 140.7 | 155.2 | 0 | 0 | 0 | 0 | 0 | 108.4 | S13 | S13-A15 PolarHBondContact O-N 3.5Š| ||
| 16 | N | 39.5 | Very low | 47.7 | Very low | 161 Ų | 161 | 137 Ų | 137 | 86% | 0.861 | 80% | 0.797 | S | S | * | * | trans | 90.7 | 84.6 | 176.7 | -53.8 | -51.4 | 0 | 0 | 0 | 116.7 | ||||
| 17 | I | 39.1 | Very low | 46.6 | Very low | 175 Ų | 175 | 139.4 Ų | 139.4 | 90% | 0.897 | 80% | 0.801 | S | S | * | * | trans | -95.5 | 112.4 | 149.3 | -62.4 | 178.7 | 0 | 0 | 0 | 107.3 | ||||
| 18 | H | 41.4 | Very low | 44.8 | Very low | 180 Ų | 180 | 139 Ų | 139 | 83% | 0.833 | 81% | 0.807 | S | S | * | * | trans | -75 | 113.2 | 177 | -162.8 | 75 | 0 | 0 | 0 | 109.2 | ||||
| 19 | S | 40.7 | Very low | 43.9 | Very low | 112 Ų | 112 | 140.3 Ų | 140.3 | 78% | 0.783 | 81% | 0.813 | S | S | * | * | P | Polyproline II helix | trans | -90.2 | 123 | 169.9 | 52.4 | 0 | 0 | 0 | 0 | 110.1 | ||
| 20 | A | 39.3 | Very low | 42.7 | Very low | 79 Ų | 79 | 137.6 Ų | 137.6 | 65% | 0.653 | 81% | 0.807 | S | S | * | * | P | Polyproline II helix | trans | -60.2 | 151.6 | -175.7 | 0 | 0 | 0 | 0 | 0 | 114.3 | ||
| 21 | P | 42.7 | Very low | 41.8 | Very low | 125 Ų | 125 | 137.8 Ų | 137.8 | 81% | 0.812 | 81% | 0.808 | S | S | * | * | P | Polyproline II helix | trans | -85.6 | 135.6 | 174.8 | 16.2 | -0.7 | 0 | 0 | 0 | 112 | ||
| 22 | Y | 40.2 | Very low | 41.9 | Very low | 218 Ų | 218 | 138.3 Ų | 138.3 | 86% | 0.855 | 81% | 0.81 | S | S | * | * | P | Polyproline II helix | trans | -72.4 | 148.3 | 168.8 | -71.5 | -91 | 0 | 0 | 0 | 111.4 | ||
| 23 | P | 43.5 | Very low | 41.8 | Very low | 124 Ų | 124 | 133.9 Ų | 133.9 | 81% | 0.805 | 80% | 0.8 | S | S | * | * | P | Polyproline II helix | trans | -79.4 | 132.6 | -175.2 | 31.4 | -31.3 | 0 | 0 | 0 | 112.1 | ||
| 24 | N | 43.3 | Very low | 41.9 | Very low | 159 Ų | 159 | 136.9 Ų | 136.9 | 85% | 0.85 | 80% | 0.802 | S | S | * | * | P | Polyproline II helix | trans | -88.8 | 121.6 | 179 | -165.9 | -3.3 | 0 | 0 | 0 | 110.5 | ||
| 25 | I | 43.7 | Very low | 41.8 | Very low | 141 Ų | 141 | 136.5 Ų | 136.5 | 72% | 0.723 | 79% | 0.79 | S | S | * | * | trans | -84.8 | 109.8 | 174.5 | -69.4 | 172.4 | 0 | 0 | 0 | 108.2 | F27 | I25-F27 HydrophobicContact CG2-CE2 4.28Š| ||
| 26 | G | 35.5 | Very low | 41.7 | Very low | 69 Ų | 69 | 137.9 Ų | 137.9 | 71% | 0.711 | 80% | 0.801 | S | S | * | * | trans | -79.7 | 134.8 | 177.1 | 0 | 0 | 0 | 0 | 0 | 112.9 | ||||
| 27 | F | 44.6 | Very low | 41.5 | Very low | 200 Ų | 200 | 133.8 Ų | 133.8 | 88% | 0.877 | 80% | 0.797 | S | S | * | * | trans | -105.3 | 123.8 | 160.2 | -77.3 | -86.3 | 0 | 0 | 0 | 108.9 | I25 | I25-F27 HydrophobicContact CG2-CE2 4.28Š| ||
| 28 | A | 36 | Very low | 41.5 | Very low | 104 Ų | 104 | 136.9 Ų | 136.9 | 86% | 0.86 | 80% | 0.799 | S | S | * | * | trans | -80.6 | 133.1 | -180 | 0 | 0 | 0 | 0 | 0 | 111.5 | ||||
| 29 | V | 47.1 | Very low | 41.2 | Very low | 147 Ų | 147 | 136.5 Ų | 136.5 | 89% | 0.891 | 80% | 0.798 | S | S | * | * | trans | -135.4 | 125.8 | 162.1 | -177.7 | 0 | 0 | 0 | 0 | 107.6 | ||||
| 30 | G | 43.3 | Very low | 41.1 | Very low | 63 Ų | 63 | 138.1 Ų | 138.1 | 65% | 0.649 | 80% | 0.798 | S | S | * | * | trans | -76.1 | 178.2 | -167.7 | 0 | 0 | 0 | 0 | 0 | 116 | ||||
| 31 | P | 40.9 | Very low | 40.9 | Very low | 120 Ų | 120 | 141 Ų | 141 | 78% | 0.779 | 80% | 0.802 | S | S | * | * | trans | -99.5 | 141 | -166.5 | 36.3 | -28.7 | 0 | 0 | 0 | 112.9 | ||||
| 32 | Y | 46.1 | Very low | 40.8 | Very low | 233 Ų | 233 | 140 Ų | 140 | 91% | 0.914 | 80% | 0.798 | S | S | * | * | trans | -132.7 | 122 | 156 | -72.7 | -74.1 | 0 | 0 | 0 | 109.9 | ||||
| 33 | S | 44.8 | Very low | 40.6 | Very low | 100 Ų | 100 | 134.9 Ų | 134.9 | 70% | 0.699 | 79% | 0.794 | S | S | * | * | trans | -53.4 | 157 | 160.7 | 44 | 0 | 0 | 0 | 0 | 111.5 | ||||
| 34 | E | 43.2 | Very low | 40.5 | Very low | 175 Ų | 175 | 136.1 Ų | 136.1 | 82% | 0.818 | 79% | 0.794 | S | S | * | * | cis | 179 | -164.5 | 23.4 | -123.3 | -175.6 | 142.3 | 0 | 0 | 106.1 | ||||
| 35 | P | 41.3 | Very low | 40.1 | Very low | 106 Ų | 106 | 138.4 Ų | 138.4 | 69% | 0.688 | 80% | 0.799 | S | S | * | * | -132.3 | 177.1 | -74.7 | 34.5 | -11.8 | 0 | 0 | 0 | 116 | |||||
| 36 | A | 40.7 | Very low | 39.8 | Very low | 104 Ų | 104 | 139.9 Ų | 139.9 | 86% | 0.86 | 80% | 0.803 | S | S | * | * | trans | 61.7 | 122 | 147.3 | 0 | 0 | 0 | 0 | 0 | 122.8 | ||||
| 37 | G | 35.1 | Very low | 40 | Very low | 76 Ų | 76 | 142.3 Ų | 142.3 | 78% | 0.784 | 81% | 0.807 | S | S | * | * | trans | 162.2 | 115.2 | 150.8 | 0 | 0 | 0 | 0 | 0 | 116.9 | ||||
| 38 | Y | 38.4 | Very low | 39.7 | Very low | 240 Ų | 240 | 143.1 Ų | 143.1 | 94% | 0.941 | 81% | 0.81 | S | S | * | * | trans | 84.4 | 112.8 | 156.1 | -105.9 | -97.8 | 0 | 0 | 0 | 121.5 | ||||
| 39 | Q | 35.1 | Very low | 39.8 | Very low | 171 Ų | 171 | 147 Ų | 147 | 80% | 0.799 | 80% | 0.804 | S | S | * | * | trans | -83.7 | 135.5 | 158.9 | -85.4 | 173.6 | -78 | 0 | 0 | 109.8 | ||||
| 40 | D | 37.5 | Very low | 39.4 | Very low | 146 Ų | 146 | 147.6 Ų | 147.6 | 78% | 0.781 | 80% | 0.802 | S | S | * | * | trans | -139 | 127.5 | 151 | -168.9 | 11.8 | 0 | 0 | 0 | 109 | ||||
| 41 | N | 35.8 | Very low | 39.6 | Very low | 140 Ų | 140 | 154.9 Ų | 154.9 | 75% | 0.749 | 81% | 0.81 | S | S | * | * | trans | -102.6 | 113.9 | -179.4 | -88.6 | -27.7 | 0 | 0 | 0 | 107.3 | ||||
| 42 | S | 41.9 | Very low | 40 | Very low | 103 Ų | 103 | 154.3 Ų | 154.3 | 72% | 0.72 | 80% | 0.8 | S | S | * | * | trans | -148.1 | 109.6 | 160.2 | -76 | 0 | 0 | 0 | 0 | 110 | D44 | S42-D44 PolarHBondContact O-N 3.31Š| ||
| 43 | S | 33.9 | Very low | 40.5 | Very low | 111 Ų | 111 | 144.9 Ų | 144.9 | 78% | 0.776 | 77% | 0.773 | S | S | * | * | trans | -13.8 | 107.3 | 158.3 | 50.3 | 0 | 0 | 0 | 0 | 116.5 | ||||
| 44 | D | 41.8 | Very low | 41.4 | Very low | 151 Ų | 151 | 144.8 Ų | 144.8 | 81% | 0.807 | 77% | 0.765 | S | S | * | * | trans | -164.7 | 112.9 | 132.8 | -91.9 | -31 | 0 | 0 | 0 | 108.7 | S42 E46 | S42-D44 PolarHBondContact O-N 3.31Å; D44-E46 PolarHBondContact O-N 3.11Å | ||
| 45 | Q | 36.1 | Very low | 42.7 | Very low | 206 Ų | 206 | 144 Ų | 144 | 96% | 0.963 | 76% | 0.76 | S | S | * | * | trans | -10.1 | 74.1 | 174 | -153.2 | 154.9 | -0.6 | 0 | 0 | 117.9 | ||||
| 46 | E | 36.2 | Very low | 44.1 | Very low | 172 Ų | 172 | 142.6 Ų | 142.6 | 80% | 0.804 | 75% | 0.749 | S | S | * | * | trans | -79.8 | 147.8 | 174.4 | -80 | -170.4 | 130.6 | 0 | 0 | 112.6 | D44 K48 | D44-E46 PolarHBondContact O-N 3.11Å; E46-K48 PolarHBondContact O-N 3.39Å; E46-K48 VanDerWaalsContact O-N 3.12Å | ||
| 47 | P | 40.6 | Very low | 45.5 | Very low | 121 Ų | 121 | 140.6 Ų | 140.6 | 79% | 0.786 | 73% | 0.729 | S | S | * | * | trans | -63.9 | 118.3 | 177 | 27.5 | -31.3 | 0 | 0 | 0 | 109.1 | Y49 | P47-Y49 PolarHBondContact O-N 2.95Š| ||
| 48 | K | 38.2 | Very low | 47.5 | Very low | 216 Ų | 216 | 142.6 Ų | 142.6 | 94% | 0.939 | 72% | 0.721 | S | S | * | * | trans | -52.1 | 102.7 | 176.8 | -83 | -176.5 | 174.3 | 179.1 | 0 | 111.1 | E46 | E46-K48 PolarHBondContact O-N 3.39Å; E46-K48 VanDerWaalsContact O-N 3.12Å | ||
| 49 | Y | 37.2 | Very low | 49.3 | Very low | 186 Ų | 186 | 135.4 Ų | 135.4 | 73% | 0.729 | 70% | 0.696 | S | S | * | * | trans | -67.6 | 121.9 | 167.5 | -167.3 | -93.2 | 0 | 0 | 0 | 109.5 | P47 | P47-Y49 PolarHBondContact O-N 2.95Š| ||
| 50 | N | 39.3 | Very low | 51 | Low | 160 Ų | 160 | 135.2 Ų | 135.2 | 86% | 0.856 | 69% | 0.689 | S | S | * | * | trans | -158.7 | 134.5 | 155.7 | -127 | -28.3 | 0 | 0 | 0 | 112.6 | ||||
| 51 | R | 47.1 | Very low | 53.1 | Low | 215 Ų | 215 | 131.4 Ų | 131.4 | 81% | 0.811 | 67% | 0.674 | S | S | * | * | S | Bend | trans | 77.4 | 81.3 | 169.9 | -158.4 | 173 | -83.8 | 165.9 | -6.9 | 116.9 | ||
| 52 | N | 50.8 | Low | 55.5 | Low | 109 Ų | 109 | 130.1 Ų | 130.1 | 58% | 0.583 | 67% | 0.667 | S | S | * | * | trans | 89.3 | 116.2 | 157.9 | -46.5 | -8.4 | 0 | 0 | 0 | 114.1 | N54 | N52-N54 HydrophobicContact CB-CB 4.29Å; N52-N54 PolarHBondContact O-N 3.1Å | ||
| 53 | G | 56.2 | Low | 57.8 | Low | 34 Ų | 34 | 130 Ų | 130 | 35% | 0.351 | 65% | 0.653 | S | S | . | * | T | Hydrogen-bonded Turn | trans | -58.4 | 19.4 | 171.2 | 0 | 0 | 0 | 0 | 0 | 115.9 | S57 | G53-S57 PolarHBondContact O-OG 3.33Š|
| 54 | N | 63 | Low | 60.6 | Low | 98 Ų | 98 | 132.6 Ų | 132.6 | 52% | 0.524 | 65% | 0.647 | S | S | . | * | H | α-helix | trans | -76 | -32.8 | 175.5 | -67.6 | 6.2 | 0 | 0 | 0 | 111.6 | N52 S57 L58 | N52-N54 HydrophobicContact CB-CB 4.29Å; N52-N54 PolarHBondContact O-N 3.1Å; N54-S57 WeakPolarHBondContact CA-OG 3.38Å; N54-S57 PolarHBondContact O-OG 3.1Å; N54-L58 HydrophobicContact CB-CD1 4.46Å; N54-L58 WeakPolarHBondContact O-CB 3.39Å; N54-L58 WeakPolarHBondContact O-CD1 3.33Å; N54-L58 WeakPolarHBondContact O-CG 3.49Å; N54-L58 PolarHBondContact O-N 3.44Å |
| 55 | F | 69.7 | Low | 63 | Low | 160 Ų | 160 | 128.3 Ų | 128.3 | 70% | 0.702 | 63% | 0.626 | S | S | * | * | H | α-helix | trans | -67.8 | -47.4 | -174.7 | -172.8 | -97.6 | 0 | 0 | 0 | 113 | L58 Q59 | F55-L58 PolarHBondContact O-N 2.96Å; F55-Q59 PolarHBondContact O-N 3.44Å |
| 56 | T | 72.8 | Confident | 65.8 | Low | 75 Ų | 75 | 120.3 Ų | 120.3 | 46% | 0.46 | 59% | 0.587 | S | S | . | * | H | α-helix | trans | -65.2 | -46.2 | 176.2 | 46.2 | 0 | 0 | 0 | 0 | 110.8 | L58 Q59 Y60 | T56-L58 VanDerWaalsContact C-N 3.34Å; T56-L58 PolarHBondContact O-N 3.18Å; T56-Q59 PolarHBondContact O-N 2.95Å; T56-Y60 WeakPolarHBondContact O-CD2 3.19Å; T56-Y60 PolarHBondContact O-N 2.75Å |
| 57 | S | 69.7 | Low | 68.6 | Low | 63 Ų | 63 | 118.1 Ų | 118.1 | 44% | 0.441 | 58% | 0.577 | S | S | . | * | H | α-helix | trans | -61.7 | -38.6 | 178.3 | 53.2 | 0 | 0 | 0 | 0 | 113.1 | G53 N54 S61 | G53-S57 PolarHBondContact O-OG 3.33Å; N54-S57 WeakPolarHBondContact CA-OG 3.38Å; N54-S57 PolarHBondContact O-OG 3.1Å; S57-S61 VanDerWaalsContact O-CB 3.23Å; S57-S61 WeakPolarHBondContact O-CB 3.41Å; S57-S61 PolarHBondContact O-N 3.34Å |
| 58 | L | 76.2 | Confident | 71.2 | Confident | 117 Ų | 117 | 113.8 Ų | 113.8 | 61% | 0.613 | 55% | 0.551 | S | S | * | * | H | α-helix | trans | -63.5 | -45.9 | 172.4 | -73.1 | 168.2 | 0 | 0 | 0 | 111.6 | N54 F55 T56 Y60 S61 D62 | N54-L58 HydrophobicContact CB-CD1 4.46Å; N54-L58 WeakPolarHBondContact O-CB 3.39Å; N54-L58 WeakPolarHBondContact O-CD1 3.33Å; N54-L58 WeakPolarHBondContact O-CG 3.49Å; N54-L58 PolarHBondContact O-N 3.44Å; F55-L58 PolarHBondContact O-N 2.96Å; T56-L58 VanDerWaalsContact C-N 3.34Å; T56-L58 PolarHBondContact O-N 3.18Å; L58-Y60 PolarHBondContact O-N 3.46Å; L58-S61 WeakPolarHBondContact O-CB 3.37Å; L58-S61 PolarHBondContact O-N 2.93Å; L58-D62 WeakPolarHBondContact O-CB 3.47Å; L58-D62 PolarHBondContact O-N 2.88Å |
| 59 | Q | 75.9 | Confident | 74 | Confident | 90 Ų | 90 | 103.8 Ų | 103.8 | 42% | 0.421 | 51% | 0.508 | S | S | . | . | H | α-helix | trans | -64.9 | -39.3 | 178.2 | -168.9 | -174.1 | 1.1 | 0 | 0 | 112.5 | F55 T56 K63 | F55-Q59 PolarHBondContact O-N 3.44Å; T56-Q59 PolarHBondContact O-N 2.95Å; Q59-K63 WeakPolarHBondContact O-CG 3.31Å; Q59-K63 PolarHBondContact O-N 3.26Å; Q59-K63 VanDerWaalsContact O-N 3.13Å |
| 60 | Y | 71.3 | Confident | 76.9 | Confident | 167 Ų | 167 | 96.4 Ų | 96.4 | 66% | 0.655 | 48% | 0.48 | S | S | * | . | H | α-helix | trans | -67.2 | -40.2 | 174.1 | -85 | -76 | 0 | 0 | 0 | 111.6 | T56 L58 Y64 | T56-Y60 WeakPolarHBondContact O-CD2 3.19Å; T56-Y60 PolarHBondContact O-N 2.75Å; L58-Y60 PolarHBondContact O-N 3.46Å; Y60-Y64 WeakPolarHBondContact O-CB 3.48Å; Y60-Y64 PolarHBondContact O-N 3.05Å |
| 61 | S | 80.9 | Confident | 79.6 | Confident | 66 Ų | 66 | 96.3 Ų | 96.3 | 46% | 0.462 | 47% | 0.468 | S | S | . | . | H | α-helix | trans | -60.9 | -47.1 | 175.7 | -172.9 | 0 | 0 | 0 | 0 | 111.2 | S57 L58 K63 Y64 V65 | S57-S61 VanDerWaalsContact O-CB 3.23Å; S57-S61 WeakPolarHBondContact O-CB 3.41Å; S57-S61 PolarHBondContact O-N 3.34Å; L58-S61 WeakPolarHBondContact O-CB 3.37Å; L58-S61 PolarHBondContact O-N 2.93Å; S61-K63 PolarHBondContact O-N 3.42Å; S61-Y64 WeakPolarHBondContact O-CB 3.43Å; S61-Y64 PolarHBondContact O-N 2.96Å; S61-Y64 VanDerWaalsContact O-N 3.15Å; S61-V65 VanDerWaalsContact O-CG2 3.28Å; S61-V65 WeakPolarHBondContact O-CG2 3.3Å; S61-V65 PolarHBondContact O-N 3.25Å |
| 62 | D | 86.3 | Confident | 82 | Confident | 112 Ų | 112 | 90.4 Ų | 90.4 | 60% | 0.599 | 45% | 0.448 | S | S | * | . | H | α-helix | trans | -63.8 | -44.3 | -179.2 | -164.7 | 20.7 | 0 | 0 | 0 | 111.9 | L58 Y64 V65 R66 | L58-D62 WeakPolarHBondContact O-CB 3.47Å; L58-D62 PolarHBondContact O-N 2.88Å; D62-Y64 PolarHBondContact O-N 2.77Å; D62-V65 PolarHBondContact O-N 3.17Å; D62-R66 WeakPolarHBondContact O-CB 3.39Å; D62-R66 PolarHBondContact O-N 2.94Å |
| 63 | K | 90.1 | Very high | 84.3 | Confident | 101 Ų | 101 | 85.2 Ų | 85.2 | 44% | 0.439 | 42% | 0.421 | S | S | . | . | H | α-helix | trans | -59.3 | -43.9 | 171.9 | -72.9 | 175.9 | -178.5 | 178.2 | 0 | 112.2 | Q59 S61 R66 H67 | Q59-K63 WeakPolarHBondContact O-CG 3.31Å; Q59-K63 PolarHBondContact O-N 3.26Å; Q59-K63 VanDerWaalsContact O-N 3.13Å; S61-K63 PolarHBondContact O-N 3.42Å; K63-R66 PolarHBondContact O-N 3.33Å; K63-H67 PolarHBondContact O-N 3.02Å; K63-H67 PolarHBondContact O-ND1 3.41Å |
| 64 | Y | 92.5 | Very high | 86.2 | Confident | 165 Ų | 165 | 86.7 Ų | 86.7 | 65% | 0.647 | 42% | 0.416 | S | S | * | . | H | α-helix | trans | -62.9 | -45.9 | 178.3 | 177.6 | -89.9 | 0 | 0 | 0 | 111.5 | Y60 S61 D62 R66 H67 A68 | Y60-Y64 WeakPolarHBondContact O-CB 3.48Å; Y60-Y64 PolarHBondContact O-N 3.05Å; S61-Y64 WeakPolarHBondContact O-CB 3.43Å; S61-Y64 PolarHBondContact O-N 2.96Å; S61-Y64 VanDerWaalsContact O-N 3.15Å; D62-Y64 PolarHBondContact O-N 2.77Å; Y64-R66 VanDerWaalsContact C-N 3.31Å; Y64-R66 PolarHBondContact O-N 3Å; Y64-H67 PolarHBondContact O-N 3.06Å; Y64-A68 WeakPolarHBondContact O-CB 3.43Å; Y64-A68 PolarHBondContact O-N 3.27Å |
| 65 | V | 93.6 | Very high | 87.9 | Confident | 61 Ų | 61 | 87.4 Ų | 87.4 | 37% | 0.37 | 42% | 0.42 | S | S | . | . | H | α-helix | trans | -59.7 | -43.4 | 176.1 | 172 | 0 | 0 | 0 | 0 | 110.3 | S61 D62 A68 F69 A254 | S61-V65 VanDerWaalsContact O-CG2 3.28Å; S61-V65 WeakPolarHBondContact O-CG2 3.3Å; S61-V65 PolarHBondContact O-N 3.25Å; D62-V65 PolarHBondContact O-N 3.17Å; V65-A68 PolarHBondContact O-N 3.47Å; V65-F69 WeakPolarHBondContact O-CB 3.3Å; V65-F69 PolarHBondContact O-N 2.88Å; V65-A254 HydrophobicContact CG1-CB 3.73Å |
| 66 | R | 94.6 | Very high | 89.3 | Confident | 38 Ų | 38 | 81.5 Ų | 81.5 | 14% | 0.143 | 40% | 0.395 | C | S | . | . | H | α-helix | trans | -62.6 | -48 | 177.6 | -170.1 | 58.9 | 171.3 | -174.1 | -0.7 | 112.6 | D62 K63 Y64 A68 F69 I70 H243 I244 M245 L252 | D62-R66 WeakPolarHBondContact O-CB 3.39Å; D62-R66 PolarHBondContact O-N 2.94Å; K63-R66 PolarHBondContact O-N 3.33Å; Y64-R66 VanDerWaalsContact C-N 3.31Å; Y64-R66 PolarHBondContact O-N 3Å; R66-A68 VanDerWaalsContact C-N 3.32Å; R66-A68 PolarHBondContact O-N 3.29Å; R66-F69 WeakPolarHBondContact O-CB 3.49Å; R66-F69 PolarHBondContact O-N 3.34Å; R66-I70 HydrophobicContact CG-CD1 3.95Å; R66-I70 VanDerWaalsContact O-CG1 3.29Å; R66-I70 WeakPolarHBondContact O-CG1 3.15Å; R66-I70 PolarHBondContact O-N 3.47Å; R66-H243 PolarHBondContact NH2-O 3.03Å; R66-I244 PolarHBondContact NE-O 3.36Å; R66-I244 PolarHBondContact NH2-O 3.38Å; R66-M245 VanDerWaalsContact NE-C 3.32Å; R66-M245 PolarHBondContact NE-O 3.02Å; R66-L252 PolarHBondContact NH1-O 2.93Å |
| 67 | H | 94.5 | Very high | 90.5 | Very high | 126 Ų | 126 | 78.5 Ų | 78.5 | 58% | 0.583 | 38% | 0.376 | S | S | * | . | H | α-helix | trans | -62.7 | -38.8 | 177.1 | -67 | 125.6 | 0 | 0 | 0 | 112.3 | K63 Y64 R71 | K63-H67 PolarHBondContact O-N 3.02Å; K63-H67 PolarHBondContact O-ND1 3.41Å; Y64-H67 PolarHBondContact O-N 3.06Å; H67-R71 WeakPolarHBondContact O-CB 3.4Å; H67-R71 PolarHBondContact O-N 3.27Å |
| 68 | A | 96 | Very high | 91.8 | Very high | 30 Ų | 30 | 79.1 Ų | 79.1 | 25% | 0.248 | 38% | 0.377 | C | S | . | . | H | α-helix | trans | -64.4 | -41.6 | 175.6 | 0 | 0 | 0 | 0 | 0 | 111.9 | Y64 V65 R66 K72 | Y64-A68 WeakPolarHBondContact O-CB 3.43Å; Y64-A68 PolarHBondContact O-N 3.27Å; V65-A68 PolarHBondContact O-N 3.47Å; R66-A68 VanDerWaalsContact C-N 3.32Å; R66-A68 PolarHBondContact O-N 3.29Å; A68-K72 WeakPolarHBondContact O-CB 3.49Å; A68-K72 PolarHBondContact O-N 3.37Å |
| 69 | F | 96.4 | Very high | 92.9 | Very high | 7 Ų | 7 | 76 Ų | 76 | 3% | 0.031 | 37% | 0.369 | C | S | . | . | H | α-helix | trans | -60.5 | -52.6 | 173.5 | 164.9 | -105.2 | 0 | 0 | 0 | 111.9 | V65 R66 R71 K72 V73 I244 L252 A254 | V65-F69 WeakPolarHBondContact O-CB 3.3Å; V65-F69 PolarHBondContact O-N 2.88Å; R66-F69 WeakPolarHBondContact O-CB 3.49Å; R66-F69 PolarHBondContact O-N 3.34Å; F69-R71 VanDerWaalsContact C-N 3.35Å; F69-R71 PolarHBondContact O-N 3.08Å; F69-K72 WeakPolarHBondContact O-CB 3.37Å; F69-K72 PolarHBondContact O-N 2.88Å; F69-K72 VanDerWaalsContact O-N 3.08Å; F69-V73 HydrophobicContact CD2-CG2 4.04Å; F69-V73 HydrophobicContact CE1-CG2 4.3Å; F69-V73 HydrophobicContact CE2-CG2 3.68Å; F69-V73 HydrophobicContact CZ-CG2 3.8Å; F69-V73 WeakPolarHBondContact O-CG2 3.39Å; F69-V73 PolarHBondContact O-N 3.3Å; F69-I244 HydrophobicContact CE1-CB 4.36Å; F69-I244 HydrophobicContact CE1-CG2 3.96Å; F69-L252 HydrophobicContact CE1-CB 4.27Å; F69-L252 HydrophobicContact CZ-CB 3.71Å; F69-L252 HydrophobicContact CZ-CD1 4.3Å; F69-A254 HydrophobicContact CB-CB 4.13Å; F69-A254 HydrophobicContact CD2-CB 4.37Å; F69-A254 WeakPolarHBondContact CD2-O 3.25Å; F69-A254 HydrophobicContact CG-CB 4.44Å |
| 70 | I | 97 | Very high | 94 | Very high | 30 Ų | 30 | 72 Ų | 72 | 15% | 0.154 | 35% | 0.35 | C | S | . | . | H | α-helix | trans | -55.4 | -51.1 | 178.5 | -68.4 | 164.6 | 0 | 0 | 0 | 109.9 | R66 K72 V73 Y74 I244 M245 | R66-I70 HydrophobicContact CG-CD1 3.95Å; R66-I70 VanDerWaalsContact O-CG1 3.29Å; R66-I70 WeakPolarHBondContact O-CG1 3.15Å; R66-I70 PolarHBondContact O-N 3.47Å; I70-K72 VanDerWaalsContact C-N 3.26Å; I70-K72 PolarHBondContact O-N 2.93Å; I70-V73 PolarHBondContact O-N 3.37Å; I70-Y74 HydrophobicContact CG2-CD2 3.77Å; I70-Y74 HydrophobicContact CG2-CE2 3.95Å; I70-Y74 WeakPolarHBondContact O-CD2 3.49Å; I70-Y74 PolarHBondContact O-N 3.36Å; I70-I244 HydrophobicContact CG1-CG2 4.12Å; I70-I244 VanDerWaalsContact CG1-O 3.28Å; I70-I244 WeakPolarHBondContact CG1-O 3.37Å; I70-M245 HydrophobicContact CD1-CE 4.5Å; I70-M245 HydrophobicContact CD1-SD 3.94Å; I70-M245 HydrophobicContact CG2-CE 3.78Å; I70-M245 HydrophobicContact CG2-SD 4.5Å |
| 71 | R | 97.2 | Very high | 95.3 | Very high | 158 Ų | 158 | 66.5 Ų | 66.5 | 60% | 0.596 | 33% | 0.331 | S | S | * | . | H | α-helix | trans | -56 | -42.9 | 178.2 | -178 | 176.6 | 63.2 | -161.3 | -2 | 111.7 | H67 F69 L75 | H67-R71 WeakPolarHBondContact O-CB 3.4Å; H67-R71 PolarHBondContact O-N 3.27Å; F69-R71 VanDerWaalsContact C-N 3.35Å; F69-R71 PolarHBondContact O-N 3.08Å; R71-L75 HydrophobicContact CG-CD1 4.07Å; R71-L75 HydrophobicContact CG-CG 4.46Å; R71-L75 WeakPolarHBondContact O-CB 3.41Å; R71-L75 VanDerWaalsContact O-CG 3.25Å; R71-L75 WeakPolarHBondContact O-CG 3.43Å; R71-L75 PolarHBondContact O-N 3.01Å |
| 72 | K | 97.4 | Very high | 96.1 | Very high | 91 Ų | 91 | 68.8 Ų | 68.8 | 40% | 0.396 | 34% | 0.338 | S | S | . | . | H | α-helix | trans | -63.9 | -44.8 | 179.1 | -169.4 | 176.5 | -174.2 | -174.8 | 0 | 111.9 | A68 F69 I70 I76 Y257 | A68-K72 WeakPolarHBondContact O-CB 3.49Å; A68-K72 PolarHBondContact O-N 3.37Å; F69-K72 WeakPolarHBondContact O-CB 3.37Å; F69-K72 PolarHBondContact O-N 2.88Å; F69-K72 VanDerWaalsContact O-N 3.08Å; I70-K72 VanDerWaalsContact C-N 3.26Å; I70-K72 PolarHBondContact O-N 2.93Å; K72-I76 HydrophobicContact CG-CD1 4.25Å; K72-I76 VanDerWaalsContact O-CG1 3.3Å; K72-I76 WeakPolarHBondContact O-CG1 3.43Å; K72-I76 PolarHBondContact O-N 3.34Å; K72-I76 VanDerWaalsContact O-N 3.17Å; K72-Y257 HydrophobicContact CD-CD1 3.99Å; K72-Y257 HydrophobicContact CD-CD2 3.84Å; K72-Y257 HydrophobicContact CD-CE1 4.41Å; K72-Y257 HydrophobicContact CD-CE2 4.23Å; K72-Y257 HydrophobicContact CD-CG 3.7Å; K72-Y257 VanDerWaalsContact CE-CD2 3.5Å; K72-Y257 HydrophobicContact CG-CD2 4.1Å; K72-Y257 HydrophobicContact CG-CG 4.23Å; K72-Y257 PolarHBondContact NZ-OH 3.28Å |
| 73 | V | 97.9 | Very high | 96.7 | Very high | 0 Ų | 0 | 66 Ų | 66 | 0% | 0 | 33% | 0.325 | C | S | . | . | H | α-helix | trans | -61 | -50.7 | 178.1 | 173.8 | 0 | 0 | 0 | 0 | 111.1 | F69 I70 L75 I76 L77 I244 A261 L264 | F69-V73 HydrophobicContact CD2-CG2 4.04Å; F69-V73 HydrophobicContact CE1-CG2 4.3Å; F69-V73 HydrophobicContact CE2-CG2 3.68Å; F69-V73 HydrophobicContact CZ-CG2 3.8Å; F69-V73 WeakPolarHBondContact O-CG2 3.39Å; F69-V73 PolarHBondContact O-N 3.3Å; I70-V73 PolarHBondContact O-N 3.37Å; V73-L75 PolarHBondContact O-N 2.95Å; V73-I76 PolarHBondContact O-N 3.39Å; V73-L77 WeakPolarHBondContact O-CB 3.29Å; V73-L77 PolarHBondContact O-N 2.95Å; V73-I244 HydrophobicContact CB-CG2 4.39Å; V73-I244 HydrophobicContact CG1-CD1 3.78Å; V73-I244 HydrophobicContact CG1-CG1 4.37Å; V73-I244 HydrophobicContact CG1-CG2 4.28Å; V73-A261 HydrophobicContact CG1-CB 4.24Å; V73-L264 HydrophobicContact CG1-CD1 4.29Å |
| 74 | Y | 97.7 | Very high | 97.1 | Very high | 65 Ų | 65 | 61.6 Ų | 61.6 | 26% | 0.255 | 31% | 0.306 | S | S | . | . | H | α-helix | trans | -69.4 | -30.5 | -177.8 | -82.1 | -87.7 | 0 | 0 | 0 | 113.5 | I70 L77 T78 I244 M245 L264 | I70-Y74 HydrophobicContact CG2-CD2 3.77Å; I70-Y74 HydrophobicContact CG2-CE2 3.95Å; I70-Y74 WeakPolarHBondContact O-CD2 3.49Å; I70-Y74 PolarHBondContact O-N 3.36Å; Y74-L77 HydrophobicContact CD1-CD2 4.1Å; Y74-L77 HydrophobicContact CE1-CD2 4.27Å; Y74-T78 WeakPolarHBondContact O-CB 3.29Å; Y74-T78 PolarHBondContact O-N 3.26Å; Y74-T78 PolarHBondContact O-OG1 3.48Å; Y74-I244 HydrophobicContact CE2-CG2 4.14Å; Y74-M245 HydrophobicContact CE2-CE 3.49Å; Y74-M245 VanDerWaalsContact CE2-CE 3.49Å; Y74-L264 HydrophobicContact CE1-CD1 4.31Å; Y74-L264 HydrophobicContact CE2-CD1 4.48Å |
| 75 | L | 98.1 | Very high | 97.3 | Very high | 114 Ų | 114 | 56.7 Ų | 56.7 | 60% | 0.597 | 30% | 0.296 | S | S | * | . | H | α-helix | trans | -64.4 | -43 | 171.3 | -78.1 | 175 | 0 | 0 | 0 | 111.7 | R71 V73 T78 A79 | R71-L75 HydrophobicContact CG-CD1 4.07Å; R71-L75 HydrophobicContact CG-CG 4.46Å; R71-L75 WeakPolarHBondContact O-CB 3.41Å; R71-L75 VanDerWaalsContact O-CG 3.25Å; R71-L75 WeakPolarHBondContact O-CG 3.43Å; R71-L75 PolarHBondContact O-N 3.01Å; V73-L75 PolarHBondContact O-N 2.95Å; L75-T78 PolarHBondContact O-N 2.79Å; L75-A79 PolarHBondContact O-N 2.89Å |
| 76 | I | 98.2 | Very high | 97.5 | Very high | 36 Ų | 36 | 56.3 Ų | 56.3 | 19% | 0.185 | 30% | 0.299 | C | S | . | . | H | α-helix | trans | -64.7 | -49.5 | 176.5 | -66.8 | 166.8 | 0 | 0 | 0 | 110.1 | K72 V73 T78 A79 Q80 L139 Y257 I258 A261 | K72-I76 HydrophobicContact CG-CD1 4.25Å; K72-I76 VanDerWaalsContact O-CG1 3.3Å; K72-I76 WeakPolarHBondContact O-CG1 3.43Å; K72-I76 PolarHBondContact O-N 3.34Å; K72-I76 VanDerWaalsContact O-N 3.17Å; V73-I76 PolarHBondContact O-N 3.39Å; I76-T78 VanDerWaalsContact C-N 3.29Å; I76-T78 PolarHBondContact O-N 2.82Å; I76-A79 WeakPolarHBondContact O-CB 3.46Å; I76-A79 PolarHBondContact O-N 2.85Å; I76-A79 VanDerWaalsContact O-N 3.07Å; I76-Q80 HydrophobicContact CG2-CG 4.35Å; I76-Q80 WeakPolarHBondContact O-CG 3.33Å; I76-Q80 PolarHBondContact O-N 2.95Å; I76-L139 HydrophobicContact CG2-CD2 3.43Å; I76-L139 VanDerWaalsContact CG2-CD2 3.43Å; I76-Y257 HydrophobicContact CD1-CD2 3.47Å; I76-Y257 VanDerWaalsContact CD1-CD2 3.47Å; I76-Y257 HydrophobicContact CD1-CE2 3.89Å; I76-I258 HydrophobicContact CD1-CD1 4.41Å; I76-A261 HydrophobicContact CB-CB 3.9Å; I76-A261 HydrophobicContact CG2-CB 3.52Å |
| 77 | L | 98.3 | Very high | 97.7 | Very high | 12 Ų | 12 | 57 Ų | 57 | 6% | 0.063 | 30% | 0.304 | C | S | . | . | H | α-helix | trans | -53.8 | -46.8 | 176.2 | 175.2 | 63.3 | 0 | 0 | 0 | 111.6 | V73 Y74 A79 Q80 L81 L264 Y265 | V73-L77 WeakPolarHBondContact O-CB 3.29Å; V73-L77 PolarHBondContact O-N 2.95Å; Y74-L77 HydrophobicContact CD1-CD2 4.1Å; Y74-L77 HydrophobicContact CE1-CD2 4.27Å; L77-A79 VanDerWaalsContact C-N 3.32Å; L77-A79 PolarHBondContact O-N 3.3Å; L77-Q80 WeakPolarHBondContact O-CB 3.47Å; L77-Q80 PolarHBondContact O-N 2.84Å; L77-Q80 VanDerWaalsContact O-N 3.16Å; L77-L81 HydrophobicContact CD1-CD1 4.06Å; L77-L81 HydrophobicContact CD1-CG 4.11Å; L77-L81 HydrophobicContact CG-CD1 4.03Å; L77-L81 HydrophobicContact CG-CG 4.44Å; L77-L81 WeakPolarHBondContact O-CG 3.31Å; L77-L81 PolarHBondContact O-N 2.74Å; L77-L264 HydrophobicContact CD1-CB 4.1Å; L77-L264 HydrophobicContact CD2-CB 3.9Å; L77-L264 HydrophobicContact CD2-CD1 3.85Å; L77-Y265 HydrophobicContact CD1-CD2 4.47Å |
| 78 | T | 98.2 | Very high | 97.8 | Very high | 75 Ų | 75 | 51.7 Ų | 51.7 | 46% | 0.46 | 28% | 0.28 | S | S | . | . | H | α-helix | trans | -59.7 | -44.2 | 177.8 | -58 | 0 | 0 | 0 | 0 | 111 | Y74 L75 I76 Q80 L81 L82 | Y74-T78 WeakPolarHBondContact O-CB 3.29Å; Y74-T78 PolarHBondContact O-N 3.26Å; Y74-T78 PolarHBondContact O-OG1 3.48Å; L75-T78 PolarHBondContact O-N 2.79Å; I76-T78 VanDerWaalsContact C-N 3.29Å; I76-T78 PolarHBondContact O-N 2.82Å; T78-Q80 PolarHBondContact O-N 3.38Å; T78-L81 PolarHBondContact O-N 3.17Å; T78-L82 HydrophobicContact CG2-CD1 4.26Å; T78-L82 HydrophobicContact CG2-CG 4.49Å; T78-L82 WeakPolarHBondContact O-CB 3.46Å; T78-L82 VanDerWaalsContact O-CG 3.29Å; T78-L82 WeakPolarHBondContact O-CG 3.29Å; T78-L82 PolarHBondContact O-N 3.49Å |
| 79 | A | 98.5 | Very high | 97.9 | Very high | 53 Ų | 53 | 53.1 Ų | 53.1 | 44% | 0.438 | 29% | 0.288 | S | S | . | . | H | α-helix | trans | -61.6 | -42.3 | 175.3 | 0 | 0 | 0 | 0 | 0 | 112.2 | L75 I76 L77 L82 V83 | L75-A79 PolarHBondContact O-N 2.89Å; I76-A79 WeakPolarHBondContact O-CB 3.46Å; I76-A79 PolarHBondContact O-N 2.85Å; I76-A79 VanDerWaalsContact O-N 3.07Å; L77-A79 VanDerWaalsContact C-N 3.32Å; L77-A79 PolarHBondContact O-N 3.3Å; A79-L82 PolarHBondContact O-N 3.26Å; A79-V83 WeakPolarHBondContact O-CG2 3.45Å; A79-V83 PolarHBondContact O-N 3.37Å |
| 80 | Q | 98.7 | Very high | 97.9 | Very high | 6 Ų | 6 | 56.6 Ų | 56.6 | 3% | 0.028 | 31% | 0.309 | C | S | . | . | H | α-helix | trans | -63 | -42.4 | 177 | -66.1 | 179 | -79.2 | 0 | 0 | 112.3 | I76 L77 T78 V83 T84 T143 A261 Y265 | I76-Q80 HydrophobicContact CG2-CG 4.35Å; I76-Q80 WeakPolarHBondContact O-CG 3.33Å; I76-Q80 PolarHBondContact O-N 2.95Å; L77-Q80 WeakPolarHBondContact O-CB 3.47Å; L77-Q80 PolarHBondContact O-N 2.84Å; L77-Q80 VanDerWaalsContact O-N 3.16Å; T78-Q80 PolarHBondContact O-N 3.38Å; Q80-V83 PolarHBondContact O-N 3.06Å; Q80-T84 PolarHBondContact O-N 2.64Å; Q80-T84 PolarHBondContact O-OG1 3.17Å; Q80-T143 HydrophobicContact CB-CG2 3.85Å; Q80-T143 HydrophobicContact CG-CG2 3.87Å; Q80-T143 PolarHBondContact NE2-OG1 2.85Å; Q80-A261 PolarHBondContact OE1-O 3.24Å; Q80-Y265 HydrophobicContact CB-CD2 3.54Å; Q80-Y265 HydrophobicContact CB-CE2 3.73Å; Q80-Y265 HydrophobicContact CB-CG 3.99Å |
| 81 | L | 98.2 | Very high | 97.8 | Very high | 51 Ų | 51 | 55.8 Ų | 55.8 | 27% | 0.267 | 31% | 0.305 | S | S | . | . | H | α-helix | trans | -68.3 | -37.6 | 177 | -68 | 175.8 | 0 | 0 | 0 | 111.9 | L77 T78 T84 S85 Y265 V268 V269 | L77-L81 HydrophobicContact CD1-CD1 4.06Å; L77-L81 HydrophobicContact CD1-CG 4.11Å; L77-L81 HydrophobicContact CG-CD1 4.03Å; L77-L81 HydrophobicContact CG-CG 4.44Å; L77-L81 WeakPolarHBondContact O-CG 3.31Å; L77-L81 PolarHBondContact O-N 2.74Å; T78-L81 PolarHBondContact O-N 3.17Å; L81-T84 PolarHBondContact O-N 3.07Å; L81-S85 VanDerWaalsContact O-CB 3.31Å; L81-S85 WeakPolarHBondContact O-CB 3.34Å; L81-S85 PolarHBondContact O-N 2.79Å; L81-S85 PolarHBondContact O-OG 3.21Å; L81-Y265 HydrophobicContact CD2-CD2 3.92Å; L81-Y265 HydrophobicContact CD2-CE2 4.22Å; L81-Y265 HydrophobicContact CG-CD2 4.4Å; L81-V268 HydrophobicContact CD1-CG1 4.21Å; L81-V268 HydrophobicContact CD2-CB 4.23Å; L81-V268 HydrophobicContact CD2-CG1 3.61Å; L81-V269 HydrophobicContact CD2-CG2 4.16Å |
| 82 | L | 98.4 | Very high | 97.6 | Very high | 114 Ų | 114 | 48.7 Ų | 48.7 | 60% | 0.597 | 28% | 0.278 | S | S | * | . | H | α-helix | trans | -63 | -44.7 | 173.6 | -74.6 | 173.9 | 0 | 0 | 0 | 112 | T78 A79 T84 S85 A86 | T78-L82 HydrophobicContact CG2-CD1 4.26Å; T78-L82 HydrophobicContact CG2-CG 4.49Å; T78-L82 WeakPolarHBondContact O-CB 3.46Å; T78-L82 VanDerWaalsContact O-CG 3.29Å; T78-L82 WeakPolarHBondContact O-CG 3.29Å; T78-L82 PolarHBondContact O-N 3.49Å; A79-L82 PolarHBondContact O-N 3.26Å; L82-T84 VanDerWaalsContact C-N 3.34Å; L82-T84 PolarHBondContact O-N 3.2Å; L82-S85 PolarHBondContact O-N 2.98Å; L82-A86 PolarHBondContact O-N 3.22Å |
| 83 | V | 98.6 | Very high | 97.5 | Very high | 53 Ų | 53 | 50.7 Ų | 50.7 | 32% | 0.321 | 29% | 0.287 | S | S | . | . | H | α-helix | trans | -58.7 | -49 | 174.3 | 172 | 0 | 0 | 0 | 0 | 109.9 | A79 Q80 S85 A86 F87 T143 L144 | A79-V83 WeakPolarHBondContact O-CG2 3.45Å; A79-V83 PolarHBondContact O-N 3.37Å; Q80-V83 PolarHBondContact O-N 3.06Å; V83-S85 VanDerWaalsContact C-N 3.32Å; V83-S85 PolarHBondContact O-N 2.96Å; V83-A86 WeakPolarHBondContact O-CB 3.37Å; V83-A86 PolarHBondContact O-N 2.87Å; V83-A86 VanDerWaalsContact O-N 3.15Å; V83-F87 HydrophobicContact CG1-CD2 3.98Å; V83-F87 HydrophobicContact CG1-CE2 3.93Å; V83-F87 WeakPolarHBondContact O-CD2 3.49Å; V83-F87 PolarHBondContact O-N 3.4Å; V83-T143 HydrophobicContact CB-CG2 4.33Å; V83-T143 HydrophobicContact CG1-CG2 4.26Å; V83-L144 HydrophobicContact CG1-CD2 4Å |
| 84 | T | 98.5 | Very high | 97.3 | Very high | 8 Ų | 8 | 52.5 Ų | 52.5 | 5% | 0.049 | 30% | 0.3 | C | S | . | . | H | α-helix | trans | -60.2 | -43.1 | 178.6 | -57 | 0 | 0 | 0 | 0 | 112.4 | Q80 L81 L82 A86 F87 V88 S147 T150 Y265 V269 | Q80-T84 PolarHBondContact O-N 2.64Å; Q80-T84 PolarHBondContact O-OG1 3.17Å; L81-T84 PolarHBondContact O-N 3.07Å; L82-T84 VanDerWaalsContact C-N 3.34Å; L82-T84 PolarHBondContact O-N 3.2Å; T84-A86 VanDerWaalsContact C-N 3.31Å; T84-A86 PolarHBondContact O-N 3.02Å; T84-F87 PolarHBondContact O-N 3.44Å; T84-V88 HydrophobicContact CG2-CG2 4.41Å; T84-V88 WeakPolarHBondContact O-CG2 3.15Å; T84-V88 PolarHBondContact O-N 3.08Å; T84-S147 WeakPolarHBondContact CA-OG 3.28Å; T84-S147 PolarHBondContact N-OG 2.96Å; T84-S147 PolarHBondContact OG1-OG 3.21Å; T84-T150 HydrophobicContact CG2-CG2 3.87Å; T84-Y265 VanDerWaalsContact OG1-CE2 3.31Å; T84-Y265 WeakPolarHBondContact OG1-CE2 3.49Å; T84-Y265 PolarHBondContact OG1-OH 2.86Å; T84-V269 HydrophobicContact CG2-CG2 4.36Å |
| 85 | S | 97.9 | Very high | 97 | Very high | 63 Ų | 63 | 53.9 Ų | 53.9 | 44% | 0.441 | 32% | 0.319 | S | S | . | . | H | α-helix | trans | -61.8 | -40.6 | 177.2 | -57.7 | 0 | 0 | 0 | 0 | 111.1 | L81 L82 V83 V88 C89 | L81-S85 VanDerWaalsContact O-CB 3.31Å; L81-S85 WeakPolarHBondContact O-CB 3.34Å; L81-S85 PolarHBondContact O-N 2.79Å; L81-S85 PolarHBondContact O-OG 3.21Å; L82-S85 PolarHBondContact O-N 2.98Å; V83-S85 VanDerWaalsContact C-N 3.32Å; V83-S85 PolarHBondContact O-N 2.96Å; S85-V88 PolarHBondContact O-N 2.97Å; S85-C89 WeakPolarHBondContact O-CB 3.39Å; S85-C89 PolarHBondContact O-N 3.22Å; S85-C89 PolarHBondContact O-SG 3.19Å |
| 86 | A | 98 | Very high | 96.9 | Very high | 53 Ų | 53 | 53 Ų | 53 | 44% | 0.438 | 32% | 0.32 | S | S | . | . | H | α-helix | trans | -62.6 | -44.4 | 174.9 | 0 | 0 | 0 | 0 | 0 | 112 | L82 V83 T84 C89 V90 | L82-A86 PolarHBondContact O-N 3.22Å; V83-A86 WeakPolarHBondContact O-CB 3.37Å; V83-A86 PolarHBondContact O-N 2.87Å; V83-A86 VanDerWaalsContact O-N 3.15Å; T84-A86 VanDerWaalsContact C-N 3.31Å; T84-A86 PolarHBondContact O-N 3.02Å; A86-C89 PolarHBondContact O-N 2.97Å; A86-V90 WeakPolarHBondContact O-CB 3.34Å; A86-V90 VanDerWaalsContact O-CG2 3.28Å; A86-V90 WeakPolarHBondContact O-CG2 3.48Å; A86-V90 PolarHBondContact O-N 2.8Å |
| 87 | F | 97.9 | Very high | 96.7 | Very high | 53 Ų | 53 | 53 Ų | 53 | 23% | 0.232 | 32% | 0.322 | C | S | . | . | H | α-helix | trans | -60.1 | -49.6 | 173.7 | -88.2 | -98 | 0 | 0 | 0 | 111.6 | V83 T84 C89 V90 F91 L144 Y148 | V83-F87 HydrophobicContact CG1-CD2 3.98Å; V83-F87 HydrophobicContact CG1-CE2 3.93Å; V83-F87 WeakPolarHBondContact O-CD2 3.49Å; V83-F87 PolarHBondContact O-N 3.4Å; T84-F87 PolarHBondContact O-N 3.44Å; F87-C89 PolarHBondContact O-N 3.41Å; F87-V90 PolarHBondContact O-N 3.06Å; F87-F91 AromaticContact CD1-CE2 3.78Å; F87-F91 HydrophobicContact CD1-CE2 3.78Å; F87-F91 HydrophobicContact CD1-CZ 4.2Å; F87-F91 HydrophobicContact CE1-CE2 4.43Å; F87-F91 WeakPolarHBondContact O-CB 3.4Å; F87-F91 WeakPolarHBondContact O-CD2 3.41Å; F87-F91 PolarHBondContact O-N 3.25Å; F87-L144 HydrophobicContact CE2-CD2 3.81Å; F87-L144 HydrophobicContact CZ-CD2 4.05Å; F87-Y148 HydrophobicContact CE1-CD2 4.2Å |
| 88 | V | 97.7 | Very high | 96.5 | Very high | 13 Ų | 13 | 55 Ų | 55 | 8% | 0.079 | 33% | 0.33 | C | S | . | . | H | α-helix | trans | -57.1 | -48.6 | 177.4 | 171 | 0 | 0 | 0 | 0 | 110.7 | T84 S85 V90 F91 L92 T150 T154 V162 | T84-V88 HydrophobicContact CG2-CG2 4.41Å; T84-V88 WeakPolarHBondContact O-CG2 3.15Å; T84-V88 PolarHBondContact O-N 3.08Å; S85-V88 PolarHBondContact O-N 2.97Å; V88-V90 PolarHBondContact O-N 2.95Å; V88-F91 PolarHBondContact O-N 3.26Å; V88-L92 WeakPolarHBondContact O-CB 3.38Å; V88-L92 PolarHBondContact O-N 3.49Å; V88-T150 HydrophobicContact CG2-CG2 3.85Å; V88-T154 HydrophobicContact CG1-CG2 4.06Å; V88-T154 HydrophobicContact CG2-CG2 4Å; V88-V162 HydrophobicContact CG1-CG1 3.96Å |
| 89 | C | 96.5 | Very high | 96.3 | Very high | 61 Ų | 61 | 59 Ų | 59 | 41% | 0.412 | 34% | 0.338 | S | S | . | . | H | α-helix | trans | -59.4 | -48.6 | 177.8 | -73.2 | 0 | 0 | 0 | 0 | 112.5 | S85 A86 F87 F91 L92 F93 | S85-C89 WeakPolarHBondContact O-CB 3.39Å; S85-C89 PolarHBondContact O-N 3.22Å; S85-C89 PolarHBondContact O-SG 3.19Å; A86-C89 PolarHBondContact O-N 2.97Å; F87-C89 PolarHBondContact O-N 3.41Å; C89-F91 VanDerWaalsContact C-N 3.31Å; C89-F91 PolarHBondContact O-N 3.49Å; C89-L92 PolarHBondContact O-N 3.03Å; C89-F93 HydrophobicContact CB-CD2 4.27Å; C89-F93 HydrophobicContact CB-CE2 4.45Å; C89-F93 WeakPolarHBondContact O-CB 3.15Å; C89-F93 WeakPolarHBondContact O-CD2 3Å; C89-F93 PolarHBondContact O-N 3.37Å |
| 90 | V | 96.9 | Very high | 96.1 | Very high | 80 Ų | 80 | 61.5 Ų | 61.5 | 49% | 0.485 | 34% | 0.336 | S | S | . | . | H | α-helix | trans | -60.2 | -43.8 | 179.5 | 169.2 | 0 | 0 | 0 | 0 | 110.8 | A86 F87 V88 S94 V97 | A86-V90 WeakPolarHBondContact O-CB 3.34Å; A86-V90 VanDerWaalsContact O-CG2 3.28Å; A86-V90 WeakPolarHBondContact O-CG2 3.48Å; A86-V90 PolarHBondContact O-N 2.8Å; F87-V90 PolarHBondContact O-N 3.06Å; V88-V90 PolarHBondContact O-N 2.95Å; V90-S94 WeakPolarHBondContact O-CB 3.43Å; V90-S94 PolarHBondContact O-N 2.82Å; V90-S94 VanDerWaalsContact O-N 3.08Å; V90-V97 HydrophobicContact CG1-CG2 4.21Å |
| 91 | F | 95.4 | Very high | 95.9 | Very high | 13 Ų | 13 | 61.4 Ų | 61.4 | 6% | 0.057 | 34% | 0.336 | C | S | . | . | H | α-helix | trans | -74.5 | -29.2 | -177.7 | -77 | -129.1 | 0 | 0 | 0 | 111.9 | F87 V88 C89 V97 K98 V101 Y148 G151 T152 | F87-F91 AromaticContact CD1-CE2 3.78Å; F87-F91 HydrophobicContact CD1-CE2 3.78Å; F87-F91 HydrophobicContact CD1-CZ 4.2Å; F87-F91 HydrophobicContact CE1-CE2 4.43Å; F87-F91 WeakPolarHBondContact O-CB 3.4Å; F87-F91 WeakPolarHBondContact O-CD2 3.41Å; F87-F91 PolarHBondContact O-N 3.25Å; V88-F91 PolarHBondContact O-N 3.26Å; C89-F91 VanDerWaalsContact C-N 3.31Å; C89-F91 PolarHBondContact O-N 3.49Å; F91-V97 HydrophobicContact CB-CG1 4.34Å; F91-V97 HydrophobicContact CD1-CG1 3.99Å; F91-V97 HydrophobicContact CD2-CG1 3.78Å; F91-V97 HydrophobicContact CE1-CG1 4.27Å; F91-V97 HydrophobicContact CE2-CG1 4.05Å; F91-V97 HydrophobicContact CG-CG1 3.76Å; F91-V97 HydrophobicContact CZ-CG1 4.29Å; F91-K98 WeakPolarHBondContact O-CE 3.4Å; F91-K98 WeakPolarHBondContact O-CG 3.44Å; F91-V101 HydrophobicContact CD1-CG1 3.98Å; F91-V101 HydrophobicContact CE1-CG1 3.55Å; F91-V101 HydrophobicContact CZ-CG1 4.35Å; F91-Y148 HydrophobicContact CE1-CD2 4.24Å; F91-Y148 HydrophobicContact CE1-CE2 4.02Å; F91-Y148 AromaticContact CZ-CD2 3.62Å; F91-Y148 HydrophobicContact CZ-CD2 3.62Å; F91-Y148 AromaticContact CZ-CE2 3.61Å; F91-Y148 HydrophobicContact CZ-CE2 3.61Å; F91-Y148 HydrophobicContact CZ-CG 4.47Å; F91-G151 WeakPolarHBondContact CB-O 3.39Å; F91-G151 WeakPolarHBondContact CD1-O 3.24Å; F91-T152 WeakPolarHBondContact CE1-OG1 3.43Å |
| 92 | L | 93.1 | Very high | 95.6 | Very high | 9 Ų | 9 | 61.8 Ų | 61.8 | 5% | 0.047 | 34% | 0.343 | C | S | . | . | H | α-helix | trans | -78.9 | -38.7 | 179.8 | -167.5 | 64.6 | 0 | 0 | 0 | 112.8 | V88 C89 K98 T159 V162 | V88-L92 WeakPolarHBondContact O-CB 3.38Å; V88-L92 PolarHBondContact O-N 3.49Å; C89-L92 PolarHBondContact O-N 3.03Å; L92-K98 WeakPolarHBondContact O-CE 3.41Å; L92-K98 PolarHBondContact O-NZ 3Å; L92-T159 HydrophobicContact CD2-CG2 3.85Å; L92-T159 HydrophobicContact CG-CG2 4.29Å; L92-V162 HydrophobicContact CD1-CB 4.41Å; L92-V162 HydrophobicContact CD1-CG2 3.98Å; L92-V162 HydrophobicContact CD2-CB 4.03Å; L92-V162 HydrophobicContact CD2-CG1 3.89Å; L92-V162 HydrophobicContact CD2-CG2 4.48Å |
| 93 | F | 94.2 | Very high | 95.4 | Very high | 133 Ų | 133 | 65.3 Ų | 65.3 | 58% | 0.583 | 35% | 0.348 | S | S | * | . | H | α-helix | trans | -99.5 | -14.4 | -173.6 | -63.7 | -62.7 | 0 | 0 | 0 | 114.6 | C89 T159 | C89-F93 HydrophobicContact CB-CD2 4.27Å; C89-F93 HydrophobicContact CB-CE2 4.45Å; C89-F93 WeakPolarHBondContact O-CB 3.15Å; C89-F93 WeakPolarHBondContact O-CD2 3Å; C89-F93 PolarHBondContact O-N 3.37Å; F93-T159 HydrophobicContact CE1-CG2 3.89Å; F93-T159 HydrophobicContact CZ-CG2 4.18Å |
| 94 | S | 94.3 | Very high | 95.2 | Very high | 38 Ų | 38 | 64.7 Ų | 64.7 | 27% | 0.266 | 34% | 0.343 | S | S | . | . | trans | -99.2 | 101.8 | 178.6 | -173.5 | 0 | 0 | 0 | 0 | 111.8 | V90 P96 V97 K98 | V90-S94 WeakPolarHBondContact O-CB 3.43Å; V90-S94 PolarHBondContact O-N 2.82Å; V90-S94 VanDerWaalsContact O-N 3.08Å; S94-P96 VanDerWaalsContact C-CD 3.47Å; S94-P96 VanDerWaalsContact C-N 3.33Å; S94-P96 WeakPolarHBondContact OG-CD 3.04Å; S94-V97 WeakPolarHBondContact O-CB 3.05Å; S94-V97 PolarHBondContact O-N 2.94Å; S94-V97 WeakPolarHBondContact OG-CG2 3.06Å; S94-K98 PolarHBondContact O-N 3.19Å | ||
| 95 | S | 92.5 | Very high | 94.9 | Very high | 94 Ų | 94 | 67.2 Ų | 67.2 | 66% | 0.657 | 36% | 0.361 | S | S | * | . | H | α-helix | trans | -54.1 | -40.8 | 174.5 | -50.5 | 0 | 0 | 0 | 0 | 113.6 | V97 K98 Y99 | S95-V97 VanDerWaalsContact C-N 3.3Å; S95-V97 PolarHBondContact O-N 3.3Å; S95-K98 PolarHBondContact O-N 3.14Å; S95-Y99 WeakPolarHBondContact O-CB 3.29Å; S95-Y99 PolarHBondContact O-N 3.39Å |
| 96 | P | 95.3 | Very high | 94.7 | Very high | 96 Ų | 96 | 71 Ų | 71 | 62% | 0.623 | 37% | 0.366 | S | S | * | . | H | α-helix | trans | -59.2 | -37.9 | 173.5 | -25.6 | 34.9 | 0 | 0 | 0 | 113.5 | S94 W100 | S94-P96 VanDerWaalsContact C-CD 3.47Å; S94-P96 VanDerWaalsContact C-N 3.33Å; S94-P96 WeakPolarHBondContact OG-CD 3.04Å; P96-W100 WeakPolarHBondContact O-CB 3.28Å; P96-W100 PolarHBondContact O-N 2.92Å |
| 97 | V | 94.5 | Very high | 94.6 | Very high | 36 Ų | 36 | 71.7 Ų | 71.7 | 22% | 0.218 | 36% | 0.359 | C | S | . | . | H | α-helix | trans | -69.4 | -47.1 | 178.2 | 175.8 | 0 | 0 | 0 | 0 | 110.2 | V90 F91 S94 S95 Y99 W100 V101 | V90-V97 HydrophobicContact CG1-CG2 4.21Å; F91-V97 HydrophobicContact CB-CG1 4.34Å; F91-V97 HydrophobicContact CD1-CG1 3.99Å; F91-V97 HydrophobicContact CD2-CG1 3.78Å; F91-V97 HydrophobicContact CE1-CG1 4.27Å; F91-V97 HydrophobicContact CE2-CG1 4.05Å; F91-V97 HydrophobicContact CG-CG1 3.76Å; F91-V97 HydrophobicContact CZ-CG1 4.29Å; S94-V97 WeakPolarHBondContact O-CB 3.05Å; S94-V97 PolarHBondContact O-N 2.94Å; S94-V97 WeakPolarHBondContact OG-CG2 3.06Å; S95-V97 VanDerWaalsContact C-N 3.3Å; S95-V97 PolarHBondContact O-N 3.3Å; V97-Y99 VanDerWaalsContact C-N 3.28Å; V97-Y99 PolarHBondContact O-N 2.93Å; V97-W100 PolarHBondContact O-N 3.37Å; V97-W100 VanDerWaalsContact O-N 3.1Å; V97-V101 HydrophobicContact CG1-CG1 4.28Å; V97-V101 WeakPolarHBondContact O-CG1 3.38Å; V97-V101 WeakPolarHBondContact O-CG2 3.37Å; V97-V101 PolarHBondContact O-N 2.83Å |
| 98 | K | 92.6 | Very high | 94.5 | Very high | 54 Ų | 54 | 72.1 Ų | 72.1 | 24% | 0.235 | 36% | 0.359 | C | S | . | . | H | α-helix | trans | -53.1 | -46.3 | 174.6 | -69.3 | -166 | 170.4 | 176.4 | 0 | 112 | F91 L92 S94 S95 V101 S102 | F91-K98 WeakPolarHBondContact O-CE 3.4Å; F91-K98 WeakPolarHBondContact O-CG 3.44Å; L92-K98 WeakPolarHBondContact O-CE 3.41Å; L92-K98 PolarHBondContact O-NZ 3Å; S94-K98 PolarHBondContact O-N 3.19Å; S95-K98 PolarHBondContact O-N 3.14Å; K98-V101 VanDerWaalsContact O-CG2 3.3Å; K98-V101 WeakPolarHBondContact O-CG2 3.24Å; K98-S102 WeakPolarHBondContact O-CB 3.32Å; K98-S102 PolarHBondContact O-N 3.5Å; K98-S102 VanDerWaalsContact O-N 3.17Å; K98-S102 PolarHBondContact O-OG 3.44Å |
| 99 | Y | 93.8 | Very high | 94.4 | Very high | 158 Ų | 158 | 79.2 Ų | 79.2 | 62% | 0.62 | 39% | 0.386 | S | S | * | . | H | α-helix | trans | -64.2 | -44.1 | 177.8 | -179.6 | -101 | 0 | 0 | 0 | 111.9 | S95 V97 S102 R103 | S95-Y99 WeakPolarHBondContact O-CB 3.29Å; S95-Y99 PolarHBondContact O-N 3.39Å; V97-Y99 VanDerWaalsContact C-N 3.28Å; V97-Y99 PolarHBondContact O-N 2.93Å; Y99-S102 PolarHBondContact O-N 3.41Å; Y99-R103 PolarHBondContact O-N 3.12Å; Y99-R103 VanDerWaalsContact O-N 3.11Å |
| 100 | W | 95.1 | Very high | 94.5 | Very high | 106 Ų | 106 | 80.6 Ų | 80.6 | 40% | 0.402 | 39% | 0.389 | S | S | . | . | H | α-helix | trans | -65.3 | -44.1 | -178.5 | -177.6 | 90.6 | 0 | 0 | 0 | 112.9 | P96 V97 S102 R103 N104 F107 Y148 | P96-W100 WeakPolarHBondContact O-CB 3.28Å; P96-W100 PolarHBondContact O-N 2.92Å; V97-W100 PolarHBondContact O-N 3.37Å; V97-W100 VanDerWaalsContact O-N 3.1Å; W100-S102 VanDerWaalsContact C-N 3.34Å; W100-R103 PolarHBondContact O-N 3.47Å; W100-N104 HydrophobicContact CZ2-CB 4.34Å; W100-N104 PolarHBondContact NE1-ND2 3.4Å; W100-N104 WeakPolarHBondContact O-CB 3.45Å; W100-N104 PolarHBondContact O-N 3.32Å; W100-N104 PolarHBondContact O-ND2 2.97Å; W100-F107 HydrophobicContact CH2-CB 4.28Å; W100-F107 AromaticContact CH2-CD1 3.94Å; W100-F107 HydrophobicContact CH2-CD1 3.94Å; W100-F107 AromaticContact CH2-CD2 3.34Å; W100-F107 HydrophobicContact CH2-CD2 3.34Å; W100-F107 HydrophobicContact CH2-CE1 4.04Å; W100-F107 AromaticContact CH2-CE2 3.41Å; W100-F107 HydrophobicContact CH2-CE2 3.41Å; W100-F107 VanDerWaalsContact CH2-CE2 3.41Å; W100-F107 AromaticContact CH2-CG 3.61Å; W100-F107 HydrophobicContact CH2-CG 3.61Å; W100-F107 AromaticContact CH2-CZ 3.79Å; W100-F107 HydrophobicContact CH2-CZ 3.79Å; W100-F107 AromaticContact CZ2-CD2 3.67Å; W100-F107 HydrophobicContact CZ2-CD2 3.67Å; W100-F107 AromaticContact CZ2-CE2 3.32Å; W100-F107 HydrophobicContact CZ2-CE2 3.32Å; W100-F107 HydrophobicContact CZ2-CG 4.37Å; W100-F107 AromaticContact CZ2-CZ 3.82Å; W100-F107 HydrophobicContact CZ2-CZ 3.82Å; W100-F107 HydrophobicContact CZ3-CD2 4.3Å; W100-F107 HydrophobicContact CZ3-CG 4.37Å; W100-Y148 HydrophobicContact CZ3-CE2 4.39Å; W100-Y148 WeakPolarHBondContact CZ3-OH 3.49Å |
| 101 | V | 94.1 | Very high | 94.5 | Very high | 3 Ų | 3 | 77.4 Ų | 77.4 | 2% | 0.018 | 37% | 0.37 | C | S | . | . | H | α-helix | trans | -68.3 | -34.3 | 179 | -59.9 | 0 | 0 | 0 | 0 | 112.1 | F91 V97 K98 R103 T152 | F91-V101 HydrophobicContact CD1-CG1 3.98Å; F91-V101 HydrophobicContact CE1-CG1 3.55Å; F91-V101 HydrophobicContact CZ-CG1 4.35Å; V97-V101 HydrophobicContact CG1-CG1 4.28Å; V97-V101 WeakPolarHBondContact O-CG1 3.38Å; V97-V101 WeakPolarHBondContact O-CG2 3.37Å; V97-V101 PolarHBondContact O-N 2.83Å; K98-V101 VanDerWaalsContact O-CG2 3.3Å; K98-V101 WeakPolarHBondContact O-CG2 3.24Å; V101-R103 VanDerWaalsContact C-N 3.33Å; V101-R103 PolarHBondContact O-N 2.88Å; V101-T152 HydrophobicContact CB-CG2 4.33Å |
| 102 | S | 91.4 | Very high | 94.6 | Very high | 60 Ų | 60 | 81.8 Ų | 81.8 | 42% | 0.42 | 39% | 0.387 | S | S | . | . | H | α-helix | trans | -65.8 | -36.9 | 175.4 | -60 | 0 | 0 | 0 | 0 | 111.7 | K98 Y99 W100 S105 | K98-S102 WeakPolarHBondContact O-CB 3.32Å; K98-S102 PolarHBondContact O-N 3.5Å; K98-S102 VanDerWaalsContact O-N 3.17Å; K98-S102 PolarHBondContact O-OG 3.44Å; Y99-S102 PolarHBondContact O-N 3.41Å; W100-S102 VanDerWaalsContact C-N 3.34Å; S102-S105 PolarHBondContact O-OG 2.94Å |
| 103 | R | 95 | Very high | 94.8 | Very high | 187 Ų | 187 | 83.6 Ų | 83.6 | 71% | 0.706 | 40% | 0.403 | S | S | * | . | H | α-helix | trans | -81 | -31 | 178.6 | -170.2 | 176.7 | -177.9 | -162 | 0.2 | 113.4 | Y99 W100 V101 | Y99-R103 PolarHBondContact O-N 3.12Å; Y99-R103 VanDerWaalsContact O-N 3.11Å; W100-R103 PolarHBondContact O-N 3.47Å; V101-R103 VanDerWaalsContact C-N 3.33Å; V101-R103 PolarHBondContact O-N 2.88Å |
| 104 | N | 94.8 | Very high | 95 | Very high | 41 Ų | 41 | 79.6 Ų | 79.6 | 22% | 0.219 | 39% | 0.389 | C | S | . | . | trans | -113.3 | 53.2 | -173.7 | -61.7 | -83 | 0 | 0 | 0 | 112.1 | W100 W106 F107 | W100-N104 HydrophobicContact CZ2-CB 4.34Å; W100-N104 PolarHBondContact NE1-ND2 3.4Å; W100-N104 WeakPolarHBondContact O-CB 3.45Å; W100-N104 PolarHBondContact O-N 3.32Å; W100-N104 PolarHBondContact O-ND2 2.97Å; N104-W106 PolarHBondContact O-N 2.7Å; N104-F107 HydrophobicContact CB-CD2 4.09Å; N104-F107 PolarHBondContact O-N 2.69Å; N104-F107 VanDerWaalsContact O-N 3.14Å | ||
| 105 | S | 91.1 | Very high | 95.2 | Very high | 60 Ų | 60 | 78.8 Ų | 78.8 | 42% | 0.42 | 38% | 0.381 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -59.5 | -18.1 | -176 | -43 | 0 | 0 | 0 | 0 | 114.1 | S102 F107 Y108 Y109 | S102-S105 PolarHBondContact O-OG 2.94Å; S105-F107 PolarHBondContact O-N 3.48Å; S105-Y108 VanDerWaalsContact O-CB 3.3Å; S105-Y108 WeakPolarHBondContact O-CB 3.32Å; S105-Y108 PolarHBondContact O-N 2.87Å; S105-Y109 WeakPolarHBondContact O-CD2 3.3Å |
| 106 | W | 95.1 | Very high | 95.4 | Very high | 144 Ų | 144 | 77.2 Ų | 77.2 | 55% | 0.545 | 37% | 0.365 | S | S | . | . | H | α-helix | trans | -60 | -30.1 | 176.3 | 72.8 | -95.4 | 0 | 0 | 0 | 113.3 | N104 Y108 Y109 L110 | N104-W106 PolarHBondContact O-N 2.7Å; W106-Y108 VanDerWaalsContact C-N 3.28Å; W106-Y108 PolarHBondContact O-N 3.19Å; W106-Y109 PolarHBondContact O-N 3.39Å; W106-L110 HydrophobicContact CE3-CB 4.45Å; W106-L110 HydrophobicContact CE3-CD2 4.49Å; W106-L110 HydrophobicContact CZ3-CD2 3.8Å; W106-L110 PolarHBondContact O-N 3.21Å |
| 107 | F | 95.3 | Very high | 95.5 | Very high | 66 Ų | 66 | 76.9 Ų | 76.9 | 29% | 0.289 | 36% | 0.364 | S | S | . | . | H | α-helix | trans | -64.7 | -32.8 | 174.8 | -86.4 | -90.3 | 0 | 0 | 0 | 112.3 | W100 N104 S105 L110 S111 Y148 | W100-F107 HydrophobicContact CH2-CB 4.28Å; W100-F107 AromaticContact CH2-CD1 3.94Å; W100-F107 HydrophobicContact CH2-CD1 3.94Å; W100-F107 AromaticContact CH2-CD2 3.34Å; W100-F107 HydrophobicContact CH2-CD2 3.34Å; W100-F107 HydrophobicContact CH2-CE1 4.04Å; W100-F107 AromaticContact CH2-CE2 3.41Å; W100-F107 HydrophobicContact CH2-CE2 3.41Å; W100-F107 VanDerWaalsContact CH2-CE2 3.41Å; W100-F107 AromaticContact CH2-CG 3.61Å; W100-F107 HydrophobicContact CH2-CG 3.61Å; W100-F107 AromaticContact CH2-CZ 3.79Å; W100-F107 HydrophobicContact CH2-CZ 3.79Å; W100-F107 AromaticContact CZ2-CD2 3.67Å; W100-F107 HydrophobicContact CZ2-CD2 3.67Å; W100-F107 AromaticContact CZ2-CE2 3.32Å; W100-F107 HydrophobicContact CZ2-CE2 3.32Å; W100-F107 HydrophobicContact CZ2-CG 4.37Å; W100-F107 AromaticContact CZ2-CZ 3.82Å; W100-F107 HydrophobicContact CZ2-CZ 3.82Å; W100-F107 HydrophobicContact CZ3-CD2 4.3Å; W100-F107 HydrophobicContact CZ3-CG 4.37Å; N104-F107 HydrophobicContact CB-CD2 4.09Å; N104-F107 PolarHBondContact O-N 2.69Å; N104-F107 VanDerWaalsContact O-N 3.14Å; S105-F107 PolarHBondContact O-N 3.48Å; F107-L110 PolarHBondContact O-N 3.03Å; F107-S111 VanDerWaalsContact O-CB 3.31Å; F107-S111 WeakPolarHBondContact O-CB 3.15Å; F107-S111 PolarHBondContact O-N 2.78Å; F107-Y148 HydrophobicContact CB-CE1 4.11Å; F107-Y148 WeakPolarHBondContact CB-OH 3.36Å |
| 108 | Y | 96 | Very high | 95.7 | Very high | 62 Ų | 62 | 76.1 Ų | 76.1 | 24% | 0.243 | 36% | 0.359 | C | S | . | . | H | α-helix | trans | -62 | -46.8 | 173.9 | 175.8 | -95.9 | 0 | 0 | 0 | 110.9 | S105 W106 S111 Y112 M149 T152 I153 | S105-Y108 VanDerWaalsContact O-CB 3.3Å; S105-Y108 WeakPolarHBondContact O-CB 3.32Å; S105-Y108 PolarHBondContact O-N 2.87Å; W106-Y108 VanDerWaalsContact C-N 3.28Å; W106-Y108 PolarHBondContact O-N 3.19Å; Y108-S111 WeakPolarHBondContact O-CB 3.39Å; Y108-S111 PolarHBondContact O-N 3.16Å; Y108-Y112 WeakPolarHBondContact O-CB 3.46Å; Y108-Y112 PolarHBondContact O-N 2.88Å; Y108-M149 HydrophobicContact CD2-CB 4.47Å; Y108-M149 HydrophobicContact CD2-CG 4.28Å; Y108-M149 HydrophobicContact CE2-CB 4.04Å; Y108-M149 HydrophobicContact CE2-CG 4.06Å; Y108-T152 HydrophobicContact CD2-CG2 3.88Å; Y108-T152 HydrophobicContact CG-CG2 4.45Å; Y108-I153 HydrophobicContact CE2-CD1 4.23Å; Y108-I153 HydrophobicContact CE2-CG1 3.99Å |
| 109 | Y | 96.5 | Very high | 95.9 | Very high | 163 Ų | 163 | 76.9 Ų | 76.9 | 64% | 0.639 | 36% | 0.361 | S | S | * | . | H | α-helix | trans | -66.9 | -36.5 | 177.7 | -62 | -65.9 | 0 | 0 | 0 | 112.8 | S105 W106 Y112 A113 | S105-Y109 WeakPolarHBondContact O-CD2 3.3Å; W106-Y109 PolarHBondContact O-N 3.39Å; Y109-Y112 WeakPolarHBondContact O-CB 3.28Å; Y109-Y112 PolarHBondContact O-N 2.89Å; Y109-A113 PolarHBondContact O-N 3.38Å |
| 110 | L | 97.3 | Very high | 96 | Very high | 90 Ų | 90 | 73.8 Ų | 73.8 | 47% | 0.471 | 36% | 0.355 | S | S | . | . | H | α-helix | trans | -63.3 | -42.9 | 172.6 | 178.1 | 62 | 0 | 0 | 0 | 111.5 | W106 F107 Y112 A113 T114 | W106-L110 HydrophobicContact CE3-CB 4.45Å; W106-L110 HydrophobicContact CE3-CD2 4.49Å; W106-L110 HydrophobicContact CZ3-CD2 3.8Å; W106-L110 PolarHBondContact O-N 3.21Å; F107-L110 PolarHBondContact O-N 3.03Å; L110-Y112 VanDerWaalsContact C-N 3.33Å; L110-A113 PolarHBondContact O-N 3.49Å; L110-T114 WeakPolarHBondContact O-CB 3.36Å; L110-T114 PolarHBondContact O-N 2.97Å; L110-T114 PolarHBondContact O-OG1 3.43Å |
| 111 | S | 97.7 | Very high | 96.1 | Very high | 12 Ų | 12 | 70.2 Ų | 70.2 | 8% | 0.084 | 35% | 0.348 | C | S | . | . | H | α-helix | trans | -63.4 | -41 | 175.5 | -159.4 | 0 | 0 | 0 | 0 | 111.3 | F107 Y108 T114 F115 A145 Y148 | F107-S111 VanDerWaalsContact O-CB 3.31Å; F107-S111 WeakPolarHBondContact O-CB 3.15Å; F107-S111 PolarHBondContact O-N 2.78Å; Y108-S111 WeakPolarHBondContact O-CB 3.39Å; Y108-S111 PolarHBondContact O-N 3.16Å; S111-T114 PolarHBondContact O-N 3.43Å; S111-F115 VanDerWaalsContact O-CB 3.29Å; S111-F115 WeakPolarHBondContact O-CB 3.4Å; S111-F115 PolarHBondContact O-N 3.29Å; S111-A145 WeakPolarHBondContact OG-CA 3.35Å; S111-A145 PolarHBondContact OG-O 3.29Å; S111-Y148 WeakPolarHBondContact OG-CD1 3.42Å |
| 112 | Y | 97.1 | Very high | 96.2 | Very high | 106 Ų | 106 | 70.1 Ų | 70.1 | 42% | 0.416 | 35% | 0.347 | S | S | . | . | H | α-helix | trans | -60.9 | -46.2 | 174.9 | -172 | -96.9 | 0 | 0 | 0 | 112.4 | Y108 Y109 L110 T114 F115 L116 M149 | Y108-Y112 WeakPolarHBondContact O-CB 3.46Å; Y108-Y112 PolarHBondContact O-N 2.88Å; Y109-Y112 WeakPolarHBondContact O-CB 3.28Å; Y109-Y112 PolarHBondContact O-N 2.89Å; L110-Y112 VanDerWaalsContact C-N 3.33Å; Y112-T114 PolarHBondContact O-N 3.45Å; Y112-F115 WeakPolarHBondContact O-CB 3.27Å; Y112-F115 PolarHBondContact O-N 3.24Å; Y112-L116 HydrophobicContact CD1-CD1 3.86Å; Y112-L116 HydrophobicContact CD1-CG 4.38Å; Y112-L116 HydrophobicContact CE1-CD1 3.3Å; Y112-L116 HydrophobicContact CE1-CG 4.02Å; Y112-L116 PolarHBondContact O-N 2.97Å; Y112-M149 VanDerWaalsContact CA-SD 3.59Å; Y112-M149 HydrophobicContact CD2-CE 3.49Å; Y112-M149 VanDerWaalsContact CD2-CE 3.49Å; Y112-M149 HydrophobicContact CD2-SD 4.12Å; Y112-M149 HydrophobicContact CE2-CE 4.15Å; Y112-M149 HydrophobicContact CG-CE 4.49Å |
| 113 | A | 97.9 | Very high | 96.4 | Very high | 47 Ų | 47 | 69.3 Ų | 69.3 | 39% | 0.388 | 34% | 0.34 | S | S | . | . | H | α-helix | trans | -62.2 | -42.9 | 175.4 | 0 | 0 | 0 | 0 | 0 | 111.8 | Y109 L110 L116 C117 | Y109-A113 PolarHBondContact O-N 3.38Å; L110-A113 PolarHBondContact O-N 3.49Å; A113-L116 PolarHBondContact O-N 2.96Å; A113-C117 WeakPolarHBondContact O-CB 3.45Å; A113-C117 PolarHBondContact O-N 3.45Å; A113-C117 PolarHBondContact O-SG 2.88Å |
| 114 | T | 98.1 | Very high | 96.4 | Very high | 48 Ų | 48 | 64.6 Ų | 64.6 | 29% | 0.294 | 33% | 0.334 | S | S | . | . | H | α-helix | trans | -62.5 | -45.2 | 176.8 | -56.4 | 0 | 0 | 0 | 0 | 111.4 | L110 S111 Y112 C117 T118 V141 A145 | L110-T114 WeakPolarHBondContact O-CB 3.36Å; L110-T114 PolarHBondContact O-N 2.97Å; L110-T114 PolarHBondContact O-OG1 3.43Å; S111-T114 PolarHBondContact O-N 3.43Å; Y112-T114 PolarHBondContact O-N 3.45Å; T114-C117 PolarHBondContact O-N 2.9Å; T114-T118 HydrophobicContact CG2-CG2 4.47Å; T114-T118 WeakPolarHBondContact O-CB 3.25Å; T114-T118 WeakPolarHBondContact O-CG2 3.37Å; T114-T118 PolarHBondContact O-N 2.82Å; T114-T118 PolarHBondContact O-OG1 3.48Å; T114-V141 HydrophobicContact CG2-CG1 3.61Å; T114-A145 HydrophobicContact CG2-CB 3.99Å |
| 115 | F | 98 | Very high | 96.4 | Very high | 22 Ų | 22 | 65.1 Ų | 65.1 | 10% | 0.096 | 34% | 0.34 | C | S | . | . | H | α-helix | trans | -56.2 | -51.3 | 174.4 | 163.2 | -97.5 | 0 | 0 | 0 | 111.3 | S111 Y112 T118 Y119 F142 A145 F146 M149 L266 | S111-F115 VanDerWaalsContact O-CB 3.29Å; S111-F115 WeakPolarHBondContact O-CB 3.4Å; S111-F115 PolarHBondContact O-N 3.29Å; Y112-F115 WeakPolarHBondContact O-CB 3.27Å; Y112-F115 PolarHBondContact O-N 3.24Å; F115-T118 PolarHBondContact O-N 2.9Å; F115-T118 PolarHBondContact O-OG1 2.78Å; F115-T118 VanDerWaalsContact O-OG1 3.12Å; F115-Y119 WeakPolarHBondContact O-CB 3.31Å; F115-Y119 PolarHBondContact O-N 3.33Å; F115-F142 AromaticContact CD2-CD2 3.88Å; F115-F142 HydrophobicContact CD2-CD2 3.88Å; F115-F142 AromaticContact CD2-CE2 3.39Å; F115-F142 HydrophobicContact CD2-CE2 3.39Å; F115-F142 HydrophobicContact CD2-CZ 4.06Å; F115-F142 HydrophobicContact CE2-CD2 4.17Å; F115-F142 AromaticContact CE2-CE2 3.22Å; F115-F142 HydrophobicContact CE2-CE2 3.22Å; F115-F142 AromaticContact CE2-CZ 3.61Å; F115-F142 HydrophobicContact CE2-CZ 3.61Å; F115-F142 HydrophobicContact CG-CE2 4.49Å; F115-F142 HydrophobicContact CZ-CE2 4.19Å; F115-A145 HydrophobicContact CB-CB 4.15Å; F115-F146 HydrophobicContact CD2-CB 3.75Å; F115-F146 HydrophobicContact CD2-CD2 4.07Å; F115-F146 AromaticContact CD2-CG 3.89Å; F115-F146 HydrophobicContact CD2-CG 3.89Å; F115-F146 HydrophobicContact CE2-CB 4.05Å; F115-F146 AromaticContact CE2-CD1 3.96Å; F115-F146 HydrophobicContact CE2-CD1 3.96Å; F115-F146 AromaticContact CE2-CD2 3.86Å; F115-F146 HydrophobicContact CE2-CD2 3.86Å; F115-F146 HydrophobicContact CE2-CE1 4.4Å; F115-F146 HydrophobicContact CE2-CE2 4.3Å; F115-F146 AromaticContact CE2-CG 3.69Å; F115-F146 HydrophobicContact CE2-CG 3.69Å; F115-F146 HydrophobicContact CZ-CD2 4.5Å; F115-M149 HydrophobicContact CB-SD 3.79Å; F115-M149 HydrophobicContact CD1-CE 4.48Å; F115-M149 HydrophobicContact CD1-SD 4.38Å; F115-M149 HydrophobicContact CG-SD 4.05Å; F115-L266 HydrophobicContact CE2-CD2 3.79Å; F115-L266 HydrophobicContact CZ-CD2 3.79Å |
| 116 | L | 97.2 | Very high | 96.5 | Very high | 61 Ų | 61 | 65.1 Ų | 65.1 | 32% | 0.319 | 34% | 0.339 | S | S | . | . | H | α-helix | trans | -62.9 | -47.9 | 179.9 | -76.1 | -179.7 | 0 | 0 | 0 | 112.4 | Y112 A113 T118 Y119 I120 | Y112-L116 HydrophobicContact CD1-CD1 3.86Å; Y112-L116 HydrophobicContact CD1-CG 4.38Å; Y112-L116 HydrophobicContact CE1-CD1 3.3Å; Y112-L116 HydrophobicContact CE1-CG 4.02Å; Y112-L116 PolarHBondContact O-N 2.97Å; A113-L116 PolarHBondContact O-N 2.96Å; L116-T118 PolarHBondContact O-N 3.37Å; L116-Y119 PolarHBondContact O-N 2.84Å; L116-I120 WeakPolarHBondContact O-CB 3.27Å; L116-I120 VanDerWaalsContact O-CG1 3.24Å; L116-I120 WeakPolarHBondContact O-CG1 3.45Å; L116-I120 PolarHBondContact O-N 2.86Å |
| 117 | C | 97.7 | Very high | 96.3 | Very high | 88 Ų | 88 | 63 Ų | 63 | 60% | 0.595 | 35% | 0.346 | S | S | * | . | H | α-helix | trans | -60.7 | -44.9 | 179.9 | -72 | 0 | 0 | 0 | 0 | 111.8 | A113 T114 A121 | A113-C117 WeakPolarHBondContact O-CB 3.45Å; A113-C117 PolarHBondContact O-N 3.45Å; A113-C117 PolarHBondContact O-SG 2.88Å; T114-C117 PolarHBondContact O-N 2.9Å; C117-A121 WeakPolarHBondContact O-CB 3.46Å; C117-A121 PolarHBondContact O-N 3.32Å |
| 118 | T | 97.4 | Very high | 96.1 | Very high | 21 Ų | 21 | 62.3 Ų | 62.3 | 13% | 0.129 | 35% | 0.347 | C | S | . | . | H | α-helix | trans | -71.7 | -36.7 | 179.1 | 52.6 | 0 | 0 | 0 | 0 | 112.6 | T114 F115 L116 A121 L122 V141 F142 | T114-T118 HydrophobicContact CG2-CG2 4.47Å; T114-T118 WeakPolarHBondContact O-CB 3.25Å; T114-T118 WeakPolarHBondContact O-CG2 3.37Å; T114-T118 PolarHBondContact O-N 2.82Å; T114-T118 PolarHBondContact O-OG1 3.48Å; F115-T118 PolarHBondContact O-N 2.9Å; F115-T118 PolarHBondContact O-OG1 2.78Å; F115-T118 VanDerWaalsContact O-OG1 3.12Å; L116-T118 PolarHBondContact O-N 3.37Å; T118-A121 PolarHBondContact O-N 2.94Å; T118-L122 WeakPolarHBondContact O-CB 3.31Å; T118-L122 WeakPolarHBondContact O-CG 3.35Å; T118-L122 PolarHBondContact O-N 3.44Å; T118-V141 HydrophobicContact CG2-CB 4.16Å; T118-V141 HydrophobicContact CG2-CG1 3.71Å; T118-F142 WeakPolarHBondContact OG1-CA 3.5Å; T118-F142 WeakPolarHBondContact OG1-CB 3.39Å |
| 119 | Y | 97.4 | Very high | 96.1 | Very high | 69 Ų | 69 | 60.3 Ų | 60.3 | 27% | 0.271 | 34% | 0.339 | S | S | . | . | H | α-helix | trans | -59.4 | -52.3 | 172.6 | 176.9 | -112.6 | 0 | 0 | 0 | 111.4 | F115 L116 A121 L122 V123 F142 L262 L266 | F115-Y119 WeakPolarHBondContact O-CB 3.31Å; F115-Y119 PolarHBondContact O-N 3.33Å; L116-Y119 PolarHBondContact O-N 2.84Å; Y119-A121 VanDerWaalsContact C-N 3.32Å; Y119-A121 PolarHBondContact O-N 3.43Å; Y119-L122 PolarHBondContact O-N 3.39Å; Y119-V123 HydrophobicContact CD2-CG2 3.87Å; Y119-V123 HydrophobicContact CE1-CG2 4.26Å; Y119-V123 HydrophobicContact CE2-CG2 3.45Å; Y119-V123 VanDerWaalsContact CE2-CG2 3.45Å; Y119-V123 HydrophobicContact CG-CG2 4.43Å; Y119-V123 WeakPolarHBondContact O-CB 3.13Å; Y119-V123 WeakPolarHBondContact O-CG2 3.36Å; Y119-V123 PolarHBondContact O-N 2.85Å; Y119-F142 HydrophobicContact CD2-CE2 4.05Å; Y119-F142 HydrophobicContact CG-CE2 4.39Å; Y119-L262 HydrophobicContact CD2-CD1 4.34Å; Y119-L262 HydrophobicContact CD2-CD2 4.24Å; Y119-L262 HydrophobicContact CE2-CD2 4.37Å; Y119-L266 HydrophobicContact CD2-CD1 3.75Å; Y119-L266 HydrophobicContact CE2-CD1 3.25Å |
| 120 | I | 96.9 | Very high | 95.9 | Very high | 94 Ų | 94 | 58.4 Ų | 58.4 | 48% | 0.482 | 33% | 0.331 | S | S | . | . | H | α-helix | trans | -59.2 | -44.6 | 178.1 | -66.9 | 165.9 | 0 | 0 | 0 | 110.3 | L116 L122 V123 C124 | L116-I120 WeakPolarHBondContact O-CB 3.27Å; L116-I120 VanDerWaalsContact O-CG1 3.24Å; L116-I120 WeakPolarHBondContact O-CG1 3.45Å; L116-I120 PolarHBondContact O-N 2.86Å; I120-L122 PolarHBondContact O-N 3.3Å; I120-V123 PolarHBondContact O-N 3.02Å; I120-C124 VanDerWaalsContact O-CB 3.23Å; I120-C124 WeakPolarHBondContact O-CB 3.47Å; I120-C124 PolarHBondContact O-N 2.88Å |
| 121 | A | 96.2 | Very high | 95.7 | Very high | 31 Ų | 31 | 63.3 Ų | 63.3 | 26% | 0.256 | 34% | 0.343 | S | S | . | . | H | α-helix | trans | -60.7 | -43.4 | 177 | 0 | 0 | 0 | 0 | 0 | 112.4 | C117 T118 Y119 C125 | C117-A121 WeakPolarHBondContact O-CB 3.46Å; C117-A121 PolarHBondContact O-N 3.32Å; T118-A121 PolarHBondContact O-N 2.94Å; Y119-A121 VanDerWaalsContact C-N 3.32Å; Y119-A121 PolarHBondContact O-N 3.43Å; A121-C125 WeakPolarHBondContact O-CA 3.28Å; A121-C125 WeakPolarHBondContact O-CB 3.18Å; A121-C125 PolarHBondContact O-N 3.39Å; A121-C125 VanDerWaalsContact O-N 3.07Å |
| 122 | L | 96.7 | Very high | 95.4 | Very high | 0 Ų | 0 | 70.9 Ų | 70.9 | 0% | 0 | 37% | 0.371 | C | S | . | . | H | α-helix | trans | -70 | -37.6 | 179 | -74.4 | 169.3 | 0 | 0 | 0 | 112.4 | T118 Y119 I120 R129 A138 L139 F142 I258 L262 | T118-L122 WeakPolarHBondContact O-CB 3.31Å; T118-L122 WeakPolarHBondContact O-CG 3.35Å; T118-L122 PolarHBondContact O-N 3.44Å; Y119-L122 PolarHBondContact O-N 3.39Å; I120-L122 PolarHBondContact O-N 3.3Å; L122-R129 HydrophobicContact CD2-CB 4.44Å; L122-R129 HydrophobicContact CD2-CG 4.5Å; L122-R129 VanDerWaalsContact O-CD 3.27Å; L122-R129 WeakPolarHBondContact O-CD 3.4Å; L122-R129 PolarHBondContact O-NH1 2.93Å; L122-A138 HydrophobicContact CD2-CB 3.75Å; L122-A138 HydrophobicContact CG-CB 4.16Å; L122-L139 HydrophobicContact CD1-CD1 4.22Å; L122-F142 HydrophobicContact CD1-CB 3.99Å; L122-F142 HydrophobicContact CD1-CG 4.22Å; L122-I258 HydrophobicContact CD2-CG2 3.94Å; L122-L262 HydrophobicContact CB-CD2 3.78Å; L122-L262 HydrophobicContact CD1-CD1 4.27Å; L122-L262 HydrophobicContact CD1-CD2 4.3Å |
| 123 | V | 95.7 | Very high | 95.2 | Very high | 44 Ų | 44 | 69.1 Ų | 69.1 | 27% | 0.267 | 37% | 0.373 | S | S | . | . | H | α-helix | trans | -76.6 | -47.4 | -179.2 | 173.4 | 0 | 0 | 0 | 0 | 111.5 | Y119 I120 R129 F259 L262 | Y119-V123 HydrophobicContact CD2-CG2 3.87Å; Y119-V123 HydrophobicContact CE1-CG2 4.26Å; Y119-V123 HydrophobicContact CE2-CG2 3.45Å; Y119-V123 VanDerWaalsContact CE2-CG2 3.45Å; Y119-V123 HydrophobicContact CG-CG2 4.43Å; Y119-V123 WeakPolarHBondContact O-CB 3.13Å; Y119-V123 WeakPolarHBondContact O-CG2 3.36Å; Y119-V123 PolarHBondContact O-N 2.85Å; I120-V123 PolarHBondContact O-N 3.02Å; V123-R129 PolarHBondContact O-NH1 3.41Å; V123-R129 VanDerWaalsContact O-NH1 3.08Å; V123-F259 HydrophobicContact CG1-CE2 4.43Å; V123-F259 HydrophobicContact CG2-CE2 4.28Å; V123-L262 HydrophobicContact CG2-CD2 4Å |
| 124 | C | 95.1 | Very high | 95 | Very high | 87 Ų | 87 | 68.4 Ų | 68.4 | 59% | 0.588 | 37% | 0.37 | S | S | * | . | H | α-helix | trans | -92.3 | -16.8 | -169.8 | -58.9 | 0 | 0 | 0 | 0 | 114.4 | I120 P126 | I120-C124 VanDerWaalsContact O-CB 3.23Å; I120-C124 WeakPolarHBondContact O-CB 3.47Å; I120-C124 PolarHBondContact O-N 2.88Å; C124-P126 VanDerWaalsContact O-CD 3.28Å; C124-P126 WeakPolarHBondContact O-CD 3.35Å |
| 125 | C | 94.8 | Very high | 94.8 | Very high | 52 Ų | 52 | 66.2 Ų | 66.2 | 35% | 0.351 | 36% | 0.356 | S | S | . | . | trans | -115.6 | 90.2 | -177.2 | -51.7 | 0 | 0 | 0 | 0 | 111.6 | A121 S127 V128 R129 | A121-C125 WeakPolarHBondContact O-CA 3.28Å; A121-C125 WeakPolarHBondContact O-CB 3.18Å; A121-C125 PolarHBondContact O-N 3.39Å; A121-C125 VanDerWaalsContact O-N 3.07Å; C125-S127 PolarHBondContact O-N 2.83Å; C125-S127 VanDerWaalsContact O-N 3.12Å; C125-V128 HydrophobicContact CB-CB 4.14Å; C125-V128 HydrophobicContact CB-CG2 3.78Å; C125-V128 PolarHBondContact O-N 3.47Å; C125-R129 PolarHBondContact O-N 3.46Å | ||
| 126 | P | 92.2 | Very high | 94.7 | Very high | 61 Ų | 61 | 68.1 Ų | 68.1 | 40% | 0.396 | 37% | 0.369 | S | S | . | . | H | α-helix | trans | -53.9 | -33.6 | 176.3 | -27.2 | 34.4 | 0 | 0 | 0 | 113.4 | C124 V128 R129 R130 | C124-P126 VanDerWaalsContact O-CD 3.28Å; C124-P126 WeakPolarHBondContact O-CD 3.35Å; P126-V128 VanDerWaalsContact C-N 3.28Å; P126-V128 PolarHBondContact O-N 2.7Å; P126-R129 PolarHBondContact O-N 3.33Å; P126-R130 VanDerWaalsContact O-CB 3.29Å; P126-R130 WeakPolarHBondContact O-CB 3.38Å; P126-R130 WeakPolarHBondContact O-CG 3.48Å; P126-R130 PolarHBondContact O-N 2.98Å |
| 127 | S | 91.7 | Very high | 94.7 | Very high | 98 Ų | 98 | 70 Ų | 70 | 69% | 0.685 | 38% | 0.379 | S | S | * | . | H | α-helix | trans | -61.6 | -34 | 176.9 | -50.6 | 0 | 0 | 0 | 0 | 113.2 | C125 R131 | C125-S127 PolarHBondContact O-N 2.83Å; C125-S127 VanDerWaalsContact O-N 3.12Å; S127-R131 WeakPolarHBondContact O-CB 3.49Å |
| 128 | V | 91.9 | Very high | 94.7 | Very high | 53 Ų | 53 | 66.6 Ų | 66.6 | 32% | 0.321 | 36% | 0.357 | S | S | . | . | H | α-helix | trans | -75.7 | -45.3 | 176 | 177.3 | 0 | 0 | 0 | 0 | 109.8 | C125 P126 N135 A138 | C125-V128 HydrophobicContact CB-CB 4.14Å; C125-V128 HydrophobicContact CB-CG2 3.78Å; C125-V128 PolarHBondContact O-N 3.47Å; P126-V128 VanDerWaalsContact C-N 3.28Å; P126-V128 PolarHBondContact O-N 2.7Å; V128-N135 VanDerWaalsContact O-CA 3.23Å; V128-N135 WeakPolarHBondContact O-CA 3.23Å; V128-N135 VanDerWaalsContact O-CB 3.25Å; V128-N135 WeakPolarHBondContact O-CB 3.3Å; V128-N135 PolarHBondContact O-N 2.89Å; V128-A138 HydrophobicContact CG1-CB 3.87Å |
| 129 | R | 94.7 | Very high | 94.7 | Very high | 19 Ų | 19 | 66.1 Ų | 66.1 | 7% | 0.072 | 35% | 0.353 | C | S | . | . | H | α-helix | trans | -74.4 | -31.8 | -173.7 | -172.4 | 173.8 | 66.8 | -140.6 | 10.3 | 114.4 | L122 V123 C125 P126 N135 E256 I258 | L122-R129 HydrophobicContact CD2-CB 4.44Å; L122-R129 HydrophobicContact CD2-CG 4.5Å; L122-R129 VanDerWaalsContact O-CD 3.27Å; L122-R129 WeakPolarHBondContact O-CD 3.4Å; L122-R129 PolarHBondContact O-NH1 2.93Å; V123-R129 PolarHBondContact O-NH1 3.41Å; V123-R129 VanDerWaalsContact O-NH1 3.08Å; C125-R129 PolarHBondContact O-N 3.46Å; P126-R129 PolarHBondContact O-N 3.33Å; R129-N135 WeakPolarHBondContact O-CB 3.35Å; R129-N135 PolarHBondContact O-ND2 2.84Å; R129-E256 IonicContact CZ-OE1 3.85Å; R129-E256 IonicContact CZ-OE2 3.13Å; R129-E256 IonicContact NE-OE1 3.95Å; R129-E256 IonicContact NE-OE2 2.66Å; R129-E256 PolarHBondContact NE-OE2 3.41Å; R129-E256 IonicContact NH2-OE1 2.88Å; R129-E256 PolarHBondContact NH2-OE1 2.88Å; R129-E256 IonicContact NH2-OE2 2.87Å; R129-E256 PolarHBondContact NH2-OE2 2.92Å; R129-I258 HydrophobicContact CG-CB 3.71Å; R129-I258 HydrophobicContact CG-CG2 3.69Å |
| 130 | R | 92.8 | Very high | 94.7 | Very high | 124 Ų | 124 | 65.6 Ų | 65.6 | 47% | 0.468 | 36% | 0.36 | S | S | . | . | H | α-helix | trans | -94.8 | -15.6 | -176.1 | -62 | -175 | -175.3 | 179.3 | 3.4 | 114 | P126 E255 E256 | P126-R130 VanDerWaalsContact O-CB 3.29Å; P126-R130 WeakPolarHBondContact O-CB 3.38Å; P126-R130 WeakPolarHBondContact O-CG 3.48Å; P126-R130 PolarHBondContact O-N 2.98Å; R130-E255 IonicContact NH1-OE2 3.87Å; R130-E256 IonicContact CZ-OE1 3.12Å; R130-E256 IonicContact NE-OE1 2.8Å; R130-E256 PolarHBondContact NE-OE1 3.28Å; R130-E256 IonicContact NH2-OE1 2.66Å; R130-E256 PolarHBondContact NH2-OE1 3.24Å |
| 131 | R | 92.5 | Very high | 94.8 | Very high | 193 Ų | 193 | 64 Ų | 64 | 73% | 0.728 | 35% | 0.354 | S | S | * | . | S | Bend | trans | -98.9 | 123.2 | -175.4 | -167.7 | 172.8 | -177.6 | 169.5 | 1.2 | 112.9 | S127 G134 N135 | S127-R131 WeakPolarHBondContact O-CB 3.49Å; R131-G134 PolarHBondContact O-N 3.06Å; R131-G134 VanDerWaalsContact O-N 3.14Å; R131-N135 PolarHBondContact O-N 3.25Å; R131-N135 PolarHBondContact O-OD1 2.87Å |
| 132 | Y | 91.4 | Very high | 94.9 | Very high | 171 Ų | 171 | 62.5 Ų | 62.5 | 67% | 0.671 | 34% | 0.342 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -80.2 | 143.4 | 171.3 | -173.1 | -92.3 | 0 | 0 | 0 | 111.4 | N135 V136 | Y132-N135 WeakPolarHBondContact CA-OD1 3.26Å; Y132-V136 HydrophobicContact CD2-CG2 4.03Å; Y132-V136 HydrophobicContact CE2-CG2 3.91Å |
| 133 | P | 93.5 | Very high | 95 | Very high | 69 Ų | 69 | 62.9 Ų | 62.9 | 45% | 0.448 | 35% | 0.345 | S | S | . | . | T | Hydrogen-bonded Turn | cis | -87.7 | 0.4 | -2.9 | 35.4 | -35.7 | 0 | 0 | 0 | 114.4 | N135 V136 I137 | P133-N135 PolarHBondContact O-N 3.38Å; P133-V136 PolarHBondContact O-N 3.28Å; P133-V136 VanDerWaalsContact O-N 3.14Å; P133-I137 HydrophobicContact CB-CD1 4.43Å; P133-I137 HydrophobicContact CG-CD1 4.39Å; P133-I137 WeakPolarHBondContact O-CG1 3.42Å; P133-I137 PolarHBondContact O-N 3.44Å; P133-I137 VanDerWaalsContact O-N 3.13Å |
| 134 | G | 92.8 | Very high | 95.1 | Very high | 32 Ų | 32 | 65 Ų | 65 | 33% | 0.33 | 35% | 0.354 | S | S | . | . | H | α-helix | trans | -57.3 | -35.9 | -173.7 | 0 | 0 | 0 | 0 | 0 | 113.7 | R131 I137 A138 | R131-G134 PolarHBondContact O-N 3.06Å; R131-G134 VanDerWaalsContact O-N 3.14Å; G134-I137 PolarHBondContact O-N 3.46Å; G134-A138 WeakPolarHBondContact O-CB 3.14Å; G134-A138 PolarHBondContact O-N 2.88Å |
| 135 | N | 95.4 | Very high | 95.3 | Very high | 1 Ų | 1 | 61.1 Ų | 61.1 | 1% | 0.005 | 33% | 0.328 | C | S | . | . | H | α-helix | trans | -63.9 | -42.8 | 177.4 | 63.8 | -9.7 | 0 | 0 | 0 | 113.8 | V128 R129 R131 Y132 P133 L139 Y257 I258 | V128-N135 VanDerWaalsContact O-CA 3.23Å; V128-N135 WeakPolarHBondContact O-CA 3.23Å; V128-N135 VanDerWaalsContact O-CB 3.25Å; V128-N135 WeakPolarHBondContact O-CB 3.3Å; V128-N135 PolarHBondContact O-N 2.89Å; R129-N135 WeakPolarHBondContact O-CB 3.35Å; R129-N135 PolarHBondContact O-ND2 2.84Å; R131-N135 PolarHBondContact O-N 3.25Å; R131-N135 PolarHBondContact O-OD1 2.87Å; Y132-N135 WeakPolarHBondContact CA-OD1 3.26Å; P133-N135 PolarHBondContact O-N 3.38Å; N135-L139 VanDerWaalsContact O-CB 3.29Å; N135-L139 WeakPolarHBondContact O-CB 3.21Å; N135-L139 PolarHBondContact O-N 2.84Å; N135-Y257 PolarHBondContact ND2-OH 3.11Å; N135-I258 HydrophobicContact CB-CD1 4.39Å; N135-I258 HydrophobicContact CB-CG1 4.03Å |
| 136 | V | 95.4 | Very high | 95.4 | Very high | 62 Ų | 62 | 58.9 Ų | 58.9 | 38% | 0.376 | 31% | 0.313 | S | S | . | . | H | α-helix | trans | -66.6 | -44.5 | 176.3 | 178 | 0 | 0 | 0 | 0 | 110 | Y132 P133 A138 L139 S140 | Y132-V136 HydrophobicContact CD2-CG2 4.03Å; Y132-V136 HydrophobicContact CE2-CG2 3.91Å; P133-V136 PolarHBondContact O-N 3.28Å; P133-V136 VanDerWaalsContact O-N 3.14Å; V136-A138 PolarHBondContact O-N 3.07Å; V136-L139 PolarHBondContact O-N 3.45Å; V136-S140 WeakPolarHBondContact O-CB 3.48Å; V136-S140 PolarHBondContact O-N 3.38Å; V136-S140 PolarHBondContact O-OG 3.1Å |
| 137 | I | 96.4 | Very high | 95.7 | Very high | 102 Ų | 102 | 56 Ų | 56 | 52% | 0.523 | 29% | 0.294 | S | S | . | . | H | α-helix | trans | -60.2 | -50.1 | 178.6 | -64.2 | 167.6 | 0 | 0 | 0 | 110.5 | P133 G134 L139 S140 V141 | P133-I137 HydrophobicContact CB-CD1 4.43Å; P133-I137 HydrophobicContact CG-CD1 4.39Å; P133-I137 WeakPolarHBondContact O-CG1 3.42Å; P133-I137 PolarHBondContact O-N 3.44Å; P133-I137 VanDerWaalsContact O-N 3.13Å; G134-I137 PolarHBondContact O-N 3.46Å; I137-L139 PolarHBondContact O-N 2.63Å; I137-S140 PolarHBondContact O-N 3.1Å; I137-V141 WeakPolarHBondContact O-CG2 3.23Å; I137-V141 PolarHBondContact O-N 3.43Å |
| 138 | A | 97.2 | Very high | 96.1 | Very high | 15 Ų | 15 | 52.9 Ų | 52.9 | 12% | 0.124 | 27% | 0.267 | C | S | . | . | H | α-helix | trans | -61.1 | -43.8 | 179.3 | 0 | 0 | 0 | 0 | 0 | 111.9 | L122 V128 G134 V136 V141 F142 | L122-A138 HydrophobicContact CD2-CB 3.75Å; L122-A138 HydrophobicContact CG-CB 4.16Å; V128-A138 HydrophobicContact CG1-CB 3.87Å; G134-A138 WeakPolarHBondContact O-CB 3.14Å; G134-A138 PolarHBondContact O-N 2.88Å; V136-A138 PolarHBondContact O-N 3.07Å; A138-V141 PolarHBondContact O-N 2.88Å; A138-F142 WeakPolarHBondContact O-CB 3.41Å; A138-F142 PolarHBondContact O-N 3.4Å |
| 139 | L | 97.9 | Very high | 96.3 | Very high | 11 Ų | 11 | 50.8 Ų | 50.8 | 6% | 0.058 | 25% | 0.254 | C | S | . | . | H | α-helix | trans | -64.4 | -39.1 | 176.4 | -172.6 | 68.1 | 0 | 0 | 0 | 112.2 | I76 L122 N135 V136 I137 F142 T143 I258 L262 | I76-L139 HydrophobicContact CG2-CD2 3.43Å; I76-L139 VanDerWaalsContact CG2-CD2 3.43Å; L122-L139 HydrophobicContact CD1-CD1 4.22Å; N135-L139 VanDerWaalsContact O-CB 3.29Å; N135-L139 WeakPolarHBondContact O-CB 3.21Å; N135-L139 PolarHBondContact O-N 2.84Å; V136-L139 PolarHBondContact O-N 3.45Å; I137-L139 PolarHBondContact O-N 2.63Å; L139-F142 HydrophobicContact CD1-CD1 4.3Å; L139-F142 PolarHBondContact O-N 2.91Å; L139-T143 WeakPolarHBondContact O-CB 3.44Å; L139-T143 PolarHBondContact O-N 3.22Å; L139-T143 PolarHBondContact O-OG1 3.37Å; L139-I258 HydrophobicContact CB-CD1 4.49Å; L139-I258 HydrophobicContact CB-CG2 4.34Å; L139-I258 HydrophobicContact CD1-CG2 4.22Å; L139-I258 HydrophobicContact CD2-CD1 3.74Å; L139-I258 HydrophobicContact CD2-CG2 4.32Å; L139-L262 HydrophobicContact CD1-CB 4.38Å; L139-L262 HydrophobicContact CD1-CD1 4.42Å |
| 140 | S | 97.9 | Very high | 96.5 | Very high | 58 Ų | 58 | 49.9 Ų | 49.9 | 41% | 0.406 | 25% | 0.25 | S | S | . | . | H | α-helix | trans | -64.2 | -46 | 176.2 | -67.1 | 0 | 0 | 0 | 0 | 111.7 | V136 I137 T143 L144 | V136-S140 WeakPolarHBondContact O-CB 3.48Å; V136-S140 PolarHBondContact O-N 3.38Å; V136-S140 PolarHBondContact O-OG 3.1Å; I137-S140 PolarHBondContact O-N 3.1Å; S140-T143 PolarHBondContact O-N 2.87Å; S140-L144 WeakPolarHBondContact O-CB 3.23Å; S140-L144 VanDerWaalsContact O-CG 3.27Å; S140-L144 WeakPolarHBondContact O-CG 3.4Å; S140-L144 PolarHBondContact O-N 3.18Å |
| 141 | V | 98.3 | Very high | 96.7 | Very high | 61 Ų | 61 | 44 Ų | 44 | 37% | 0.37 | 23% | 0.228 | S | C | . | . | H | α-helix | trans | -61.9 | -46.1 | 176.6 | 177.1 | 0 | 0 | 0 | 0 | 110.6 | T114 T118 I137 A138 T143 L144 A145 | T114-V141 HydrophobicContact CG2-CG1 3.61Å; T118-V141 HydrophobicContact CG2-CB 4.16Å; T118-V141 HydrophobicContact CG2-CG1 3.71Å; I137-V141 WeakPolarHBondContact O-CG2 3.23Å; I137-V141 PolarHBondContact O-N 3.43Å; A138-V141 PolarHBondContact O-N 2.88Å; V141-T143 VanDerWaalsContact C-N 3.35Å; V141-T143 PolarHBondContact O-N 2.91Å; V141-L144 PolarHBondContact O-N 3.32Å; V141-A145 WeakPolarHBondContact O-CB 3.48Å; V141-A145 PolarHBondContact O-N 2.95Å |
| 142 | F | 98.5 | Very high | 96.9 | Very high | 0 Ų | 0 | 35.1 Ų | 35.1 | 0% | 0 | 20% | 0.196 | C | C | . | . | H | α-helix | trans | -56.3 | -48.2 | 174.7 | 168.1 | -91 | 0 | 0 | 0 | 111.8 | F115 T118 Y119 L122 A138 L139 A145 F146 L262 Y265 L266 | F115-F142 AromaticContact CD2-CD2 3.88Å; F115-F142 HydrophobicContact CD2-CD2 3.88Å; F115-F142 AromaticContact CD2-CE2 3.39Å; F115-F142 HydrophobicContact CD2-CE2 3.39Å; F115-F142 HydrophobicContact CD2-CZ 4.06Å; F115-F142 HydrophobicContact CE2-CD2 4.17Å; F115-F142 AromaticContact CE2-CE2 3.22Å; F115-F142 HydrophobicContact CE2-CE2 3.22Å; F115-F142 AromaticContact CE2-CZ 3.61Å; F115-F142 HydrophobicContact CE2-CZ 3.61Å; F115-F142 HydrophobicContact CG-CE2 4.49Å; F115-F142 HydrophobicContact CZ-CE2 4.19Å; T118-F142 WeakPolarHBondContact OG1-CA 3.5Å; T118-F142 WeakPolarHBondContact OG1-CB 3.39Å; Y119-F142 HydrophobicContact CD2-CE2 4.05Å; Y119-F142 HydrophobicContact CG-CE2 4.39Å; L122-F142 HydrophobicContact CD1-CB 3.99Å; L122-F142 HydrophobicContact CD1-CG 4.22Å; A138-F142 WeakPolarHBondContact O-CB 3.41Å; A138-F142 PolarHBondContact O-N 3.4Å; L139-F142 HydrophobicContact CD1-CD1 4.3Å; L139-F142 PolarHBondContact O-N 2.91Å; F142-A145 PolarHBondContact O-N 3.28Å; F142-F146 HydrophobicContact CZ-CD1 4.34Å; F142-F146 PolarHBondContact O-N 3.11Å; F142-L262 HydrophobicContact CD1-CD1 3.57Å; F142-L262 HydrophobicContact CD2-CD1 4.09Å; F142-L262 HydrophobicContact CE1-CD1 3.16Å; F142-L262 HydrophobicContact CE2-CD1 3.71Å; F142-L262 HydrophobicContact CG-CD1 4.03Å; F142-L262 HydrophobicContact CZ-CD1 3.25Å; F142-Y265 HydrophobicContact CD1-CE1 4.38Å; F142-Y265 AromaticContact CE1-CD1 3.62Å; F142-Y265 HydrophobicContact CE1-CD1 3.62Å; F142-Y265 AromaticContact CE1-CE1 3.66Å; F142-Y265 HydrophobicContact CE1-CE1 3.66Å; F142-Y265 HydrophobicContact CZ-CD1 4.36Å; F142-Y265 HydrophobicContact CZ-CE1 4.42Å; F142-L266 HydrophobicContact CE2-CD2 4.43Å; F142-L266 HydrophobicContact CZ-CD1 4.31Å; F142-L266 HydrophobicContact CZ-CD2 3.8Å; F142-L266 HydrophobicContact CZ-CG 3.95Å |
| 143 | T | 98.6 | Very high | 97.1 | Very high | 8 Ų | 8 | 29 Ų | 29 | 5% | 0.049 | 17% | 0.174 | C | C | . | . | H | α-helix | trans | -62.3 | -50.7 | -179 | -57 | 0 | 0 | 0 | 0 | 110.1 | Q80 V83 L139 S140 V141 A145 F146 S147 Y265 | Q80-T143 HydrophobicContact CB-CG2 3.85Å; Q80-T143 HydrophobicContact CG-CG2 3.87Å; Q80-T143 PolarHBondContact NE2-OG1 2.85Å; V83-T143 HydrophobicContact CB-CG2 4.33Å; V83-T143 HydrophobicContact CG1-CG2 4.26Å; L139-T143 WeakPolarHBondContact O-CB 3.44Å; L139-T143 PolarHBondContact O-N 3.22Å; L139-T143 PolarHBondContact O-OG1 3.37Å; S140-T143 PolarHBondContact O-N 2.87Å; V141-T143 VanDerWaalsContact C-N 3.35Å; V141-T143 PolarHBondContact O-N 2.91Å; T143-A145 VanDerWaalsContact C-N 3.33Å; T143-A145 PolarHBondContact O-N 3.28Å; T143-F146 PolarHBondContact O-N 2.89Å; T143-S147 VanDerWaalsContact O-CB 3.31Å; T143-S147 WeakPolarHBondContact O-CB 3.14Å; T143-S147 PolarHBondContact O-N 3.36Å; T143-S147 PolarHBondContact O-OG 3.46Å; T143-Y265 HydrophobicContact CG2-CE1 4.42Å |
| 144 | L | 98.6 | Very high | 97.1 | Very high | 87 Ų | 87 | 25.7 Ų | 25.7 | 46% | 0.455 | 15% | 0.153 | S | C | . | . | H | α-helix | trans | -59.5 | -42.3 | 179.7 | -69.8 | 171.1 | 0 | 0 | 0 | 112.2 | V83 F87 S140 V141 Y148 | V83-L144 HydrophobicContact CG1-CD2 4Å; F87-L144 HydrophobicContact CE2-CD2 3.81Å; F87-L144 HydrophobicContact CZ-CD2 4.05Å; S140-L144 WeakPolarHBondContact O-CB 3.23Å; S140-L144 VanDerWaalsContact O-CG 3.27Å; S140-L144 WeakPolarHBondContact O-CG 3.4Å; S140-L144 PolarHBondContact O-N 3.18Å; V141-L144 PolarHBondContact O-N 3.32Å; L144-Y148 WeakPolarHBondContact O-CB 3.37Å; L144-Y148 PolarHBondContact O-N 3.41Å |
| 145 | A | 98.5 | Very high | 97.2 | Very high | 7 Ų | 7 | 24.6 Ų | 24.6 | 6% | 0.058 | 14% | 0.14 | C | C | . | . | H | α-helix | trans | -63.6 | -44.7 | 176.6 | 0 | 0 | 0 | 0 | 0 | 111.6 | S111 T114 F115 V141 F142 T143 Y148 M149 | S111-A145 WeakPolarHBondContact OG-CA 3.35Å; S111-A145 PolarHBondContact OG-O 3.29Å; T114-A145 HydrophobicContact CG2-CB 3.99Å; F115-A145 HydrophobicContact CB-CB 4.15Å; V141-A145 WeakPolarHBondContact O-CB 3.48Å; V141-A145 PolarHBondContact O-N 2.95Å; F142-A145 PolarHBondContact O-N 3.28Å; T143-A145 VanDerWaalsContact C-N 3.33Å; T143-A145 PolarHBondContact O-N 3.28Å; A145-Y148 PolarHBondContact O-N 3.06Å; A145-M149 WeakPolarHBondContact O-CG 3.43Å; A145-M149 PolarHBondContact O-N 2.91Å |
| 146 | F | 98.4 | Very high | 97.1 | Very high | 5 Ų | 5 | 30.7 Ų | 30.7 | 2% | 0.022 | 17% | 0.167 | C | C | . | . | H | α-helix | trans | -72.2 | -35.8 | 179.5 | -162.9 | -156.7 | 0 | 0 | 0 | 112.4 | F115 F142 T143 M149 T150 Y265 L266 V269 L273 | F115-F146 HydrophobicContact CD2-CB 3.75Å; F115-F146 HydrophobicContact CD2-CD2 4.07Å; F115-F146 AromaticContact CD2-CG 3.89Å; F115-F146 HydrophobicContact CD2-CG 3.89Å; F115-F146 HydrophobicContact CE2-CB 4.05Å; F115-F146 AromaticContact CE2-CD1 3.96Å; F115-F146 HydrophobicContact CE2-CD1 3.96Å; F115-F146 AromaticContact CE2-CD2 3.86Å; F115-F146 HydrophobicContact CE2-CD2 3.86Å; F115-F146 HydrophobicContact CE2-CE1 4.4Å; F115-F146 HydrophobicContact CE2-CE2 4.3Å; F115-F146 AromaticContact CE2-CG 3.69Å; F115-F146 HydrophobicContact CE2-CG 3.69Å; F115-F146 HydrophobicContact CZ-CD2 4.5Å; F142-F146 HydrophobicContact CZ-CD1 4.34Å; F142-F146 PolarHBondContact O-N 3.11Å; T143-F146 PolarHBondContact O-N 2.89Å; F146-M149 HydrophobicContact CD2-CB 4.49Å; F146-M149 HydrophobicContact CD2-CE 4.23Å; F146-M149 HydrophobicContact CD2-SD 4.45Å; F146-M149 HydrophobicContact CE2-CE 4.49Å; F146-M149 PolarHBondContact O-N 2.97Å; F146-T150 WeakPolarHBondContact O-CB 3.19Å; F146-T150 PolarHBondContact O-N 3.35Å; F146-T150 PolarHBondContact O-OG1 3.3Å; F146-Y265 HydrophobicContact CB-CE1 4.18Å; F146-Y265 HydrophobicContact CD1-CD1 4.12Å; F146-Y265 AromaticContact CD1-CE1 3.48Å; F146-Y265 HydrophobicContact CD1-CE1 3.48Å; F146-Y265 VanDerWaalsContact CD1-CE1 3.48Å; F146-Y265 AromaticContact CD1-CZ 3.94Å; F146-Y265 HydrophobicContact CE1-CE1 4.34Å; F146-Y265 HydrophobicContact CG-CE1 4.3Å; F146-L266 HydrophobicContact CD1-CD2 4.17Å; F146-L266 HydrophobicContact CE1-CD2 3.72Å; F146-L266 HydrophobicContact CZ-CD2 4.28Å; F146-V269 HydrophobicContact CD1-CB 4.33Å; F146-V269 HydrophobicContact CD1-CG1 4.14Å; F146-V269 HydrophobicContact CE1-CB 3.55Å; F146-V269 HydrophobicContact CE1-CG1 3.49Å; F146-V269 VanDerWaalsContact CE1-CG1 3.49Å; F146-V269 HydrophobicContact CE1-CG2 4.3Å; F146-V269 HydrophobicContact CE2-CG1 4.06Å; F146-V269 HydrophobicContact CZ-CB 3.89Å; F146-V269 HydrophobicContact CZ-CG1 3.45Å; F146-V269 VanDerWaalsContact CZ-CG1 3.45Å; F146-L273 HydrophobicContact CE2-CD1 4.37Å |
| 147 | S | 98.6 | Very high | 96.9 | Very high | 0 Ų | 0 | 30.1 Ų | 30.1 | 0% | 0 | 16% | 0.158 | C | C | . | . | H | α-helix | trans | -64 | -41.7 | 173.7 | -60.2 | 0 | 0 | 0 | 0 | 111.7 | T84 T143 T150 G151 Y265 | T84-S147 WeakPolarHBondContact CA-OG 3.28Å; T84-S147 PolarHBondContact N-OG 2.96Å; T84-S147 PolarHBondContact OG1-OG 3.21Å; T143-S147 VanDerWaalsContact O-CB 3.31Å; T143-S147 WeakPolarHBondContact O-CB 3.14Å; T143-S147 PolarHBondContact O-N 3.36Å; T143-S147 PolarHBondContact O-OG 3.46Å; S147-T150 PolarHBondContact O-N 3.02Å; S147-G151 PolarHBondContact O-N 3.26Å; S147-Y265 PolarHBondContact OG-OH 3.44Å |
| 148 | Y | 98.2 | Very high | 96.8 | Very high | 32 Ų | 32 | 29.7 Ų | 29.7 | 13% | 0.125 | 16% | 0.157 | C | C | . | . | H | α-helix | trans | -62.8 | -44.7 | 174.4 | 178.2 | -84.6 | 0 | 0 | 0 | 111.8 | F87 F91 W100 F107 S111 L144 A145 G151 T152 | F87-Y148 HydrophobicContact CE1-CD2 4.2Å; F91-Y148 HydrophobicContact CE1-CD2 4.24Å; F91-Y148 HydrophobicContact CE1-CE2 4.02Å; F91-Y148 AromaticContact CZ-CD2 3.62Å; F91-Y148 HydrophobicContact CZ-CD2 3.62Å; F91-Y148 AromaticContact CZ-CE2 3.61Å; F91-Y148 HydrophobicContact CZ-CE2 3.61Å; F91-Y148 HydrophobicContact CZ-CG 4.47Å; W100-Y148 HydrophobicContact CZ3-CE2 4.39Å; W100-Y148 WeakPolarHBondContact CZ3-OH 3.49Å; F107-Y148 HydrophobicContact CB-CE1 4.11Å; F107-Y148 WeakPolarHBondContact CB-OH 3.36Å; S111-Y148 WeakPolarHBondContact OG-CD1 3.42Å; L144-Y148 WeakPolarHBondContact O-CB 3.37Å; L144-Y148 PolarHBondContact O-N 3.41Å; A145-Y148 PolarHBondContact O-N 3.06Å; Y148-G151 PolarHBondContact O-N 3.12Å; Y148-T152 WeakPolarHBondContact CE1-OG1 3.33Å; Y148-T152 WeakPolarHBondContact O-CB 3.29Å; Y148-T152 PolarHBondContact O-N 3.21Å; Y148-T152 PolarHBondContact O-OG1 3.35Å |
| 149 | M | 97.8 | Very high | 96.6 | Very high | 9 Ų | 9 | 30.5 Ų | 30.5 | 4% | 0.044 | 16% | 0.16 | C | C | . | . | H | α-helix | trans | -59.8 | -47.7 | 174.9 | -73.1 | 168.5 | 52.2 | 0 | 0 | 111.4 | Y108 Y112 F115 A145 F146 T152 I153 | Y108-M149 HydrophobicContact CD2-CB 4.47Å; Y108-M149 HydrophobicContact CD2-CG 4.28Å; Y108-M149 HydrophobicContact CE2-CB 4.04Å; Y108-M149 HydrophobicContact CE2-CG 4.06Å; Y112-M149 VanDerWaalsContact CA-SD 3.59Å; Y112-M149 HydrophobicContact CD2-CE 3.49Å; Y112-M149 VanDerWaalsContact CD2-CE 3.49Å; Y112-M149 HydrophobicContact CD2-SD 4.12Å; Y112-M149 HydrophobicContact CE2-CE 4.15Å; Y112-M149 HydrophobicContact CG-CE 4.49Å; F115-M149 HydrophobicContact CB-SD 3.79Å; F115-M149 HydrophobicContact CD1-CE 4.48Å; F115-M149 HydrophobicContact CD1-SD 4.38Å; F115-M149 HydrophobicContact CG-SD 4.05Å; A145-M149 WeakPolarHBondContact O-CG 3.43Å; A145-M149 PolarHBondContact O-N 2.91Å; F146-M149 HydrophobicContact CD2-CB 4.49Å; F146-M149 HydrophobicContact CD2-CE 4.23Å; F146-M149 HydrophobicContact CD2-SD 4.45Å; F146-M149 HydrophobicContact CE2-CE 4.49Å; F146-M149 PolarHBondContact O-N 2.97Å; M149-T152 WeakPolarHBondContact O-CB 3.17Å; M149-T152 PolarHBondContact O-N 3.28Å; M149-I153 VanDerWaalsContact O-CG1 3.31Å; M149-I153 WeakPolarHBondContact O-CG1 3.35Å; M149-I153 PolarHBondContact O-N 3.4Å |
| 150 | T | 98.1 | Very high | 96.4 | Very high | 0 Ų | 0 | 35.7 Ų | 35.7 | 0% | 0 | 19% | 0.185 | C | C | . | . | H | α-helix | trans | -60.3 | -49.4 | 178.6 | -57.2 | 0 | 0 | 0 | 0 | 110.5 | T84 V88 F146 S147 T152 I153 T154 V269 F272 L273 | T84-T150 HydrophobicContact CG2-CG2 3.87Å; V88-T150 HydrophobicContact CG2-CG2 3.85Å; F146-T150 WeakPolarHBondContact O-CB 3.19Å; F146-T150 PolarHBondContact O-N 3.35Å; F146-T150 PolarHBondContact O-OG1 3.3Å; S147-T150 PolarHBondContact O-N 3.02Å; T150-T152 VanDerWaalsContact C-N 3.32Å; T150-T152 PolarHBondContact O-N 3.4Å; T150-I153 PolarHBondContact O-N 3.5Å; T150-T154 HydrophobicContact CG2-CG2 4.44Å; T150-T154 VanDerWaalsContact O-CG2 3.31Å; T150-T154 WeakPolarHBondContact O-CG2 3.44Å; T150-T154 PolarHBondContact O-N 2.84Å; T150-T154 PolarHBondContact O-OG1 2.96Å; T150-V269 HydrophobicContact CG2-CG1 4.05Å; T150-V269 VanDerWaalsContact OG1-CG1 3.27Å; T150-V269 WeakPolarHBondContact OG1-CG1 3.41Å; T150-F272 HydrophobicContact CG2-CD1 3.99Å; T150-F272 HydrophobicContact CG2-CE1 3.75Å; T150-L273 HydrophobicContact CG2-CD2 4.07Å |
| 151 | G | 97.3 | Very high | 96.2 | Very high | 0 Ų | 0 | 33.7 Ų | 33.7 | 0% | 0 | 17% | 0.17 | C | C | . | . | H | α-helix | trans | -55.9 | -45.5 | 174.9 | 0 | 0 | 0 | 0 | 0 | 112.3 | F91 S147 Y148 T154 S155 | F91-G151 WeakPolarHBondContact CB-O 3.39Å; F91-G151 WeakPolarHBondContact CD1-O 3.24Å; S147-G151 PolarHBondContact O-N 3.26Å; Y148-G151 PolarHBondContact O-N 3.12Å; G151-T154 WeakPolarHBondContact CA-OG1 3.46Å; G151-T154 PolarHBondContact O-N 2.84Å; G151-T154 PolarHBondContact O-OG1 2.94Å; G151-S155 PolarHBondContact O-N 3.2Å |
| 152 | T | 96.2 | Very high | 96.2 | Very high | 7 Ų | 7 | 30.9 Ų | 30.9 | 4% | 0.043 | 15% | 0.153 | C | C | . | . | H | α-helix | trans | -60.6 | -48.2 | 176.5 | -56.7 | 0 | 0 | 0 | 0 | 111.5 | F91 V101 Y108 Y148 M149 T150 T154 S155 F156 | F91-T152 WeakPolarHBondContact CE1-OG1 3.43Å; V101-T152 HydrophobicContact CB-CG2 4.33Å; Y108-T152 HydrophobicContact CD2-CG2 3.88Å; Y108-T152 HydrophobicContact CG-CG2 4.45Å; Y148-T152 WeakPolarHBondContact CE1-OG1 3.33Å; Y148-T152 WeakPolarHBondContact O-CB 3.29Å; Y148-T152 PolarHBondContact O-N 3.21Å; Y148-T152 PolarHBondContact O-OG1 3.35Å; M149-T152 WeakPolarHBondContact O-CB 3.17Å; M149-T152 PolarHBondContact O-N 3.28Å; T150-T152 VanDerWaalsContact C-N 3.32Å; T150-T152 PolarHBondContact O-N 3.4Å; T152-T154 PolarHBondContact O-N 2.9Å; T152-S155 WeakPolarHBondContact O-CB 3.34Å; T152-S155 PolarHBondContact O-N 2.99Å; T152-S155 PolarHBondContact O-OG 2.76Å; T152-F156 HydrophobicContact CG2-CE2 4.06Å; T152-F156 WeakPolarHBondContact O-CD2 3.33Å; T152-F156 WeakPolarHBondContact O-CE2 3.38Å |
| 153 | I | 94.9 | Very high | 96 | Very high | 42 Ų | 42 | 34.7 Ų | 34.7 | 22% | 0.215 | 17% | 0.173 | C | C | . | . | H | α-helix | trans | -60.6 | -49.2 | 178.3 | -65.7 | 165.7 | 0 | 0 | 0 | 110.1 | Y108 M149 T150 S155 F156 Y157 L273 | Y108-I153 HydrophobicContact CE2-CD1 4.23Å; Y108-I153 HydrophobicContact CE2-CG1 3.99Å; M149-I153 VanDerWaalsContact O-CG1 3.31Å; M149-I153 WeakPolarHBondContact O-CG1 3.35Å; M149-I153 PolarHBondContact O-N 3.4Å; T150-I153 PolarHBondContact O-N 3.5Å; I153-S155 PolarHBondContact O-N 2.69Å; I153-F156 PolarHBondContact O-N 3.01Å; I153-F156 VanDerWaalsContact O-N 3.17Å; I153-Y157 HydrophobicContact CG2-CE2 3.95Å; I153-Y157 VanDerWaalsContact O-CD2 3.28Å; I153-Y157 WeakPolarHBondContact O-CD2 3.27Å; I153-L273 HydrophobicContact CB-CD2 4.11Å; I153-L273 HydrophobicContact CD1-CD1 4.04Å; I153-L273 HydrophobicContact CD1-CD2 4.14Å; I153-L273 HydrophobicContact CG2-CD2 3.87Å |
| 154 | T | 95.2 | Very high | 95.9 | Very high | 0 Ų | 0 | 37.6 Ų | 37.6 | 0% | 0 | 19% | 0.188 | C | C | . | . | H | α-helix | trans | -61.4 | -26.1 | -179.9 | 59.1 | 0 | 0 | 0 | 0 | 113.6 | V88 T150 G151 T152 F156 Y157 F272 L276 | V88-T154 HydrophobicContact CG1-CG2 4.06Å; V88-T154 HydrophobicContact CG2-CG2 4Å; T150-T154 HydrophobicContact CG2-CG2 4.44Å; T150-T154 VanDerWaalsContact O-CG2 3.31Å; T150-T154 WeakPolarHBondContact O-CG2 3.44Å; T150-T154 PolarHBondContact O-N 2.84Å; T150-T154 PolarHBondContact O-OG1 2.96Å; G151-T154 WeakPolarHBondContact CA-OG1 3.46Å; G151-T154 PolarHBondContact O-N 2.84Å; G151-T154 PolarHBondContact O-OG1 2.94Å; T152-T154 PolarHBondContact O-N 2.9Å; T154-F156 PolarHBondContact O-N 2.79Å; T154-Y157 PolarHBondContact O-N 3.47Å; T154-Y157 VanDerWaalsContact O-N 3.07Å; T154-F272 HydrophobicContact CG2-CE1 3.55Å; T154-F272 HydrophobicContact CG2-CZ 3.6Å; T154-L276 HydrophobicContact CG2-CD2 3.76Å |
| 155 | S | 94.3 | Very high | 95.8 | Very high | 10 Ų | 10 | 33.5 Ų | 33.5 | 7% | 0.07 | 17% | 0.166 | C | C | . | . | T | Hydrogen-bonded Turn | trans | -64.5 | -20.9 | 179.5 | 80.7 | 0 | 0 | 0 | 0 | 113.7 | G151 T152 I153 | G151-S155 PolarHBondContact O-N 3.2Å; T152-S155 WeakPolarHBondContact O-CB 3.34Å; T152-S155 PolarHBondContact O-N 2.99Å; T152-S155 PolarHBondContact O-OG 2.76Å; I153-S155 PolarHBondContact O-N 2.69Å |
| 156 | F | 92.4 | Very high | 95.7 | Very high | 129 Ų | 129 | 36.5 Ų | 36.5 | 57% | 0.566 | 18% | 0.184 | S | C | * | . | T | Hydrogen-bonded Turn | trans | -90.4 | 1.3 | 176.5 | -62.8 | -74.1 | 0 | 0 | 0 | 114 | T152 I153 T154 | T152-F156 HydrophobicContact CG2-CE2 4.06Å; T152-F156 WeakPolarHBondContact O-CD2 3.33Å; T152-F156 WeakPolarHBondContact O-CE2 3.38Å; I153-F156 PolarHBondContact O-N 3.01Å; I153-F156 VanDerWaalsContact O-N 3.17Å; T154-F156 PolarHBondContact O-N 2.79Å |
| 157 | Y | 92.8 | Very high | 95.7 | Very high | 49 Ų | 49 | 41.4 Ų | 41.4 | 19% | 0.192 | 21% | 0.209 | C | C | . | . | S | Bend | trans | -109.2 | 156.1 | 177.1 | -71.2 | -105.3 | 0 | 0 | 0 | 110.3 | I153 T154 L276 G280 | I153-Y157 HydrophobicContact CG2-CE2 3.95Å; I153-Y157 VanDerWaalsContact O-CD2 3.28Å; I153-Y157 WeakPolarHBondContact O-CD2 3.27Å; T154-Y157 PolarHBondContact O-N 3.47Å; T154-Y157 VanDerWaalsContact O-N 3.07Å; Y157-L276 HydrophobicContact CD1-CD1 3.63Å; Y157-L276 HydrophobicContact CD1-CD2 4.29Å; Y157-L276 HydrophobicContact CD1-CG 3.65Å; Y157-L276 HydrophobicContact CD2-CD2 3.9Å; Y157-L276 HydrophobicContact CD2-CG 4.16Å; Y157-L276 HydrophobicContact CE1-CD1 4.22Å; Y157-L276 HydrophobicContact CE1-CD2 4.5Å; Y157-L276 HydrophobicContact CE1-CG 3.78Å; Y157-L276 VanDerWaalsContact CE1-O 3.32Å; Y157-L276 WeakPolarHBondContact CE1-O 3.49Å; Y157-L276 HydrophobicContact CE2-CD2 4.14Å; Y157-L276 HydrophobicContact CE2-CG 4.28Å; Y157-L276 HydrophobicContact CG-CD1 3.85Å; Y157-L276 HydrophobicContact CG-CD2 3.99Å; Y157-L276 HydrophobicContact CG-CG 3.86Å; Y157-G280 VanDerWaalsContact CD1-CA 3.46Å; Y157-G280 VanDerWaalsContact CE1-CA 3.43Å |
| 158 | D | 92.6 | Very high | 95.6 | Very high | 93 Ų | 93 | 44.2 Ų | 44.2 | 50% | 0.497 | 22% | 0.223 | S | C | . | . | trans | -67.9 | 148.2 | 170.7 | -176.3 | 59.8 | 0 | 0 | 0 | 111.3 | Q160 S161 V162 | D158-Q160 VanDerWaalsContact C-N 3.26Å; D158-Q160 PolarHBondContact O-N 3.45Å; D158-Q160 VanDerWaalsContact OD2-CB 3.25Å; D158-Q160 WeakPolarHBondContact OD2-CB 3.23Å; D158-Q160 WeakPolarHBondContact OD2-CG 3.33Å; D158-Q160 PolarHBondContact OD2-N 2.82Å; D158-S161 WeakPolarHBondContact O-CB 3.32Å; D158-S161 PolarHBondContact O-N 2.91Å; D158-S161 VanDerWaalsContact O-N 3.16Å; D158-V162 WeakPolarHBondContact O-CG2 3.38Å; D158-V162 PolarHBondContact O-N 2.98Å | ||
| 159 | T | 93.4 | Very high | 95.6 | Very high | 32 Ų | 32 | 42.9 Ų | 42.9 | 20% | 0.196 | 22% | 0.219 | C | C | . | . | H | α-helix | trans | -57 | -38.9 | 179.8 | -58.8 | 0 | 0 | 0 | 0 | 112 | L92 F93 V162 L163 | L92-T159 HydrophobicContact CD2-CG2 3.85Å; L92-T159 HydrophobicContact CG-CG2 4.29Å; F93-T159 HydrophobicContact CE1-CG2 3.89Å; F93-T159 HydrophobicContact CZ-CG2 4.18Å; T159-V162 PolarHBondContact O-N 3.43Å; T159-L163 HydrophobicContact CG2-CD1 4.09Å; T159-L163 HydrophobicContact CG2-CG 4.42Å; T159-L163 WeakPolarHBondContact O-CG 3.32Å; T159-L163 PolarHBondContact O-N 3.13Å |
| 160 | Q | 93.7 | Very high | 95.6 | Very high | 121 Ų | 121 | 44.7 Ų | 44.7 | 57% | 0.565 | 24% | 0.235 | S | C | * | . | H | α-helix | trans | -64.6 | -45.1 | 178.6 | -60 | -58.2 | -33.6 | 0 | 0 | 111 | D158 V162 L163 I164 | D158-Q160 VanDerWaalsContact C-N 3.26Å; D158-Q160 PolarHBondContact O-N 3.45Å; D158-Q160 VanDerWaalsContact OD2-CB 3.25Å; D158-Q160 WeakPolarHBondContact OD2-CB 3.23Å; D158-Q160 WeakPolarHBondContact OD2-CG 3.33Å; D158-Q160 PolarHBondContact OD2-N 2.82Å; Q160-V162 VanDerWaalsContact C-N 3.31Å; Q160-V162 PolarHBondContact O-N 3.36Å; Q160-L163 PolarHBondContact O-N 3.38Å; Q160-I164 WeakPolarHBondContact O-CB 3.25Å; Q160-I164 VanDerWaalsContact O-CG1 3.27Å; Q160-I164 WeakPolarHBondContact O-CG1 3.29Å; Q160-I164 PolarHBondContact O-N 3.33Å |
| 161 | S | 95 | Very high | 95.6 | Very high | 15 Ų | 15 | 48.4 Ų | 48.4 | 11% | 0.105 | 26% | 0.26 | C | S | . | . | H | α-helix | trans | -59.8 | -41.6 | 176.4 | -57.2 | 0 | 0 | 0 | 0 | 112 | D158 A165 F279 | D158-S161 WeakPolarHBondContact O-CB 3.32Å; D158-S161 PolarHBondContact O-N 2.91Å; D158-S161 VanDerWaalsContact O-N 3.16Å; S161-A165 WeakPolarHBondContact O-CB 3.5Å; S161-A165 PolarHBondContact O-N 3.22Å; S161-F279 VanDerWaalsContact CB-O 3.3Å; S161-F279 WeakPolarHBondContact CB-O 3.17Å; S161-F279 PolarHBondContact OG-O 3.03Å |
| 162 | V | 96.3 | Very high | 95.6 | Very high | 2 Ų | 2 | 51.3 Ų | 51.3 | 1% | 0.012 | 28% | 0.276 | C | S | . | . | H | α-helix | trans | -63.9 | -47.5 | 176.9 | 175.9 | 0 | 0 | 0 | 0 | 111.5 | V88 L92 D158 T159 Q160 A165 V166 F272 L276 | V88-V162 HydrophobicContact CG1-CG1 3.96Å; L92-V162 HydrophobicContact CD1-CB 4.41Å; L92-V162 HydrophobicContact CD1-CG2 3.98Å; L92-V162 HydrophobicContact CD2-CB 4.03Å; L92-V162 HydrophobicContact CD2-CG1 3.89Å; L92-V162 HydrophobicContact CD2-CG2 4.48Å; D158-V162 WeakPolarHBondContact O-CG2 3.38Å; D158-V162 PolarHBondContact O-N 2.98Å; T159-V162 PolarHBondContact O-N 3.43Å; Q160-V162 VanDerWaalsContact C-N 3.31Å; Q160-V162 PolarHBondContact O-N 3.36Å; V162-A165 PolarHBondContact O-N 3.5Å; V162-V166 WeakPolarHBondContact O-CG2 3.31Å; V162-V166 PolarHBondContact O-N 2.99Å; V162-F272 HydrophobicContact CG1-CZ 4.21Å; V162-L276 HydrophobicContact CB-CD1 4.4Å; V162-L276 HydrophobicContact CG2-CD1 3.85Å; V162-L276 HydrophobicContact CG2-CD2 4.45Å |
| 163 | L | 95.2 | Very high | 95.7 | Very high | 80 Ų | 80 | 51.8 Ų | 51.8 | 42% | 0.419 | 28% | 0.279 | S | S | . | . | H | α-helix | trans | -63.8 | -42.9 | 179.9 | -69.1 | 175 | 0 | 0 | 0 | 112.2 | T159 Q160 A165 V166 I167 | T159-L163 HydrophobicContact CG2-CD1 4.09Å; T159-L163 HydrophobicContact CG2-CG 4.42Å; T159-L163 WeakPolarHBondContact O-CG 3.32Å; T159-L163 PolarHBondContact O-N 3.13Å; Q160-L163 PolarHBondContact O-N 3.38Å; L163-A165 VanDerWaalsContact C-N 3.33Å; L163-A165 PolarHBondContact O-N 3.01Å; L163-V166 PolarHBondContact O-N 3.15Å; L163-I167 WeakPolarHBondContact O-CG1 3.34Å; L163-I167 PolarHBondContact O-N 3.23Å; L163-I167 VanDerWaalsContact O-N 3.09Å |
| 164 | I | 95.8 | Very high | 95.9 | Very high | 70 Ų | 70 | 54.8 Ų | 54.8 | 36% | 0.359 | 29% | 0.294 | S | S | . | . | H | α-helix | trans | -59.9 | -45.4 | 175.2 | -69.2 | 166.8 | 0 | 0 | 0 | 110.4 | Q160 V166 I167 I168 F279 | Q160-I164 WeakPolarHBondContact O-CB 3.25Å; Q160-I164 VanDerWaalsContact O-CG1 3.27Å; Q160-I164 WeakPolarHBondContact O-CG1 3.29Å; Q160-I164 PolarHBondContact O-N 3.33Å; I164-V166 PolarHBondContact O-N 3.01Å; I164-I167 PolarHBondContact O-N 3.08Å; I164-I168 HydrophobicContact CG2-CD1 3.67Å; I164-I168 HydrophobicContact CG2-CG1 4.43Å; I164-I168 WeakPolarHBondContact O-CG1 3.43Å; I164-I168 PolarHBondContact O-N 3.14Å; I164-F279 HydrophobicContact CG2-CD1 4.05Å; I164-F279 HydrophobicContact CG2-CD2 4.17Å; I164-F279 HydrophobicContact CG2-CE1 3.75Å; I164-F279 HydrophobicContact CG2-CE2 3.9Å; I164-F279 HydrophobicContact CG2-CG 4.25Å; I164-F279 HydrophobicContact CG2-CZ 3.68Å |
| 165 | A | 96.8 | Very high | 96 | Very high | 0 Ų | 0 | 57.5 Ų | 57.5 | 0% | 0 | 32% | 0.317 | C | S | . | . | H | α-helix | trans | -64.5 | -38.7 | 179.4 | 0 | 0 | 0 | 0 | 0 | 112.9 | S161 V162 L163 T169 F272 I275 L276 | S161-A165 WeakPolarHBondContact O-CB 3.5Å; S161-A165 PolarHBondContact O-N 3.22Å; V162-A165 PolarHBondContact O-N 3.5Å; L163-A165 VanDerWaalsContact C-N 3.33Å; L163-A165 PolarHBondContact O-N 3.01Å; A165-T169 VanDerWaalsContact O-CB 3.29Å; A165-T169 WeakPolarHBondContact O-CB 3.35Å; A165-T169 PolarHBondContact O-N 3.43Å; A165-T169 PolarHBondContact O-OG1 3.32Å; A165-F272 HydrophobicContact CB-CD2 4.16Å; A165-F272 HydrophobicContact CB-CE2 3.9Å; A165-I275 HydrophobicContact CB-CG2 4.08Å; A165-L276 HydrophobicContact CB-CB 3.82Å; A165-L276 HydrophobicContact CB-CD1 3.93Å |
| 166 | V | 97 | Very high | 96.2 | Very high | 70 Ų | 70 | 58.6 Ų | 58.6 | 42% | 0.424 | 32% | 0.321 | S | S | . | . | H | α-helix | trans | -60 | -48.2 | 173.8 | 169.3 | 0 | 0 | 0 | 0 | 110.8 | V162 L163 I164 T169 A170 F272 | V162-V166 WeakPolarHBondContact O-CG2 3.31Å; V162-V166 PolarHBondContact O-N 2.99Å; L163-V166 PolarHBondContact O-N 3.15Å; I164-V166 PolarHBondContact O-N 3.01Å; V166-T169 PolarHBondContact O-N 3.05Å; V166-A170 WeakPolarHBondContact O-CB 3.38Å; V166-A170 PolarHBondContact O-N 2.92Å; V166-F272 HydrophobicContact CG2-CD2 4.11Å; V166-F272 HydrophobicContact CG2-CE2 3.54Å; V166-F272 HydrophobicContact CG2-CZ 4.19Å |
| 167 | I | 97.3 | Very high | 96.4 | Very high | 109 Ų | 109 | 53.5 Ų | 53.5 | 56% | 0.559 | 30% | 0.301 | S | S | * | . | H | α-helix | trans | -62 | -49.8 | -179.1 | -67.2 | 166.4 | 0 | 0 | 0 | 110.6 | L163 I164 T169 A170 C171 | L163-I167 WeakPolarHBondContact O-CG1 3.34Å; L163-I167 PolarHBondContact O-N 3.23Å; L163-I167 VanDerWaalsContact O-N 3.09Å; I164-I167 PolarHBondContact O-N 3.08Å; I167-T169 VanDerWaalsContact C-N 3.31Å; I167-T169 PolarHBondContact O-N 3.34Å; I167-A170 PolarHBondContact O-N 2.91Å; I167-C171 PolarHBondContact O-N 3.27Å; I167-C171 PolarHBondContact O-SG 2.61Å; I167-C171 VanDerWaalsContact O-SG 3.36Å |
| 168 | I | 97.5 | Very high | 96.7 | Very high | 58 Ų | 58 | 55 Ų | 55 | 30% | 0.297 | 31% | 0.312 | S | S | . | . | H | α-helix | trans | -60.7 | -43.3 | 179.4 | -69 | 169.8 | 0 | 0 | 0 | 110.6 | I164 C171 L172 I275 F279 | I164-I168 HydrophobicContact CG2-CD1 3.67Å; I164-I168 HydrophobicContact CG2-CG1 4.43Å; I164-I168 WeakPolarHBondContact O-CG1 3.43Å; I164-I168 PolarHBondContact O-N 3.14Å; I168-C171 PolarHBondContact O-N 3.23Å; I168-L172 HydrophobicContact CG2-CD1 3.9Å; I168-L172 HydrophobicContact CG2-CG 4.29Å; I168-L172 WeakPolarHBondContact O-CB 3.18Å; I168-L172 WeakPolarHBondContact O-CG 3.49Å; I168-L172 PolarHBondContact O-N 2.96Å; I168-I275 HydrophobicContact CB-CG2 3.92Å; I168-I275 HydrophobicContact CD1-CG2 4.4Å; I168-I275 HydrophobicContact CG2-CD1 4.42Å; I168-I275 HydrophobicContact CG2-CG1 4.37Å; I168-I275 HydrophobicContact CG2-CG2 3.68Å; I168-F279 HydrophobicContact CD1-CE1 4.48Å; I168-F279 HydrophobicContact CD1-CE2 3.52Å; I168-F279 HydrophobicContact CD1-CZ 3.35Å |
| 169 | T | 97.9 | Very high | 96.9 | Very high | 5 Ų | 5 | 55.9 Ų | 55.9 | 3% | 0.031 | 31% | 0.312 | C | S | . | . | H | α-helix | trans | -65 | -41.9 | 179.4 | -54.2 | 0 | 0 | 0 | 0 | 111.5 | A165 V166 I167 C171 L172 C173 L271 F272 | A165-T169 VanDerWaalsContact O-CB 3.29Å; A165-T169 WeakPolarHBondContact O-CB 3.35Å; A165-T169 PolarHBondContact O-N 3.43Å; A165-T169 PolarHBondContact O-OG1 3.32Å; V166-T169 PolarHBondContact O-N 3.05Å; I167-T169 VanDerWaalsContact C-N 3.31Å; I167-T169 PolarHBondContact O-N 3.34Å; T169-C171 PolarHBondContact O-N 3.23Å; T169-L172 PolarHBondContact O-N 3.44Å; T169-C173 WeakPolarHBondContact O-CB 3.32Å; T169-C173 PolarHBondContact O-N 3.34Å; T169-C173 PolarHBondContact O-SG 3.42Å; T169-L271 HydrophobicContact CG2-CB 4.25Å; T169-L271 HydrophobicContact CG2-CD2 4.26Å; T169-L271 HydrophobicContact CG2-CG 4.2Å; T169-F272 HydrophobicContact CG2-CB 3.91Å; T169-F272 VanDerWaalsContact OG1-CA 3.3Å; T169-F272 WeakPolarHBondContact OG1-CA 3.47Å |
| 170 | A | 97.8 | Very high | 97 | Very high | 47 Ų | 47 | 54.4 Ų | 54.4 | 39% | 0.388 | 30% | 0.302 | S | S | . | . | H | α-helix | trans | -60.3 | -45.4 | 174.8 | 0 | 0 | 0 | 0 | 0 | 111.5 | V166 I167 C173 I174 | V166-A170 WeakPolarHBondContact O-CB 3.38Å; V166-A170 PolarHBondContact O-N 2.92Å; I167-A170 PolarHBondContact O-N 2.91Å; A170-C173 PolarHBondContact O-N 3Å; A170-I174 WeakPolarHBondContact O-CB 3.37Å; A170-I174 VanDerWaalsContact O-CG1 3.26Å; A170-I174 WeakPolarHBondContact O-CG1 3.47Å; A170-I174 PolarHBondContact O-N 2.92Å |
| 171 | C | 98.2 | Very high | 97.1 | Very high | 78 Ų | 78 | 52.6 Ų | 52.6 | 53% | 0.527 | 30% | 0.296 | S | S | . | . | H | α-helix | trans | -60.3 | -46.7 | 175.4 | -69.9 | 0 | 0 | 0 | 0 | 112.2 | I167 I168 T169 I174 A175 | I167-C171 PolarHBondContact O-N 3.27Å; I167-C171 PolarHBondContact O-SG 2.61Å; I167-C171 VanDerWaalsContact O-SG 3.36Å; I168-C171 PolarHBondContact O-N 3.23Å; T169-C171 PolarHBondContact O-N 3.23Å; C171-I174 PolarHBondContact O-N 2.79Å; C171-A175 VanDerWaalsContact O-CB 3.27Å; C171-A175 WeakPolarHBondContact O-CB 3.41Å; C171-A175 PolarHBondContact O-N 2.89Å |
| 172 | L | 98.3 | Very high | 97.2 | Very high | 61 Ų | 61 | 58.8 Ų | 58.8 | 32% | 0.319 | 32% | 0.323 | S | S | . | . | H | α-helix | trans | -61.3 | -45.4 | 176.4 | -73.3 | 172.4 | 0 | 0 | 0 | 111.1 | I168 T169 I174 A175 I176 L271 I275 | I168-L172 HydrophobicContact CG2-CD1 3.9Å; I168-L172 HydrophobicContact CG2-CG 4.29Å; I168-L172 WeakPolarHBondContact O-CB 3.18Å; I168-L172 WeakPolarHBondContact O-CG 3.49Å; I168-L172 PolarHBondContact O-N 2.96Å; T169-L172 PolarHBondContact O-N 3.44Å; L172-I174 PolarHBondContact O-N 2.99Å; L172-A175 PolarHBondContact O-N 3.46Å; L172-I176 HydrophobicContact CB-CD1 4.35Å; L172-I176 VanDerWaalsContact O-CB 3.24Å; L172-I176 WeakPolarHBondContact O-CB 3.34Å; L172-I176 WeakPolarHBondContact O-CD1 3.41Å; L172-I176 WeakPolarHBondContact O-CG1 3.41Å; L172-I176 PolarHBondContact O-N 2.88Å; L172-L271 HydrophobicContact CB-CD2 3.96Å; L172-L271 HydrophobicContact CD1-CD1 4.43Å; L172-L271 HydrophobicContact CD1-CD2 4.24Å; L172-L271 HydrophobicContact CD1-CG 4.44Å; L172-I275 HydrophobicContact CD1-CD1 3.82Å; L172-I275 HydrophobicContact CD1-CG1 4.01Å |
| 173 | C | 98.2 | Very high | 97.1 | Very high | 16 Ų | 16 | 59.6 Ų | 59.6 | 11% | 0.108 | 33% | 0.328 | C | S | . | . | H | α-helix | trans | -62 | -44.3 | -179.2 | -68.6 | 0 | 0 | 0 | 0 | 111.7 | T169 A170 S177 L237 | T169-C173 WeakPolarHBondContact O-CB 3.32Å; T169-C173 PolarHBondContact O-N 3.34Å; T169-C173 PolarHBondContact O-SG 3.42Å; A170-C173 PolarHBondContact O-N 3Å; C173-S177 WeakPolarHBondContact O-CB 3.12Å; C173-S177 PolarHBondContact O-N 2.92Å; C173-S177 PolarHBondContact O-OG 3.06Å; C173-L237 HydrophobicContact CB-CD2 4.03Å |
| 174 | I | 97.9 | Very high | 97 | Very high | 106 Ų | 106 | 67 Ų | 67 | 54% | 0.544 | 35% | 0.351 | S | S | . | . | H | α-helix | trans | -64.5 | -50.3 | 176.8 | -68 | 166.2 | 0 | 0 | 0 | 110.4 | A170 C171 L172 I176 S177 I178 | A170-I174 WeakPolarHBondContact O-CB 3.37Å; A170-I174 VanDerWaalsContact O-CG1 3.26Å; A170-I174 WeakPolarHBondContact O-CG1 3.47Å; A170-I174 PolarHBondContact O-N 2.92Å; C171-I174 PolarHBondContact O-N 2.79Å; L172-I174 PolarHBondContact O-N 2.99Å; I174-I176 PolarHBondContact O-N 2.87Å; I174-S177 PolarHBondContact O-N 3.39Å; I174-I178 HydrophobicContact CG2-CD1 3.64Å; I174-I178 HydrophobicContact CG2-CG1 4.38Å; I174-I178 WeakPolarHBondContact O-CB 3.13Å; I174-I178 VanDerWaalsContact O-CG1 3.25Å; I174-I178 WeakPolarHBondContact O-CG1 3.44Å; I174-I178 PolarHBondContact O-N 3.21Å |
| 175 | A | 98.3 | Very high | 96.8 | Very high | 57 Ų | 57 | 69 Ų | 69 | 47% | 0.471 | 36% | 0.361 | S | S | . | . | H | α-helix | trans | -60.8 | -46.6 | -177.9 | 0 | 0 | 0 | 0 | 0 | 112.1 | C171 L172 F179 | C171-A175 VanDerWaalsContact O-CB 3.27Å; C171-A175 WeakPolarHBondContact O-CB 3.41Å; C171-A175 PolarHBondContact O-N 2.89Å; L172-A175 PolarHBondContact O-N 3.46Å; A175-F179 WeakPolarHBondContact O-CB 3.4Å; A175-F179 PolarHBondContact O-N 3Å |
| 176 | I | 98.2 | Very high | 96.6 | Very high | 33 Ų | 33 | 70.1 Ų | 70.1 | 17% | 0.169 | 37% | 0.367 | C | S | . | . | H | α-helix | trans | -66.5 | -43.3 | 178.8 | -66.9 | 167.9 | 0 | 0 | 0 | 110.8 | L172 I174 F179 A180 G234 L237 A238 | L172-I176 HydrophobicContact CB-CD1 4.35Å; L172-I176 VanDerWaalsContact O-CB 3.24Å; L172-I176 WeakPolarHBondContact O-CB 3.34Å; L172-I176 WeakPolarHBondContact O-CD1 3.41Å; L172-I176 WeakPolarHBondContact O-CG1 3.41Å; L172-I176 PolarHBondContact O-N 2.88Å; I174-I176 PolarHBondContact O-N 2.87Å; I176-F179 PolarHBondContact O-N 3.08Å; I176-A180 VanDerWaalsContact O-CB 3.26Å; I176-A180 WeakPolarHBondContact O-CB 3.27Å; I176-A180 PolarHBondContact O-N 2.78Å; I176-G234 WeakPolarHBondContact CG2-O 3.29Å; I176-L237 HydrophobicContact CB-CD2 4.07Å; I176-L237 HydrophobicContact CD1-CD2 4.38Å; I176-L237 HydrophobicContact CG2-CB 4.07Å; I176-L237 HydrophobicContact CG2-CD2 4Å; I176-L237 HydrophobicContact CG2-CG 4Å; I176-A238 HydrophobicContact CG2-CB 3.79Å |
| 177 | S | 97.1 | Very high | 96.4 | Very high | 21 Ų | 21 | 67.9 Ų | 67.9 | 15% | 0.147 | 35% | 0.352 | C | S | . | . | H | α-helix | trans | -63.1 | -45 | 178.2 | -60.6 | 0 | 0 | 0 | 0 | 111.6 | C173 I174 A180 I181 | C173-S177 WeakPolarHBondContact O-CB 3.12Å; C173-S177 PolarHBondContact O-N 2.92Å; C173-S177 PolarHBondContact O-OG 3.06Å; I174-S177 PolarHBondContact O-N 3.39Å; S177-A180 PolarHBondContact O-N 2.84Å; S177-I181 WeakPolarHBondContact O-CB 3.3Å; S177-I181 WeakPolarHBondContact O-CD1 3.49Å; S177-I181 WeakPolarHBondContact O-CG1 3.26Å; S177-I181 PolarHBondContact O-N 2.66Å |
| 178 | I | 97.6 | Very high | 96 | Very high | 81 Ų | 81 | 62.8 Ų | 62.8 | 42% | 0.415 | 33% | 0.326 | S | S | . | . | H | α-helix | trans | -60.5 | -47.6 | 176.1 | -70.4 | 171.6 | 0 | 0 | 0 | 110.1 | I174 A180 I181 Q182 | I174-I178 HydrophobicContact CG2-CD1 3.64Å; I174-I178 HydrophobicContact CG2-CG1 4.38Å; I174-I178 WeakPolarHBondContact O-CB 3.13Å; I174-I178 VanDerWaalsContact O-CG1 3.25Å; I174-I178 WeakPolarHBondContact O-CG1 3.44Å; I174-I178 PolarHBondContact O-N 3.21Å; I178-A180 VanDerWaalsContact C-N 3.35Å; I178-A180 PolarHBondContact O-N 3.28Å; I178-I181 PolarHBondContact O-N 2.91Å; I178-Q182 HydrophobicContact CG2-CG 4.34Å; I178-Q182 WeakPolarHBondContact O-CB 3.39Å; I178-Q182 VanDerWaalsContact O-CG 3.31Å; I178-Q182 WeakPolarHBondContact O-CG 3.29Å; I178-Q182 PolarHBondContact O-N 2.89Å |
| 179 | F | 97.2 | Very high | 95.7 | Very high | 112 Ų | 112 | 66 Ų | 66 | 49% | 0.491 | 34% | 0.338 | S | S | . | . | H | α-helix | trans | -57.2 | -47.8 | 175.9 | 172.1 | -98.8 | 0 | 0 | 0 | 111.6 | A175 I176 I181 Q182 T183 I187 | A175-F179 WeakPolarHBondContact O-CB 3.4Å; A175-F179 PolarHBondContact O-N 3Å; I176-F179 PolarHBondContact O-N 3.08Å; F179-I181 VanDerWaalsContact C-N 3.34Å; F179-I181 PolarHBondContact O-N 3Å; F179-Q182 PolarHBondContact O-N 2.95Å; F179-T183 HydrophobicContact CE1-CG2 4.22Å; F179-T183 HydrophobicContact CZ-CG2 4.35Å; F179-T183 WeakPolarHBondContact O-CB 3.15Å; F179-T183 WeakPolarHBondContact O-CG2 3.43Å; F179-T183 PolarHBondContact O-N 3.03Å; F179-I187 HydrophobicContact CE1-CD1 4.33Å |
| 180 | A | 96.6 | Very high | 95.4 | Very high | 0 Ų | 0 | 68.2 Ų | 68.2 | 0% | 0 | 35% | 0.353 | C | S | . | . | H | α-helix | trans | -62.2 | -38.5 | -178.8 | 0 | 0 | 0 | 0 | 0 | 112.9 | I176 S177 I178 A238 T241 Q242 | I176-A180 VanDerWaalsContact O-CB 3.26Å; I176-A180 WeakPolarHBondContact O-CB 3.27Å; I176-A180 PolarHBondContact O-N 2.78Å; S177-A180 PolarHBondContact O-N 2.84Å; I178-A180 VanDerWaalsContact C-N 3.35Å; I178-A180 PolarHBondContact O-N 3.28Å; A180-A238 HydrophobicContact CB-CB 3.97Å; A180-T241 HydrophobicContact CB-CG2 3.9Å; A180-Q242 HydrophobicContact CB-CG 4.22Å; A180-Q242 WeakPolarHBondContact O-CG 3.43Å; A180-Q242 PolarHBondContact O-NE2 2.97Å; A180-Q242 VanDerWaalsContact O-NE2 3.1Å |
| 181 | I | 95.7 | Very high | 95.1 | Very high | 83 Ų | 83 | 68.9 Ų | 68.9 | 43% | 0.426 | 35% | 0.352 | S | S | . | . | H | α-helix | trans | -69.5 | -42.4 | 176.5 | -67.2 | 161.1 | 0 | 0 | 0 | 111.2 | S177 I178 F179 T241 M245 | S177-I181 WeakPolarHBondContact O-CB 3.3Å; S177-I181 WeakPolarHBondContact O-CD1 3.49Å; S177-I181 WeakPolarHBondContact O-CG1 3.26Å; S177-I181 PolarHBondContact O-N 2.66Å; I178-I181 PolarHBondContact O-N 2.91Å; F179-I181 VanDerWaalsContact C-N 3.34Å; F179-I181 PolarHBondContact O-N 3Å; I181-T241 HydrophobicContact CD1-CG2 4.32Å; I181-T241 HydrophobicContact CG1-CG2 3.85Å; I181-M245 HydrophobicContact CD1-CE 4.35Å; I181-M245 HydrophobicContact CD1-SD 4.4Å; I181-M245 HydrophobicContact CG1-CG 3.87Å; I181-M245 HydrophobicContact CG1-SD 4.14Å |
| 182 | Q | 95.9 | Very high | 94.8 | Very high | 145 Ų | 145 | 69.5 Ų | 69.5 | 68% | 0.678 | 36% | 0.358 | S | S | * | . | H | α-helix | trans | -88.2 | -30 | -171.3 | -67.9 | -179.7 | 1.4 | 0 | 0 | 114.1 | I178 F179 | I178-Q182 HydrophobicContact CG2-CG 4.34Å; I178-Q182 WeakPolarHBondContact O-CB 3.39Å; I178-Q182 VanDerWaalsContact O-CG 3.31Å; I178-Q182 WeakPolarHBondContact O-CG 3.29Å; I178-Q182 PolarHBondContact O-N 2.89Å; F179-Q182 PolarHBondContact O-N 2.95Å |
| 183 | T | 94.7 | Very high | 94.6 | Very high | 20 Ų | 20 | 71.1 Ų | 71.1 | 12% | 0.123 | 37% | 0.366 | C | S | . | . | trans | -62.7 | 141.6 | -174.4 | -173.1 | 0 | 0 | 0 | 0 | 111.4 | F179 I185 Q242 R248 | F179-T183 HydrophobicContact CE1-CG2 4.22Å; F179-T183 HydrophobicContact CZ-CG2 4.35Å; F179-T183 WeakPolarHBondContact O-CB 3.15Å; F179-T183 WeakPolarHBondContact O-CG2 3.43Å; F179-T183 PolarHBondContact O-N 3.03Å; T183-I185 VanDerWaalsContact C-N 3.28Å; T183-I185 WeakPolarHBondContact CG2-O 3.16Å; T183-I185 PolarHBondContact OG1-N 3.25Å; T183-Q242 VanDerWaalsContact CG2-NE2 3.32Å; T183-R248 PolarHBondContact O-NH2 3.29Å | ||
| 184 | R | 91.8 | Very high | 94.4 | Very high | 235 Ų | 235 | 70.6 Ų | 70.6 | 89% | 0.887 | 36% | 0.362 | S | S | * | . | S | Bend | trans | -76.4 | -20.9 | 172.3 | -64.3 | -66.9 | -173.6 | 171.5 | 0.4 | 112 | D186 R248 | R184-D186 PolarHBondContact O-N 3.42Å; R184-R248 PolarHBondContact O-NH1 3.34Å |
| 185 | I | 92.5 | Very high | 94.3 | Very high | 111 Ų | 111 | 71.9 Ų | 71.9 | 57% | 0.569 | 36% | 0.364 | S | S | * | . | S | Bend | trans | -67.5 | 124.9 | -179.9 | -57.5 | 172.5 | 0 | 0 | 0 | 109 | T183 I187 Q242 | T183-I185 VanDerWaalsContact C-N 3.28Å; T183-I185 WeakPolarHBondContact CG2-O 3.16Å; T183-I185 PolarHBondContact OG1-N 3.25Å; I185-I187 PolarHBondContact O-N 2.99Å; I185-Q242 PolarHBondContact O-NE2 3.27Å |
| 186 | D | 92.6 | Very high | 94.2 | Very high | 25 Ų | 25 | 73.2 Ų | 73.2 | 13% | 0.134 | 37% | 0.366 | C | S | . | . | trans | -88 | 94.4 | 174.6 | -171.5 | -6.2 | 0 | 0 | 0 | 109.3 | R184 T188 K189 R248 E249 | R184-D186 PolarHBondContact O-N 3.42Å; D186-T188 PolarHBondContact O-N 2.68Å; D186-T188 VanDerWaalsContact OD1-CB 3.3Å; D186-T188 WeakPolarHBondContact OD1-CB 3.49Å; D186-T188 PolarHBondContact OD1-N 3.36Å; D186-T188 PolarHBondContact OD1-OG1 2.93Å; D186-K189 HydrophobicContact CB-CD 4.15Å; D186-K189 HydrophobicContact CB-CG 3.86Å; D186-K189 PolarHBondContact O-N 3.4Å; D186-K189 WeakPolarHBondContact OD2-CE 3.29Å; D186-R248 WeakPolarHBondContact OD1-CB 3.43Å; D186-E249 PolarHBondContact OD2-N 3.42Å | ||
| 187 | I | 92.3 | Very high | 94 | Very high | 23 Ų | 23 | 74.9 Ų | 74.9 | 12% | 0.118 | 38% | 0.375 | C | S | . | . | G | 310 helix | trans | -64.2 | -24.5 | 178.5 | -56.6 | 174 | 0 | 0 | 0 | 109.7 | F179 I185 K189 C190 I194 A238 F239 Q242 | F179-I187 HydrophobicContact CE1-CD1 4.33Å; I185-I187 PolarHBondContact O-N 2.99Å; I187-K189 PolarHBondContact O-N 3.04Å; I187-C190 WeakPolarHBondContact O-CB 3.19Å; I187-C190 PolarHBondContact O-N 3.29Å; I187-I194 HydrophobicContact CG2-CD1 4.08Å; I187-A238 HydrophobicContact CD1-CB 3.53Å; I187-F239 HydrophobicContact CG2-CB 4.13Å; I187-F239 HydrophobicContact CG2-CD2 4.39Å; I187-Q242 VanDerWaalsContact CB-OE1 3.32Å |
| 188 | T | 89.4 | Confident | 93.9 | Very high | 1 Ų | 1 | 75.7 Ų | 75.7 | 1% | 0.006 | 38% | 0.379 | C | S | . | . | G | 310 helix | trans | -64.5 | -21.5 | 179.5 | 77.4 | 0 | 0 | 0 | 0 | 113.2 | D186 C190 T191 F239 Q242 R248 E249 L250 | D186-T188 PolarHBondContact O-N 2.68Å; D186-T188 VanDerWaalsContact OD1-CB 3.3Å; D186-T188 WeakPolarHBondContact OD1-CB 3.49Å; D186-T188 PolarHBondContact OD1-N 3.36Å; D186-T188 PolarHBondContact OD1-OG1 2.93Å; T188-C190 VanDerWaalsContact C-N 3.26Å; T188-C190 PolarHBondContact O-N 2.91Å; T188-T191 PolarHBondContact O-OG1 3.34Å; T188-F239 HydrophobicContact CG2-CD2 4.45Å; T188-F239 HydrophobicContact CG2-CE2 4.42Å; T188-Q242 HydrophobicContact CG2-CB 3.81Å; T188-R248 HydrophobicContact CG2-CB 4.11Å; T188-E249 PolarHBondContact OG1-N 3.17Å; T188-L250 WeakPolarHBondContact O-CD1 3.4Å; T188-L250 PolarHBondContact OG1-N 3.47Å; T188-L250 VanDerWaalsContact OG1-N 3.17Å |
| 189 | K | 91.8 | Very high | 93.9 | Very high | 126 Ų | 126 | 74.9 Ų | 74.9 | 55% | 0.548 | 38% | 0.375 | S | S | . | . | G | 310 helix | trans | -71.6 | -22.4 | 173.2 | -52 | -159.9 | 170.5 | -168.7 | 0 | 113.4 | D186 I187 T191 E249 | D186-K189 HydrophobicContact CB-CD 4.15Å; D186-K189 HydrophobicContact CB-CG 3.86Å; D186-K189 PolarHBondContact O-N 3.4Å; D186-K189 WeakPolarHBondContact OD2-CE 3.29Å; I187-K189 PolarHBondContact O-N 3.04Å; K189-T191 PolarHBondContact O-N 3.09Å; K189-E249 WeakPolarHBondContact CD-OE2 3.42Å; K189-E249 WeakPolarHBondContact CE-OE2 3.37Å; K189-E249 HydrophobicContact CG-CB 4.05Å; K189-E249 WeakPolarHBondContact CG-OE2 3.41Å; K189-E249 IonicContact NZ-OE2 3.66Å |
| 190 | C | 91.6 | Very high | 93.9 | Very high | 52 Ų | 52 | 73.4 Ų | 73.4 | 35% | 0.351 | 38% | 0.375 | S | S | . | . | G | 310 helix | trans | -87.6 | 19.2 | -176.2 | -62 | 0 | 0 | 0 | 0 | 112.5 | I187 T188 S192 L193 I194 | I187-C190 WeakPolarHBondContact O-CB 3.19Å; I187-C190 PolarHBondContact O-N 3.29Å; T188-C190 VanDerWaalsContact C-N 3.26Å; T188-C190 PolarHBondContact O-N 2.91Å; C190-S192 PolarHBondContact O-N 3.47Å; C190-L193 HydrophobicContact CB-CB 4.42Å; C190-L193 WeakPolarHBondContact O-CB 3.43Å; C190-L193 PolarHBondContact O-N 3.47Å; C190-I194 WeakPolarHBondContact O-CG1 3.01Å; C190-I194 PolarHBondContact O-N 2.98Å |
| 191 | T | 90.9 | Very high | 93.8 | Very high | 60 Ų | 60 | 74.2 Ų | 74.2 | 37% | 0.368 | 38% | 0.38 | S | S | . | . | H | α-helix | trans | -52.8 | -40.2 | -178.3 | -52.7 | 0 | 0 | 0 | 0 | 112.9 | T188 K189 I194 F195 L250 | T188-T191 PolarHBondContact O-OG1 3.34Å; K189-T191 PolarHBondContact O-N 3.09Å; T191-I194 PolarHBondContact O-N 3.22Å; T191-F195 WeakPolarHBondContact O-CB 3.36Å; T191-F195 PolarHBondContact O-N 2.95Å; T191-L250 VanDerWaalsContact OG1-CD1 3.29Å; T191-L250 WeakPolarHBondContact OG1-CD1 3.39Å |
| 192 | S | 92.4 | Very high | 93.8 | Very high | 91 Ų | 91 | 75.8 Ų | 75.8 | 64% | 0.636 | 39% | 0.387 | S | S | * | . | H | α-helix | trans | -64.2 | -41 | 177.6 | 57.3 | 0 | 0 | 0 | 0 | 112.4 | C190 F195 V196 | C190-S192 PolarHBondContact O-N 3.47Å; S192-F195 PolarHBondContact O-N 3.39Å; S192-V196 WeakPolarHBondContact O-CG2 3.48Å; S192-V196 PolarHBondContact O-N 2.89Å; S192-V196 VanDerWaalsContact O-N 3.08Å |
| 193 | L | 94.5 | Very high | 93.8 | Very high | 96 Ų | 96 | 73.5 Ų | 73.5 | 50% | 0.503 | 38% | 0.379 | S | S | . | . | H | α-helix | trans | -67.1 | -44.9 | 176.1 | -179.1 | 151.1 | 0 | 0 | 0 | 111 | C190 F195 V196 L197 | C190-L193 HydrophobicContact CB-CB 4.42Å; C190-L193 WeakPolarHBondContact O-CB 3.43Å; C190-L193 PolarHBondContact O-N 3.47Å; L193-F195 VanDerWaalsContact C-N 3.3Å; L193-F195 PolarHBondContact O-N 3.14Å; L193-V196 PolarHBondContact O-N 3.33Å; L193-L197 HydrophobicContact CD2-CD1 3.51Å; L193-L197 HydrophobicContact CD2-CG 4.01Å; L193-L197 WeakPolarHBondContact O-CG 3.42Å; L193-L197 PolarHBondContact O-N 3.07Å |
| 194 | I | 93.9 | Very high | 93.7 | Very high | 5 Ų | 5 | 75.3 Ų | 75.3 | 3% | 0.026 | 39% | 0.39 | C | S | . | . | H | α-helix | trans | -59.8 | -43.6 | 176.5 | -64.5 | 170.8 | 0 | 0 | 0 | 110 | I187 C190 T191 V196 L197 T198 V235 Y236 F239 | I187-I194 HydrophobicContact CG2-CD1 4.08Å; C190-I194 WeakPolarHBondContact O-CG1 3.01Å; C190-I194 PolarHBondContact O-N 2.98Å; T191-I194 PolarHBondContact O-N 3.22Å; I194-V196 PolarHBondContact O-N 2.91Å; I194-L197 PolarHBondContact O-N 2.7Å; I194-T198 WeakPolarHBondContact O-CB 3.31Å; I194-T198 PolarHBondContact O-N 3.37Å; I194-T198 PolarHBondContact O-OG1 3.05Å; I194-V235 HydrophobicContact CD1-CG1 3.99Å; I194-V235 HydrophobicContact CG1-CG1 3.89Å; I194-Y236 HydrophobicContact CG2-CD1 4Å; I194-Y236 HydrophobicContact CG2-CE1 3.39Å; I194-Y236 HydrophobicContact CG2-CE2 4.06Å; I194-Y236 VanDerWaalsContact CG2-CZ 3.44Å; I194-F239 HydrophobicContact CD1-CB 4.03Å; I194-F239 HydrophobicContact CD1-CD2 3.45Å; I194-F239 VanDerWaalsContact CD1-CD2 3.45Å; I194-F239 HydrophobicContact CD1-CE2 4.17Å; I194-F239 HydrophobicContact CD1-CG 3.95Å |
| 195 | F | 94.5 | Very high | 93.8 | Very high | 133 Ų | 133 | 64.5 Ų | 64.5 | 58% | 0.583 | 35% | 0.351 | S | S | * | . | H | α-helix | trans | -58.9 | -44.8 | 176.2 | -179.8 | -105 | 0 | 0 | 0 | 112.7 | T191 S192 L193 T198 I199 | T191-F195 WeakPolarHBondContact O-CB 3.36Å; T191-F195 PolarHBondContact O-N 2.95Å; S192-F195 PolarHBondContact O-N 3.39Å; L193-F195 VanDerWaalsContact C-N 3.3Å; L193-F195 PolarHBondContact O-N 3.14Å; F195-T198 PolarHBondContact O-N 3.16Å; F195-I199 HydrophobicContact CD1-CD1 3.91Å; F195-I199 HydrophobicContact CE1-CD1 3.36Å; F195-I199 HydrophobicContact CE1-CG1 4.46Å; F195-I199 HydrophobicContact CE2-CD1 4.24Å; F195-I199 HydrophobicContact CZ-CD1 3.57Å; F195-I199 HydrophobicContact CZ-CG1 4.41Å; F195-I199 WeakPolarHBondContact O-CG1 3.49Å; F195-I199 PolarHBondContact O-N 3.41Å |
| 196 | V | 96.5 | Very high | 93.8 | Very high | 85 Ų | 85 | 64.2 Ų | 64.2 | 52% | 0.515 | 35% | 0.351 | S | S | . | . | H | α-helix | trans | -63.6 | -46.5 | 175.8 | 173.9 | 0 | 0 | 0 | 0 | 111.1 | S192 L193 I194 T198 I199 V200 | S192-V196 WeakPolarHBondContact O-CG2 3.48Å; S192-V196 PolarHBondContact O-N 2.89Å; S192-V196 VanDerWaalsContact O-N 3.08Å; L193-V196 PolarHBondContact O-N 3.33Å; I194-V196 PolarHBondContact O-N 2.91Å; V196-T198 PolarHBondContact O-N 3.48Å; V196-I199 PolarHBondContact O-N 2.92Å; V196-V200 HydrophobicContact CG1-CG2 4.41Å; V196-V200 WeakPolarHBondContact O-CG2 3.29Å; V196-V200 PolarHBondContact O-N 3.45Å |
| 197 | L | 95.4 | Very high | 93.8 | Very high | 67 Ų | 67 | 65.3 Ų | 65.3 | 35% | 0.351 | 36% | 0.363 | S | S | . | . | H | α-helix | trans | -57.7 | -39.9 | 176.8 | -70.4 | -179.9 | 0 | 0 | 0 | 111.6 | L193 I194 V200 V201 L232 | L193-L197 HydrophobicContact CD2-CD1 3.51Å; L193-L197 HydrophobicContact CD2-CG 4.01Å; L193-L197 WeakPolarHBondContact O-CG 3.42Å; L193-L197 PolarHBondContact O-N 3.07Å; I194-L197 PolarHBondContact O-N 2.7Å; L197-V200 PolarHBondContact O-N 2.89Å; L197-V201 WeakPolarHBondContact O-CG2 3.37Å; L197-V201 PolarHBondContact O-N 3Å; L197-L232 HydrophobicContact CB-CD1 3.82Å |
| 198 | T | 95 | Very high | 93.8 | Very high | 38 Ų | 38 | 64.9 Ų | 64.9 | 23% | 0.233 | 36% | 0.362 | C | S | . | . | H | α-helix | trans | -65.1 | -44.6 | 177.6 | -61.7 | 0 | 0 | 0 | 0 | 112.6 | I194 F195 V196 V200 V201 M202 Y236 | I194-T198 WeakPolarHBondContact O-CB 3.31Å; I194-T198 PolarHBondContact O-N 3.37Å; I194-T198 PolarHBondContact O-OG1 3.05Å; F195-T198 PolarHBondContact O-N 3.16Å; V196-T198 PolarHBondContact O-N 3.48Å; T198-V200 VanDerWaalsContact C-N 3.32Å; T198-V200 PolarHBondContact O-N 3.42Å; T198-V201 PolarHBondContact O-N 3.36Å; T198-M202 WeakPolarHBondContact O-CB 3.36Å; T198-M202 PolarHBondContact O-N 2.92Å; T198-Y236 WeakPolarHBondContact CB-OH 3.16Å; T198-Y236 HydrophobicContact CG2-CE2 4.5Å; T198-Y236 WeakPolarHBondContact OG1-CE2 3.33Å; T198-Y236 VanDerWaalsContact OG1-CZ 3.23Å; T198-Y236 PolarHBondContact OG1-OH 2.86Å |
| 199 | I | 96.4 | Very high | 93.8 | Very high | 65 Ų | 65 | 69.4 Ų | 69.4 | 33% | 0.333 | 39% | 0.39 | S | S | . | . | H | α-helix | trans | -60.6 | -45 | 174.8 | -68.4 | 171.2 | 0 | 0 | 0 | 110.2 | F195 V196 M202 L203 | F195-I199 HydrophobicContact CD1-CD1 3.91Å; F195-I199 HydrophobicContact CE1-CD1 3.36Å; F195-I199 HydrophobicContact CE1-CG1 4.46Å; F195-I199 HydrophobicContact CE2-CD1 4.24Å; F195-I199 HydrophobicContact CZ-CD1 3.57Å; F195-I199 HydrophobicContact CZ-CG1 4.41Å; F195-I199 WeakPolarHBondContact O-CG1 3.49Å; F195-I199 PolarHBondContact O-N 3.41Å; V196-I199 PolarHBondContact O-N 2.92Å; I199-M202 PolarHBondContact O-N 3.41Å; I199-L203 HydrophobicContact CG2-CD1 3.69Å; I199-L203 HydrophobicContact CG2-CG 4.13Å; I199-L203 WeakPolarHBondContact O-CB 3.37Å; I199-L203 VanDerWaalsContact O-CG 3.3Å; I199-L203 WeakPolarHBondContact O-CG 3.34Å; I199-L203 PolarHBondContact O-N 3.27Å |
| 200 | V | 96.7 | Very high | 93.8 | Very high | 80 Ų | 80 | 68.1 Ų | 68.1 | 49% | 0.485 | 39% | 0.388 | S | S | . | . | H | α-helix | trans | -61.1 | -50.4 | 179.8 | 171.1 | 0 | 0 | 0 | 0 | 111.1 | V196 L197 T198 T204 | V196-V200 HydrophobicContact CG1-CG2 4.41Å; V196-V200 WeakPolarHBondContact O-CG2 3.29Å; V196-V200 PolarHBondContact O-N 3.45Å; L197-V200 PolarHBondContact O-N 2.89Å; T198-V200 VanDerWaalsContact C-N 3.32Å; T198-V200 PolarHBondContact O-N 3.42Å; V200-T204 VanDerWaalsContact O-CB 3.23Å; V200-T204 WeakPolarHBondContact O-CB 3.4Å; V200-T204 PolarHBondContact O-N 3.19Å; V200-T204 PolarHBondContact O-OG1 3.21Å |
| 201 | V | 95.6 | Very high | 93.8 | Very high | 18 Ų | 18 | 68.7 Ų | 68.7 | 11% | 0.109 | 39% | 0.389 | C | S | . | . | H | α-helix | trans | -64.1 | -43 | 178.5 | 173 | 0 | 0 | 0 | 0 | 110.5 | L197 T198 T204 G205 Y225 A229 L232 | L197-V201 WeakPolarHBondContact O-CG2 3.37Å; L197-V201 PolarHBondContact O-N 3Å; T198-V201 PolarHBondContact O-N 3.36Å; V201-T204 PolarHBondContact O-N 2.87Å; V201-G205 PolarHBondContact O-N 3.43Å; V201-Y225 HydrophobicContact CG1-CE2 3.99Å; V201-Y225 WeakPolarHBondContact O-CE2 3.48Å; V201-Y225 PolarHBondContact O-OH 3.18Å; V201-A229 HydrophobicContact CG1-CB 4.28Å; V201-L232 HydrophobicContact CB-CD2 3.73Å; V201-L232 HydrophobicContact CG1-CD2 3.95Å; V201-L232 HydrophobicContact CG2-CB 4.41Å; V201-L232 HydrophobicContact CG2-CD2 3.87Å |
| 202 | M | 94.6 | Very high | 93.7 | Very high | 116 Ų | 116 | 68.7 Ų | 68.7 | 57% | 0.571 | 38% | 0.384 | S | S | * | . | H | α-helix | trans | -61.7 | -49.7 | 178.8 | -174.4 | -168.6 | 69.2 | 0 | 0 | 112.3 | T198 I199 G205 L206 | T198-M202 WeakPolarHBondContact O-CB 3.36Å; T198-M202 PolarHBondContact O-N 2.92Å; I199-M202 PolarHBondContact O-N 3.41Å; M202-G205 PolarHBondContact O-N 3.18Å; M202-L206 PolarHBondContact O-N 2.92Å |
| 203 | L | 96 | Very high | 93.5 | Very high | 97 Ų | 97 | 68.3 Ų | 68.3 | 51% | 0.508 | 39% | 0.387 | S | S | . | . | H | α-helix | trans | -66.5 | -38.7 | 179.3 | -68.3 | 179.8 | 0 | 0 | 0 | 111.6 | I199 G205 L206 A207 | I199-L203 HydrophobicContact CG2-CD1 3.69Å; I199-L203 HydrophobicContact CG2-CG 4.13Å; I199-L203 WeakPolarHBondContact O-CB 3.37Å; I199-L203 VanDerWaalsContact O-CG 3.3Å; I199-L203 WeakPolarHBondContact O-CG 3.34Å; I199-L203 PolarHBondContact O-N 3.27Å; L203-G205 VanDerWaalsContact C-N 3.34Å; L203-L206 PolarHBondContact O-N 3.1Å; L203-A207 PolarHBondContact O-N 2.89Å |
| 204 | T | 94.4 | Very high | 93.4 | Very high | 57 Ų | 57 | 69.6 Ų | 69.6 | 35% | 0.35 | 40% | 0.398 | S | S | . | . | H | α-helix | trans | -63.7 | -41.5 | 173.6 | -56.2 | 0 | 0 | 0 | 0 | 110.6 | V200 V201 A207 C208 Y225 | V200-T204 VanDerWaalsContact O-CB 3.23Å; V200-T204 WeakPolarHBondContact O-CB 3.4Å; V200-T204 PolarHBondContact O-N 3.19Å; V200-T204 PolarHBondContact O-OG1 3.21Å; V201-T204 PolarHBondContact O-N 2.87Å; T204-A207 WeakPolarHBondContact O-CB 3.44Å; T204-A207 PolarHBondContact O-N 2.66Å; T204-C208 PolarHBondContact O-N 3Å; T204-C208 PolarHBondContact O-SG 2.76Å; T204-Y225 HydrophobicContact CG2-CD2 4.06Å; T204-Y225 HydrophobicContact CG2-CE2 4.43Å |
| 205 | G | 92.4 | Very high | 93.1 | Very high | 8 Ų | 8 | 72.6 Ų | 72.6 | 8% | 0.082 | 42% | 0.419 | C | S | . | . | H | α-helix | trans | -61.8 | -43.8 | 176.2 | 0 | 0 | 0 | 0 | 0 | 112.8 | V201 M202 L203 A207 C208 V209 Y225 | V201-G205 PolarHBondContact O-N 3.43Å; M202-G205 PolarHBondContact O-N 3.18Å; L203-G205 VanDerWaalsContact C-N 3.34Å; G205-A207 VanDerWaalsContact C-N 3.34Å; G205-A207 PolarHBondContact O-N 2.8Å; G205-C208 WeakPolarHBondContact O-CB 3.47Å; G205-C208 PolarHBondContact O-N 2.88Å; G205-V209 WeakPolarHBondContact O-CG2 3.38Å; G205-V209 PolarHBondContact O-N 3.34Å; G205-Y225 VanDerWaalsContact CA-OH 3.29Å; G205-Y225 WeakPolarHBondContact CA-OH 3.39Å; G205-Y225 VanDerWaalsContact N-CE2 3.3Å |
| 206 | L | 92.9 | Very high | 92.7 | Very high | 105 Ų | 105 | 75.4 Ų | 75.4 | 55% | 0.55 | 43% | 0.431 | S | S | . | . | H | α-helix | trans | -61.1 | -43.5 | 173.7 | -176.9 | 63 | 0 | 0 | 0 | 111.4 | M202 L203 C208 V209 I210 | M202-L206 PolarHBondContact O-N 2.92Å; L203-L206 PolarHBondContact O-N 3.1Å; L206-C208 VanDerWaalsContact C-N 3.33Å; L206-C208 PolarHBondContact O-N 3.14Å; L206-V209 PolarHBondContact O-N 3.39Å; L206-I210 HydrophobicContact CG-CD1 4.36Å; L206-I210 WeakPolarHBondContact O-CG1 3.48Å; L206-I210 PolarHBondContact O-N 2.86Å |
| 207 | A | 92.8 | Very high | 92 | Very high | 49 Ų | 49 | 75.4 Ų | 75.4 | 41% | 0.405 | 43% | 0.434 | S | S | . | . | H | α-helix | trans | -61.3 | -41.2 | 173.9 | 0 | 0 | 0 | 0 | 0 | 111.9 | L203 T204 G205 V209 I210 V211 | L203-A207 PolarHBondContact O-N 2.89Å; T204-A207 WeakPolarHBondContact O-CB 3.44Å; T204-A207 PolarHBondContact O-N 2.66Å; G205-A207 VanDerWaalsContact C-N 3.34Å; G205-A207 PolarHBondContact O-N 2.8Å; A207-V209 PolarHBondContact O-N 2.81Å; A207-I210 PolarHBondContact O-N 3.33Å; A207-V211 VanDerWaalsContact O-CG2 3.29Å; A207-V211 WeakPolarHBondContact O-CG2 3.45Å; A207-V211 PolarHBondContact O-N 2.87Å |
| 208 | C | 91.4 | Very high | 91.5 | Very high | 13 Ų | 13 | 75.8 Ų | 75.8 | 9% | 0.088 | 44% | 0.436 | C | S | . | . | H | α-helix | trans | -61.6 | -41.9 | 175.9 | -65.1 | 0 | 0 | 0 | 0 | 111.8 | T204 G205 L206 V211 F212 L221 | T204-C208 PolarHBondContact O-N 3Å; T204-C208 PolarHBondContact O-SG 2.76Å; G205-C208 WeakPolarHBondContact O-CB 3.47Å; G205-C208 PolarHBondContact O-N 2.88Å; L206-C208 VanDerWaalsContact C-N 3.33Å; L206-C208 PolarHBondContact O-N 3.14Å; C208-V211 PolarHBondContact O-N 3.49Å; C208-F212 WeakPolarHBondContact O-CB 3.34Å; C208-F212 VanDerWaalsContact O-CG 3.29Å; C208-F212 WeakPolarHBondContact O-CG 3.34Å; C208-F212 PolarHBondContact O-N 2.96Å; C208-L221 HydrophobicContact CB-CD2 3.72Å; C208-L221 WeakPolarHBondContact SG-CD2 3.39Å |
| 209 | V | 89.6 | Confident | 91.1 | Very high | 97 Ų | 97 | 82.6 Ų | 82.6 | 59% | 0.588 | 46% | 0.457 | S | S | * | . | H | α-helix | trans | -60.8 | -45.2 | 175.1 | 171.1 | 0 | 0 | 0 | 0 | 111 | G205 L206 A207 F212 A213 | G205-V209 WeakPolarHBondContact O-CG2 3.38Å; G205-V209 PolarHBondContact O-N 3.34Å; L206-V209 PolarHBondContact O-N 3.39Å; A207-V209 PolarHBondContact O-N 2.81Å; V209-F212 PolarHBondContact O-N 3.02Å; V209-A213 WeakPolarHBondContact O-CB 3.48Å; V209-A213 PolarHBondContact O-N 3.24Å |
| 210 | I | 92 | Very high | 90.8 | Very high | 98 Ų | 98 | 83.8 Ų | 83.8 | 50% | 0.503 | 46% | 0.463 | S | S | . | . | H | α-helix | trans | -63.2 | -45.1 | 177.2 | -65.3 | 165 | 0 | 0 | 0 | 110.7 | L206 A207 F212 A213 V214 | L206-I210 HydrophobicContact CG-CD1 4.36Å; L206-I210 WeakPolarHBondContact O-CG1 3.48Å; L206-I210 PolarHBondContact O-N 2.86Å; A207-I210 PolarHBondContact O-N 3.33Å; I210-F212 PolarHBondContact O-N 3.29Å; I210-A213 PolarHBondContact O-N 3.44Å; I210-V214 WeakPolarHBondContact O-CG2 3.35Å; I210-V214 PolarHBondContact O-N 3.16Å; I210-V214 VanDerWaalsContact O-N 3.1Å |
| 211 | V | 91.4 | Very high | 90.5 | Very high | 64 Ų | 64 | 82.4 Ų | 82.4 | 39% | 0.388 | 45% | 0.453 | S | S | . | . | H | α-helix | trans | -60.6 | -44.3 | 177.6 | 169.7 | 0 | 0 | 0 | 0 | 110.9 | A207 C208 A213 V214 S215 L221 | A207-V211 VanDerWaalsContact O-CG2 3.29Å; A207-V211 WeakPolarHBondContact O-CG2 3.45Å; A207-V211 PolarHBondContact O-N 2.87Å; C208-V211 PolarHBondContact O-N 3.49Å; V211-A213 VanDerWaalsContact C-N 3.3Å; V211-A213 PolarHBondContact O-N 3.11Å; V211-V214 PolarHBondContact O-N 3.08Å; V211-S215 WeakPolarHBondContact O-CA 3.27Å; V211-S215 WeakPolarHBondContact O-CB 3.46Å; V211-S215 PolarHBondContact O-N 3.24Å; V211-L221 HydrophobicContact CG1-CD1 4.39Å |
| 212 | F | 88.7 | Confident | 90.2 | Very high | 61 Ų | 61 | 83.3 Ų | 83.3 | 27% | 0.268 | 46% | 0.456 | S | S | . | . | H | α-helix | trans | -71.5 | -21.4 | 177.7 | -68.8 | -11.8 | 0 | 0 | 0 | 114 | C208 V209 I210 S215 N218 L221 Q222 | C208-F212 WeakPolarHBondContact O-CB 3.34Å; C208-F212 VanDerWaalsContact O-CG 3.29Å; C208-F212 WeakPolarHBondContact O-CG 3.34Å; C208-F212 PolarHBondContact O-N 2.96Å; V209-F212 PolarHBondContact O-N 3.02Å; I210-F212 PolarHBondContact O-N 3.29Å; F212-S215 CarbonylContact C-O 3.54Å; F212-S215 VanDerWaalsContact O-O 3.05Å; F212-N218 HydrophobicContact CE1-CB 4.31Å; F212-L221 HydrophobicContact CE1-CB 4.33Å; F212-L221 HydrophobicContact CE1-CD1 4.41Å; F212-L221 HydrophobicContact CE1-CD2 3.75Å; F212-L221 HydrophobicContact CE1-CG 4.39Å; F212-L221 HydrophobicContact CE2-CD2 4.28Å; F212-L221 HydrophobicContact CZ-CB 4.38Å; F212-L221 HydrophobicContact CZ-CD2 3.51Å; F212-L221 HydrophobicContact CZ-CG 4.46Å; F212-Q222 HydrophobicContact CE2-CB 4.49Å; F212-Q222 HydrophobicContact CZ-CB 4.19Å |
| 213 | A | 89 | Confident | 90 | Very high | 83 Ų | 83 | 80.9 Ų | 80.9 | 69% | 0.686 | 45% | 0.447 | S | S | * | . | H | α-helix | trans | -76.9 | -32.3 | 172.8 | 0 | 0 | 0 | 0 | 0 | 112.4 | V209 I210 V211 | V209-A213 WeakPolarHBondContact O-CB 3.48Å; V209-A213 PolarHBondContact O-N 3.24Å; I210-A213 PolarHBondContact O-N 3.44Å; V211-A213 VanDerWaalsContact C-N 3.3Å; V211-A213 PolarHBondContact O-N 3.11Å |
| 214 | V | 91.9 | Very high | 89.9 | Confident | 123 Ų | 123 | 80.4 Ų | 80.4 | 75% | 0.745 | 45% | 0.448 | S | S | * | . | H | α-helix | trans | -97.1 | -30.4 | -177.5 | 178.8 | 0 | 0 | 0 | 0 | 112.6 | I210 V211 | I210-V214 WeakPolarHBondContact O-CG2 3.35Å; I210-V214 PolarHBondContact O-N 3.16Å; I210-V214 VanDerWaalsContact O-N 3.1Å; V211-V214 PolarHBondContact O-N 3.08Å |
| 215 | S | 88.9 | Confident | 89.9 | Confident | 67 Ų | 67 | 80.8 Ų | 80.8 | 47% | 0.469 | 44% | 0.444 | S | S | . | . | S | Bend | trans | -119.1 | 162.3 | -175.4 | -54.9 | 0 | 0 | 0 | 0 | 111.3 | V211 F212 | V211-S215 WeakPolarHBondContact O-CA 3.27Å; V211-S215 WeakPolarHBondContact O-CB 3.46Å; V211-S215 PolarHBondContact O-N 3.24Å; F212-S215 CarbonylContact C-O 3.54Å; F212-S215 VanDerWaalsContact O-O 3.05Å |
| 216 | K | 85.8 | Confident | 90 | Very high | 192 Ų | 192 | 80.6 Ų | 80.6 | 84% | 0.835 | 44% | 0.442 | S | S | * | . | trans | -59.1 | 137.5 | 171.7 | -67.2 | -178.3 | -179 | 178.9 | 0 | 110 | N218 | K216-N218 PolarHBondContact O-N 2.97Š| ||
| 217 | P | 81.3 | Confident | 90.1 | Very high | 86 Ų | 86 | 77.2 Ų | 77.2 | 56% | 0.558 | 43% | 0.433 | S | S | * | . | trans | -51.9 | 128.7 | 174.8 | -27.4 | 34.6 | 0 | 0 | 0 | 111.5 | ||||
| 218 | N | 85.7 | Confident | 90.3 | Very high | 74 Ų | 74 | 79 Ų | 79 | 40% | 0.396 | 44% | 0.435 | S | S | . | . | trans | -105 | 116.6 | 178.7 | -176.5 | -28 | 0 | 0 | 0 | 109.4 | F212 K216 I220 L221 Q222 | F212-N218 HydrophobicContact CE1-CB 4.31Å; K216-N218 PolarHBondContact O-N 2.97Å; N218-I220 VanDerWaalsContact C-N 3.3Å; N218-I220 PolarHBondContact O-N 3.28Å; N218-I220 WeakPolarHBondContact OD1-CB 3.35Å; N218-I220 PolarHBondContact OD1-N 2.97Å; N218-L221 HydrophobicContact CB-CB 4.07Å; N218-L221 PolarHBondContact O-N 2.9Å; N218-L221 PolarHBondContact OD1-N 3.46Å; N218-Q222 PolarHBondContact O-N 3.49Å | ||
| 219 | W | 86 | Confident | 90.5 | Very high | 182 Ų | 182 | 78.7 Ų | 78.7 | 69% | 0.689 | 43% | 0.433 | S | S | * | . | H | α-helix | trans | -61.3 | -36.9 | -177.4 | 79.2 | -90.7 | 0 | 0 | 0 | 112.7 | Q222 V223 | W219-Q222 PolarHBondContact O-N 2.71Å; W219-V223 HydrophobicContact CE3-CG2 4Å; W219-V223 HydrophobicContact CZ3-CG2 4.33Å; W219-V223 WeakPolarHBondContact O-CG2 3.41Å; W219-V223 PolarHBondContact O-N 3.36Å |
| 220 | I | 89.9 | Confident | 90.9 | Very high | 89 Ų | 89 | 74.9 Ų | 74.9 | 46% | 0.456 | 41% | 0.412 | S | S | . | . | H | α-helix | trans | -63.6 | -47 | 179.4 | -57.8 | 174.2 | 0 | 0 | 0 | 109.1 | N218 Q222 V223 V224 | N218-I220 VanDerWaalsContact C-N 3.3Å; N218-I220 PolarHBondContact O-N 3.28Å; N218-I220 WeakPolarHBondContact OD1-CB 3.35Å; N218-I220 PolarHBondContact OD1-N 2.97Å; I220-Q222 VanDerWaalsContact C-N 3.32Å; I220-Q222 PolarHBondContact O-N 3.22Å; I220-V223 PolarHBondContact O-N 3.44Å; I220-V224 HydrophobicContact CG2-CG2 4.2Å; I220-V224 WeakPolarHBondContact O-CB 3.26Å; I220-V224 VanDerWaalsContact O-CG2 3.26Å; I220-V224 WeakPolarHBondContact O-CG2 3.36Å; I220-V224 PolarHBondContact O-N 2.9Å |
| 221 | L | 90.1 | Very high | 91.1 | Very high | 51 Ų | 51 | 75.9 Ų | 75.9 | 27% | 0.267 | 42% | 0.417 | S | S | . | . | H | α-helix | trans | -63.2 | -40.8 | 179.3 | -172.1 | 160.1 | 0 | 0 | 0 | 110.9 | C208 V211 F212 N218 Y225 | C208-L221 HydrophobicContact CB-CD2 3.72Å; C208-L221 WeakPolarHBondContact SG-CD2 3.39Å; V211-L221 HydrophobicContact CG1-CD1 4.39Å; F212-L221 HydrophobicContact CE1-CB 4.33Å; F212-L221 HydrophobicContact CE1-CD1 4.41Å; F212-L221 HydrophobicContact CE1-CD2 3.75Å; F212-L221 HydrophobicContact CE1-CG 4.39Å; F212-L221 HydrophobicContact CE2-CD2 4.28Å; F212-L221 HydrophobicContact CZ-CB 4.38Å; F212-L221 HydrophobicContact CZ-CD2 3.51Å; F212-L221 HydrophobicContact CZ-CG 4.46Å; N218-L221 HydrophobicContact CB-CB 4.07Å; N218-L221 PolarHBondContact O-N 2.9Å; N218-L221 PolarHBondContact OD1-N 3.46Å; L221-Y225 WeakPolarHBondContact O-CB 3.34Å; L221-Y225 PolarHBondContact O-N 3.33Å |
| 222 | Q | 88.9 | Confident | 91.4 | Very high | 37 Ų | 37 | 73.3 Ų | 73.3 | 17% | 0.173 | 40% | 0.402 | C | S | . | . | H | α-helix | trans | -60.7 | -47 | 174.8 | -176.1 | 179.7 | -27.4 | 0 | 0 | 111.9 | F212 N218 W219 I220 G226 S277 | F212-Q222 HydrophobicContact CE2-CB 4.49Å; F212-Q222 HydrophobicContact CZ-CB 4.19Å; N218-Q222 PolarHBondContact O-N 3.49Å; W219-Q222 PolarHBondContact O-N 2.71Å; I220-Q222 VanDerWaalsContact C-N 3.32Å; I220-Q222 PolarHBondContact O-N 3.22Å; Q222-G226 PolarHBondContact O-N 3.17Å; Q222-S277 PolarHBondContact NE2-O 2.86Å |
| 223 | V | 92 | Very high | 91.8 | Very high | 65 Ų | 65 | 72.7 Ų | 72.7 | 39% | 0.394 | 40% | 0.399 | S | S | . | . | H | α-helix | trans | -67 | -44.5 | 179.8 | 172 | 0 | 0 | 0 | 0 | 111.5 | W219 I220 G226 G227 | W219-V223 HydrophobicContact CE3-CG2 4Å; W219-V223 HydrophobicContact CZ3-CG2 4.33Å; W219-V223 WeakPolarHBondContact O-CG2 3.41Å; W219-V223 PolarHBondContact O-N 3.36Å; I220-V223 PolarHBondContact O-N 3.44Å; V223-G226 PolarHBondContact O-N 2.88Å; V223-G227 PolarHBondContact O-N 3.47Å |
| 224 | V | 93.3 | Very high | 92.2 | Very high | 87 Ų | 87 | 69.2 Ų | 69.2 | 53% | 0.527 | 37% | 0.371 | S | S | . | . | H | α-helix | trans | -63.2 | -49.2 | 178.7 | 170.5 | 0 | 0 | 0 | 0 | 110.8 | I220 G227 L228 | I220-V224 HydrophobicContact CG2-CG2 4.2Å; I220-V224 WeakPolarHBondContact O-CB 3.26Å; I220-V224 VanDerWaalsContact O-CG2 3.26Å; I220-V224 WeakPolarHBondContact O-CG2 3.36Å; I220-V224 PolarHBondContact O-N 2.9Å; V224-G227 PolarHBondContact O-N 3.17Å; V224-L228 HydrophobicContact CG1-CD1 4.47Å; V224-L228 WeakPolarHBondContact O-CG 3.49Å; V224-L228 PolarHBondContact O-N 3.01Å |
| 225 | Y | 93.8 | Very high | 92.4 | Very high | 66 Ų | 66 | 65.4 Ų | 65.4 | 26% | 0.259 | 35% | 0.348 | S | S | . | . | H | α-helix | trans | -62.8 | -45.3 | 178.2 | 177.1 | -101.7 | 0 | 0 | 0 | 111.6 | V201 T204 G205 L221 G227 L228 A229 | V201-Y225 HydrophobicContact CG1-CE2 3.99Å; V201-Y225 WeakPolarHBondContact O-CE2 3.48Å; V201-Y225 PolarHBondContact O-OH 3.18Å; T204-Y225 HydrophobicContact CG2-CD2 4.06Å; T204-Y225 HydrophobicContact CG2-CE2 4.43Å; G205-Y225 VanDerWaalsContact CA-OH 3.29Å; G205-Y225 WeakPolarHBondContact CA-OH 3.39Å; G205-Y225 VanDerWaalsContact N-CE2 3.3Å; L221-Y225 WeakPolarHBondContact O-CB 3.34Å; L221-Y225 PolarHBondContact O-N 3.33Å; Y225-G227 VanDerWaalsContact C-N 3.29Å; Y225-G227 PolarHBondContact O-N 2.85Å; Y225-L228 PolarHBondContact O-N 3.42Å; Y225-A229 WeakPolarHBondContact O-CB 3.3Å; Y225-A229 PolarHBondContact O-N 2.96Å |
| 226 | G | 94.4 | Very high | 92.8 | Very high | 4 Ų | 4 | 64.9 Ų | 64.9 | 4% | 0.041 | 34% | 0.336 | C | S | . | . | H | α-helix | trans | -60.5 | -38.1 | 175.6 | 0 | 0 | 0 | 0 | 0 | 112.1 | Q222 V223 A229 A230 I274 F278 | Q222-G226 PolarHBondContact O-N 3.17Å; V223-G226 PolarHBondContact O-N 2.88Å; G226-A229 PolarHBondContact O-N 3.03Å; G226-A230 VanDerWaalsContact O-CB 3.32Å; G226-A230 WeakPolarHBondContact O-CB 3.5Å; G226-A230 PolarHBondContact O-N 3.13Å; G226-I274 WeakPolarHBondContact O-CG2 3.32Å; G226-F278 VanDerWaalsContact C-CZ 3.43Å |
| 227 | G | 95.6 | Very high | 93.4 | Very high | 34 Ų | 34 | 55.9 Ų | 55.9 | 35% | 0.351 | 30% | 0.297 | S | S | . | . | H | α-helix | trans | -63.3 | -43.7 | 175.8 | 0 | 0 | 0 | 0 | 0 | 112.7 | V223 V224 Y225 A230 L231 | V223-G227 PolarHBondContact O-N 3.47Å; V224-G227 PolarHBondContact O-N 3.17Å; Y225-G227 VanDerWaalsContact C-N 3.29Å; Y225-G227 PolarHBondContact O-N 2.85Å; G227-A230 PolarHBondContact O-N 3.47Å; G227-L231 PolarHBondContact O-N 3.28Å |
| 228 | L | 96.4 | Very high | 94.2 | Very high | 87 Ų | 87 | 52 Ų | 52 | 46% | 0.455 | 27% | 0.273 | S | S | . | . | H | α-helix | trans | -64.2 | -41.6 | 174.4 | -67.8 | 173.4 | 0 | 0 | 0 | 111.9 | V224 Y225 L231 L232 | V224-L228 HydrophobicContact CG1-CD1 4.47Å; V224-L228 WeakPolarHBondContact O-CG 3.49Å; V224-L228 PolarHBondContact O-N 3.01Å; Y225-L228 PolarHBondContact O-N 3.42Å; L228-L231 PolarHBondContact O-N 3.33Å; L228-L232 PolarHBondContact O-N 2.89Å |
| 229 | A | 96.5 | Very high | 94.7 | Very high | 5 Ų | 5 | 49.5 Ų | 49.5 | 4% | 0.041 | 26% | 0.258 | C | S | . | . | H | α-helix | trans | -65.7 | -42.6 | 176.2 | 0 | 0 | 0 | 0 | 0 | 111.7 | V201 Y225 G226 L231 L232 F233 I274 | V201-A229 HydrophobicContact CG1-CB 4.28Å; Y225-A229 WeakPolarHBondContact O-CB 3.3Å; Y225-A229 PolarHBondContact O-N 2.96Å; G226-A229 PolarHBondContact O-N 3.03Å; A229-L231 VanDerWaalsContact C-N 3.33Å; A229-L231 PolarHBondContact O-N 3Å; A229-L232 PolarHBondContact O-N 3.26Å; A229-F233 WeakPolarHBondContact O-CD2 3.43Å; A229-F233 PolarHBondContact O-N 2.78Å; A229-I274 HydrophobicContact CB-CD1 3.69Å; A229-I274 HydrophobicContact CB-CG1 4.3Å |
| 230 | A | 97 | Very high | 95.2 | Very high | 18 Ų | 18 | 41.2 Ų | 41.2 | 15% | 0.149 | 23% | 0.227 | C | C | . | . | H | α-helix | trans | -61.5 | -41.6 | 176.2 | 0 | 0 | 0 | 0 | 0 | 111.5 | G226 G227 G234 L271 I274 I275 | G226-A230 VanDerWaalsContact O-CB 3.32Å; G226-A230 WeakPolarHBondContact O-CB 3.5Å; G226-A230 PolarHBondContact O-N 3.13Å; G227-A230 PolarHBondContact O-N 3.47Å; A230-G234 PolarHBondContact O-N 3.31Å; A230-L271 HydrophobicContact CB-CD1 4.11Å; A230-I274 HydrophobicContact CB-CG2 3.8Å; A230-I275 HydrophobicContact CB-CD1 4.44Å |
| 231 | L | 96.8 | Very high | 95.5 | Very high | 118 Ų | 118 | 37 Ų | 37 | 62% | 0.618 | 21% | 0.205 | S | C | * | . | H | α-helix | trans | -59.5 | -48.2 | 173.1 | -172.3 | 88.9 | 0 | 0 | 0 | 110.8 | G227 L228 A229 G234 V235 | G227-L231 PolarHBondContact O-N 3.28Å; L228-L231 PolarHBondContact O-N 3.33Å; A229-L231 VanDerWaalsContact C-N 3.33Å; A229-L231 PolarHBondContact O-N 3Å; L231-G234 PolarHBondContact O-N 3.01Å; L231-V235 WeakPolarHBondContact O-CG2 3.38Å; L231-V235 PolarHBondContact O-N 3.31Å |
| 232 | L | 97 | Very high | 95.8 | Very high | 11 Ų | 11 | 34.6 Ų | 34.6 | 6% | 0.058 | 19% | 0.193 | C | C | . | . | H | α-helix | trans | -61.2 | -50.6 | -179.6 | 179.4 | 64 | 0 | 0 | 0 | 112 | L197 V201 L228 A229 G234 V235 Y236 | L197-L232 HydrophobicContact CB-CD1 3.82Å; V201-L232 HydrophobicContact CB-CD2 3.73Å; V201-L232 HydrophobicContact CG1-CD2 3.95Å; V201-L232 HydrophobicContact CG2-CB 4.41Å; V201-L232 HydrophobicContact CG2-CD2 3.87Å; L228-L232 PolarHBondContact O-N 2.89Å; A229-L232 PolarHBondContact O-N 3.26Å; L232-G234 VanDerWaalsContact C-N 3.26Å; L232-G234 PolarHBondContact O-N 3.47Å; L232-V235 WeakPolarHBondContact O-CB 3.48Å; L232-V235 PolarHBondContact O-N 2.7Å; L232-V235 VanDerWaalsContact O-N 3.1Å; L232-Y236 HydrophobicContact CD1-CD2 4.02Å; L232-Y236 HydrophobicContact CD1-CE2 3.75Å; L232-Y236 HydrophobicContact CD2-CE2 4.19Å; L232-Y236 HydrophobicContact CG-CD2 3.87Å; L232-Y236 HydrophobicContact CG-CE2 3.8Å; L232-Y236 WeakPolarHBondContact O-CD2 3.4Å; L232-Y236 PolarHBondContact O-N 2.98Å |
| 233 | F | 96.6 | Very high | 96 | Very high | 47 Ų | 47 | 34.2 Ų | 34.2 | 21% | 0.206 | 19% | 0.191 | C | C | . | . | H | α-helix | trans | -65.9 | -29.8 | 177.5 | -82 | -74.5 | 0 | 0 | 0 | 112.4 | A229 Y236 L237 N270 L271 I274 | A229-F233 WeakPolarHBondContact O-CD2 3.43Å; A229-F233 PolarHBondContact O-N 2.78Å; F233-Y236 PolarHBondContact O-N 2.94Å; F233-L237 WeakPolarHBondContact O-CB 3.39Å; F233-L237 PolarHBondContact O-N 3.47Å; F233-N270 HydrophobicContact CD1-CB 3.8Å; F233-N270 HydrophobicContact CD2-CB 4.19Å; F233-N270 HydrophobicContact CE1-CB 3.51Å; F233-N270 WeakPolarHBondContact CE1-ND2 3.48Å; F233-N270 HydrophobicContact CE2-CB 3.93Å; F233-N270 HydrophobicContact CG-CB 4.12Å; F233-N270 HydrophobicContact CZ-CB 3.58Å; F233-L271 HydrophobicContact CB-CD1 4.49Å; F233-I274 HydrophobicContact CD2-CD1 3.34Å; F233-I274 HydrophobicContact CE2-CD1 3.79Å; F233-I274 HydrophobicContact CG-CD1 4.26Å |
| 234 | G | 97.6 | Very high | 96.3 | Very high | 10 Ų | 10 | 31.1 Ų | 31.1 | 10% | 0.103 | 17% | 0.172 | C | C | . | . | H | α-helix | trans | -65.7 | -39 | 169.7 | 0 | 0 | 0 | 0 | 0 | 113 | I176 A230 L231 L232 A238 | I176-G234 WeakPolarHBondContact CG2-O 3.29Å; A230-G234 PolarHBondContact O-N 3.31Å; L231-G234 PolarHBondContact O-N 3.01Å; L232-G234 VanDerWaalsContact C-N 3.26Å; L232-G234 PolarHBondContact O-N 3.47Å; G234-A238 PolarHBondContact O-N 3.49Å; G234-A238 VanDerWaalsContact O-N 3.14Å |
| 235 | V | 97 | Very high | 96.3 | Very high | 44 Ų | 44 | 29.3 Ų | 29.3 | 27% | 0.267 | 16% | 0.159 | S | C | . | . | H | α-helix | trans | -67.1 | -41.3 | 173 | 172.4 | 0 | 0 | 0 | 0 | 111.1 | I194 L231 L232 A238 F239 | I194-V235 HydrophobicContact CD1-CG1 3.99Å; I194-V235 HydrophobicContact CG1-CG1 3.89Å; L231-V235 WeakPolarHBondContact O-CG2 3.38Å; L231-V235 PolarHBondContact O-N 3.31Å; L232-V235 WeakPolarHBondContact O-CB 3.48Å; L232-V235 PolarHBondContact O-N 2.7Å; L232-V235 VanDerWaalsContact O-N 3.1Å; V235-A238 PolarHBondContact O-N 2.89Å; V235-F239 WeakPolarHBondContact O-CB 3.23Å; V235-F239 PolarHBondContact O-N 3.05Å |
| 236 | Y | 97.2 | Very high | 96.1 | Very high | 56 Ų | 56 | 27 Ų | 27 | 22% | 0.22 | 16% | 0.155 | C | C | . | . | H | α-helix | trans | -60.6 | -46.4 | 173.6 | -86.7 | -64 | 0 | 0 | 0 | 112 | I194 T198 L232 F233 A238 F239 D240 D267 | I194-Y236 HydrophobicContact CG2-CD1 4Å; I194-Y236 HydrophobicContact CG2-CE1 3.39Å; I194-Y236 HydrophobicContact CG2-CE2 4.06Å; I194-Y236 VanDerWaalsContact CG2-CZ 3.44Å; T198-Y236 WeakPolarHBondContact CB-OH 3.16Å; T198-Y236 HydrophobicContact CG2-CE2 4.5Å; T198-Y236 WeakPolarHBondContact OG1-CE2 3.33Å; T198-Y236 VanDerWaalsContact OG1-CZ 3.23Å; T198-Y236 PolarHBondContact OG1-OH 2.86Å; L232-Y236 HydrophobicContact CD1-CD2 4.02Å; L232-Y236 HydrophobicContact CD1-CE2 3.75Å; L232-Y236 HydrophobicContact CD2-CE2 4.19Å; L232-Y236 HydrophobicContact CG-CD2 3.87Å; L232-Y236 HydrophobicContact CG-CE2 3.8Å; L232-Y236 WeakPolarHBondContact O-CD2 3.4Å; L232-Y236 PolarHBondContact O-N 2.98Å; F233-Y236 PolarHBondContact O-N 2.94Å; Y236-A238 PolarHBondContact O-N 3.36Å; Y236-F239 CarbonylContact O-C 3.53Å; Y236-F239 WeakPolarHBondContact O-CA 3.43Å; Y236-F239 WeakPolarHBondContact O-CB 3.43Å; Y236-F239 PolarHBondContact O-N 2.82Å; Y236-D240 PolarHBondContact O-N 3.33Å; Y236-D267 VanDerWaalsContact C-OD2 3.27Å; Y236-D267 WeakPolarHBondContact CB-OD1 3.45Å |
| 237 | L | 97.9 | Very high | 95.8 | Very high | 3 Ų | 3 | 30.1 Ų | 30.1 | 2% | 0.016 | 19% | 0.187 | C | C | . | . | H | α-helix | trans | -57.3 | -40.3 | 176.6 | -178.5 | 62.9 | 0 | 0 | 0 | 112 | C173 I176 F233 T241 L264 D267 V268 | C173-L237 HydrophobicContact CB-CD2 4.03Å; I176-L237 HydrophobicContact CB-CD2 4.07Å; I176-L237 HydrophobicContact CD1-CD2 4.38Å; I176-L237 HydrophobicContact CG2-CB 4.07Å; I176-L237 HydrophobicContact CG2-CD2 4Å; I176-L237 HydrophobicContact CG2-CG 4Å; F233-L237 WeakPolarHBondContact O-CB 3.39Å; F233-L237 PolarHBondContact O-N 3.47Å; L237-T241 VanDerWaalsContact O-CB 3.23Å; L237-T241 WeakPolarHBondContact O-CB 3.27Å; L237-T241 PolarHBondContact O-N 3Å; L237-T241 PolarHBondContact O-OG1 2.94Å; L237-L264 HydrophobicContact CD1-CD2 3.67Å; L237-D267 VanDerWaalsContact CA-OD2 3.27Å; L237-D267 WeakPolarHBondContact CA-OD2 3.28Å; L237-D267 HydrophobicContact CB-CB 4.09Å; L237-D267 HydrophobicContact CD1-CB 4.12Å; L237-D267 PolarHBondContact N-OD2 3.35Å; L237-V268 HydrophobicContact CD1-CG2 4.3Å |
| 238 | A | 97.6 | Very high | 95.4 | Very high | 5 Ų | 5 | 31.3 Ų | 31.3 | 4% | 0.041 | 18% | 0.181 | C | C | . | . | H | α-helix | trans | -67 | -43.7 | 175.2 | 0 | 0 | 0 | 0 | 0 | 112.2 | I176 A180 I187 G234 V235 Y236 Q242 | I176-A238 HydrophobicContact CG2-CB 3.79Å; A180-A238 HydrophobicContact CB-CB 3.97Å; I187-A238 HydrophobicContact CD1-CB 3.53Å; G234-A238 PolarHBondContact O-N 3.49Å; G234-A238 VanDerWaalsContact O-N 3.14Å; V235-A238 PolarHBondContact O-N 2.89Å; Y236-A238 PolarHBondContact O-N 3.36Å; A238-Q242 WeakPolarHBondContact O-CG 3.43Å; A238-Q242 PolarHBondContact O-N 3.43Å |
| 239 | F | 96.7 | Very high | 94.9 | Very high | 21 Ų | 21 | 33 Ų | 33 | 9% | 0.092 | 19% | 0.187 | C | C | . | . | H | α-helix | trans | -60.1 | -51.4 | 176.2 | 176.7 | -86.1 | 0 | 0 | 0 | 111.5 | I187 T188 I194 V235 Y236 T241 Q242 H243 L250 | I187-F239 HydrophobicContact CG2-CB 4.13Å; I187-F239 HydrophobicContact CG2-CD2 4.39Å; T188-F239 HydrophobicContact CG2-CD2 4.45Å; T188-F239 HydrophobicContact CG2-CE2 4.42Å; I194-F239 HydrophobicContact CD1-CB 4.03Å; I194-F239 HydrophobicContact CD1-CD2 3.45Å; I194-F239 VanDerWaalsContact CD1-CD2 3.45Å; I194-F239 HydrophobicContact CD1-CE2 4.17Å; I194-F239 HydrophobicContact CD1-CG 3.95Å; V235-F239 WeakPolarHBondContact O-CB 3.23Å; V235-F239 PolarHBondContact O-N 3.05Å; Y236-F239 CarbonylContact O-C 3.53Å; Y236-F239 WeakPolarHBondContact O-CA 3.43Å; Y236-F239 WeakPolarHBondContact O-CB 3.43Å; Y236-F239 PolarHBondContact O-N 2.82Å; F239-T241 PolarHBondContact O-N 2.78Å; F239-Q242 PolarHBondContact O-N 2.67Å; F239-Q242 VanDerWaalsContact O-N 3.13Å; F239-H243 WeakPolarHBondContact O-CB 3.26Å; F239-H243 PolarHBondContact O-N 2.91Å; F239-L250 HydrophobicContact CZ-CD1 4.3Å |
| 240 | D | 96.7 | Very high | 94.5 | Very high | 7 Ų | 7 | 36 Ų | 36 | 4% | 0.037 | 20% | 0.202 | C | C | . | . | H | α-helix | trans | -68.4 | -35.1 | -178.3 | -76.7 | -46 | 0 | 0 | 0 | 111.9 | Y236 Q242 H243 I244 Q263 L264 D267 | Y236-D240 PolarHBondContact O-N 3.33Å; D240-Q242 PolarHBondContact O-N 3.45Å; D240-H243 PolarHBondContact O-N 2.89Å; D240-I244 WeakPolarHBondContact O-CD1 3.16Å; D240-I244 WeakPolarHBondContact O-CG1 3.24Å; D240-I244 PolarHBondContact O-N 3.44Å; D240-Q263 HydrophobicContact CB-CB 4.4Å; D240-Q263 WeakPolarHBondContact OD2-CB 3.18Å; D240-L264 HydrophobicContact CB-CD2 3.85Å; D240-L264 HydrophobicContact CB-CG 4.45Å; D240-D267 VanDerWaalsContact OD2-OD2 3.08Å |
| 241 | T | 97.2 | Very high | 94.2 | Very high | 0 Ų | 0 | 40.3 Ų | 40.3 | 0% | 0 | 22% | 0.219 | C | C | . | . | H | α-helix | trans | -59.5 | -46.6 | 169.5 | -61.4 | 0 | 0 | 0 | 0 | 110.9 | A180 I181 L237 F239 H243 I244 M245 | A180-T241 HydrophobicContact CB-CG2 3.9Å; I181-T241 HydrophobicContact CD1-CG2 4.32Å; I181-T241 HydrophobicContact CG1-CG2 3.85Å; L237-T241 VanDerWaalsContact O-CB 3.23Å; L237-T241 WeakPolarHBondContact O-CB 3.27Å; L237-T241 PolarHBondContact O-N 3Å; L237-T241 PolarHBondContact O-OG1 2.94Å; F239-T241 PolarHBondContact O-N 2.78Å; T241-H243 VanDerWaalsContact C-N 3.35Å; T241-H243 PolarHBondContact O-N 3.08Å; T241-I244 PolarHBondContact O-N 3.28Å; T241-M245 HydrophobicContact CG2-CG 4.13Å; T241-M245 WeakPolarHBondContact O-CB 3.17Å; T241-M245 WeakPolarHBondContact O-CG 3.25Å; T241-M245 PolarHBondContact O-N 3.17Å |
| 242 | Q | 96.5 | Very high | 94 | Very high | 2 Ų | 2 | 35.3 Ų | 35.3 | 1% | 0.009 | 19% | 0.193 | C | C | . | . | H | α-helix | trans | -64.2 | -39.7 | 177.3 | -74.9 | -169.6 | -7.3 | 0 | 0 | 112.4 | A180 T183 I185 I187 T188 A238 F239 D240 I244 M245 G246 R248 | A180-Q242 HydrophobicContact CB-CG 4.22Å; A180-Q242 WeakPolarHBondContact O-CG 3.43Å; A180-Q242 PolarHBondContact O-NE2 2.97Å; A180-Q242 VanDerWaalsContact O-NE2 3.1Å; T183-Q242 VanDerWaalsContact CG2-NE2 3.32Å; I185-Q242 PolarHBondContact O-NE2 3.27Å; I187-Q242 VanDerWaalsContact CB-OE1 3.32Å; T188-Q242 HydrophobicContact CG2-CB 3.81Å; A238-Q242 WeakPolarHBondContact O-CG 3.43Å; A238-Q242 PolarHBondContact O-N 3.43Å; F239-Q242 PolarHBondContact O-N 2.67Å; F239-Q242 VanDerWaalsContact O-N 3.13Å; D240-Q242 PolarHBondContact O-N 3.45Å; Q242-I244 PolarHBondContact O-N 3.3Å; Q242-M245 PolarHBondContact O-N 3.39Å; Q242-G246 PolarHBondContact O-N 3.07Å; Q242-R248 HydrophobicContact CB-CG 4.33Å |
| 243 | H | 93.2 | Very high | 93.8 | Very high | 28 Ų | 28 | 37.8 Ų | 37.8 | 13% | 0.13 | 21% | 0.211 | C | C | . | . | H | α-helix | trans | -61.3 | -32.7 | 177.3 | -156.4 | -169.8 | 0 | 0 | 0 | 112 | R66 F239 D240 T241 L250 L252 | R66-H243 PolarHBondContact NH2-O 3.03Å; F239-H243 WeakPolarHBondContact O-CB 3.26Å; F239-H243 PolarHBondContact O-N 2.91Å; D240-H243 PolarHBondContact O-N 2.89Å; T241-H243 VanDerWaalsContact C-N 3.35Å; T241-H243 PolarHBondContact O-N 3.08Å; H243-L250 PolarHBondContact CD2-O 2.55Å; H243-L250 VanDerWaalsContact CD2-O 3.29Å; H243-L252 HydrophobicContact CB-CD1 4.26Å; H243-L252 HydrophobicContact CB-CG 4.46Å; H243-L252 PolarHBondContact CD2-N 3.05Å; H243-L252 VanDerWaalsContact CD2-N 3.33Å; H243-L252 PolarHBondContact O-N 3.1Å |
| 244 | I | 96.3 | Very high | 93.6 | Very high | 0 Ų | 0 | 37.4 Ų | 37.4 | 0% | 0 | 22% | 0.216 | C | C | . | . | H | α-helix | trans | -86.3 | -29.5 | 176.8 | -67.1 | 159.7 | 0 | 0 | 0 | 113.4 | R66 F69 I70 V73 Y74 D240 T241 Q242 L252 L264 | R66-I244 PolarHBondContact NE-O 3.36Å; R66-I244 PolarHBondContact NH2-O 3.38Å; F69-I244 HydrophobicContact CE1-CB 4.36Å; F69-I244 HydrophobicContact CE1-CG2 3.96Å; I70-I244 HydrophobicContact CG1-CG2 4.12Å; I70-I244 VanDerWaalsContact CG1-O 3.28Å; I70-I244 WeakPolarHBondContact CG1-O 3.37Å; V73-I244 HydrophobicContact CB-CG2 4.39Å; V73-I244 HydrophobicContact CG1-CD1 3.78Å; V73-I244 HydrophobicContact CG1-CG1 4.37Å; V73-I244 HydrophobicContact CG1-CG2 4.28Å; Y74-I244 HydrophobicContact CE2-CG2 4.14Å; D240-I244 WeakPolarHBondContact O-CD1 3.16Å; D240-I244 WeakPolarHBondContact O-CG1 3.24Å; D240-I244 PolarHBondContact O-N 3.44Å; T241-I244 PolarHBondContact O-N 3.28Å; Q242-I244 PolarHBondContact O-N 3.3Å; I244-L252 HydrophobicContact CG1-CD1 3.82Å; I244-L264 HydrophobicContact CD1-CD1 3.24Å; I244-L264 HydrophobicContact CD1-CD2 4.2Å; I244-L264 HydrophobicContact CD1-CG 3.48Å; I244-L264 VanDerWaalsContact CD1-CG 3.48Å |
| 245 | M | 94.6 | Very high | 93.3 | Very high | 50 Ų | 50 | 42.3 Ų | 42.3 | 25% | 0.246 | 24% | 0.237 | C | C | . | . | H | α-helix | trans | -79.3 | -38.3 | 178.6 | -68.5 | -67.8 | 144.5 | 0 | 0 | 112.3 | R66 I70 Y74 I181 T241 Q242 | R66-M245 VanDerWaalsContact NE-C 3.32Å; R66-M245 PolarHBondContact NE-O 3.02Å; I70-M245 HydrophobicContact CD1-CE 4.5Å; I70-M245 HydrophobicContact CD1-SD 3.94Å; I70-M245 HydrophobicContact CG2-CE 3.78Å; I70-M245 HydrophobicContact CG2-SD 4.5Å; Y74-M245 HydrophobicContact CE2-CE 3.49Å; Y74-M245 VanDerWaalsContact CE2-CE 3.49Å; I181-M245 HydrophobicContact CD1-CE 4.35Å; I181-M245 HydrophobicContact CD1-SD 4.4Å; I181-M245 HydrophobicContact CG1-CG 3.87Å; I181-M245 HydrophobicContact CG1-SD 4.14Å; T241-M245 HydrophobicContact CG2-CG 4.13Å; T241-M245 WeakPolarHBondContact O-CB 3.17Å; T241-M245 WeakPolarHBondContact O-CG 3.25Å; T241-M245 PolarHBondContact O-N 3.17Å; Q242-M245 PolarHBondContact O-N 3.39Å |
| 246 | G | 90.3 | Very high | 93.2 | Very high | 16 Ų | 16 | 40.7 Ų | 40.7 | 17% | 0.165 | 23% | 0.226 | C | C | . | . | trans | 84.5 | -177 | 170.5 | 0 | 0 | 0 | 0 | 0 | 112.9 | Q242 R248 | Q242-G246 PolarHBondContact O-N 3.07Å; G246-R248 VanDerWaalsContact C-N 3.29Å | ||
| 247 | G | 86.5 | Confident | 93.1 | Very high | 71 Ų | 71 | 39.3 Ų | 39.3 | 73% | 0.732 | 22% | 0.221 | S | C | * | . | S | Bend | trans | 69.8 | 30.2 | -172.2 | 0 | 0 | 0 | 0 | 0 | 113 | E251 | G247-E251 PolarHBondContact N-OE2 2.96Š|
| 248 | R | 87.5 | Confident | 93.1 | Very high | 58 Ų | 58 | 39.2 Ų | 39.2 | 22% | 0.219 | 22% | 0.22 | C | C | . | . | S | Bend | trans | -128.3 | 173.2 | 179.9 | -60.6 | -58.7 | 175.9 | 162.1 | 5.5 | 109.3 | T183 R184 D186 T188 Q242 G246 L250 | T183-R248 PolarHBondContact O-NH2 3.29Å; R184-R248 PolarHBondContact O-NH1 3.34Å; D186-R248 WeakPolarHBondContact OD1-CB 3.43Å; T188-R248 HydrophobicContact CG2-CB 4.11Å; Q242-R248 HydrophobicContact CB-CG 4.33Å; G246-R248 VanDerWaalsContact C-N 3.29Å; R248-L250 VanDerWaalsContact C-N 3.32Å; R248-L250 PolarHBondContact O-N 2.87Å |
| 249 | E | 86.1 | Confident | 93.1 | Very high | 124 Ų | 124 | 40.6 Ų | 40.6 | 58% | 0.579 | 23% | 0.225 | S | C | * | . | S | Bend | trans | -60.2 | -41 | -179.3 | -173.9 | 168.5 | 161.6 | 0 | 0 | 112.8 | D186 T188 K189 | D186-E249 PolarHBondContact OD2-N 3.42Å; T188-E249 PolarHBondContact OG1-N 3.17Å; K189-E249 WeakPolarHBondContact CD-OE2 3.42Å; K189-E249 WeakPolarHBondContact CE-OE2 3.37Å; K189-E249 HydrophobicContact CG-CB 4.05Å; K189-E249 WeakPolarHBondContact CG-OE2 3.41Å; K189-E249 IonicContact NZ-OE2 3.66Å |
| 250 | L | 87.6 | Confident | 93.1 | Very high | 68 Ų | 68 | 39.6 Ų | 39.6 | 36% | 0.356 | 22% | 0.221 | S | C | . | . | S | Bend | trans | -111.7 | 118.1 | 172 | -53.3 | 174.7 | 0 | 0 | 0 | 109.7 | T188 T191 F239 H243 R248 | T188-L250 WeakPolarHBondContact O-CD1 3.4Å; T188-L250 PolarHBondContact OG1-N 3.47Å; T188-L250 VanDerWaalsContact OG1-N 3.17Å; T191-L250 VanDerWaalsContact OG1-CD1 3.29Å; T191-L250 WeakPolarHBondContact OG1-CD1 3.39Å; F239-L250 HydrophobicContact CZ-CD1 4.3Å; H243-L250 PolarHBondContact CD2-O 2.55Å; H243-L250 VanDerWaalsContact CD2-O 3.29Å; R248-L250 VanDerWaalsContact C-N 3.32Å; R248-L250 PolarHBondContact O-N 2.87Å |
| 251 | E | 91.3 | Very high | 93.2 | Very high | 108 Ų | 108 | 39.3 Ų | 39.3 | 51% | 0.505 | 22% | 0.219 | S | C | . | . | trans | -126.7 | 140.3 | 173.7 | 64 | -179.7 | -165.5 | 0 | 0 | 111.7 | G247 | G247-E251 PolarHBondContact N-OE2 2.96Š| ||
| 252 | L | 92.3 | Very high | 93.2 | Very high | 12 Ų | 12 | 39.3 Ų | 39.3 | 6% | 0.063 | 22% | 0.219 | C | C | . | . | trans | -72.3 | 133.8 | 175.6 | -77.3 | 162.1 | 0 | 0 | 0 | 110.4 | R66 F69 H243 I244 E256 F259 | R66-L252 PolarHBondContact NH1-O 2.93Å; F69-L252 HydrophobicContact CE1-CB 4.27Å; F69-L252 HydrophobicContact CZ-CB 3.71Å; F69-L252 HydrophobicContact CZ-CD1 4.3Å; H243-L252 HydrophobicContact CB-CD1 4.26Å; H243-L252 HydrophobicContact CB-CG 4.46Å; H243-L252 PolarHBondContact CD2-N 3.05Å; H243-L252 VanDerWaalsContact CD2-N 3.33Å; H243-L252 PolarHBondContact O-N 3.1Å; I244-L252 HydrophobicContact CG1-CD1 3.82Å; L252-E256 HydrophobicContact CB-CB 4.31Å; L252-E256 HydrophobicContact CD2-CB 3.7Å; L252-E256 HydrophobicContact CD2-CG 4.23Å; L252-F259 HydrophobicContact CD1-CD1 4.42Å; L252-F259 HydrophobicContact CD2-CD1 3.62Å; L252-F259 HydrophobicContact CD2-CE1 4.26Å | ||
| 253 | S | 92.5 | Very high | 93.2 | Very high | 63 Ų | 63 | 40.6 Ų | 40.6 | 44% | 0.441 | 23% | 0.225 | S | C | . | . | trans | -59.7 | 148.3 | 165.3 | 173.7 | 0 | 0 | 0 | 0 | 110.7 | E255 E256 | S253-E255 PolarHBondContact O-N 3.25Å; S253-E256 WeakPolarHBondContact O-CB 3.13Å; S253-E256 PolarHBondContact O-N 3.35Å | ||
| 254 | A | 92.4 | Very high | 93.5 | Very high | 39 Ų | 39 | 39.3 Ų | 39.3 | 32% | 0.322 | 22% | 0.22 | S | C | . | . | G | 310 helix | trans | -59.2 | -21 | 179.5 | 0 | 0 | 0 | 0 | 0 | 113.7 | V65 F69 E256 | V65-A254 HydrophobicContact CG1-CB 3.73Å; F69-A254 HydrophobicContact CB-CB 4.13Å; F69-A254 HydrophobicContact CD2-CB 4.37Å; F69-A254 WeakPolarHBondContact CD2-O 3.25Å; F69-A254 HydrophobicContact CG-CB 4.44Å; A254-E256 VanDerWaalsContact C-N 3.27Å; A254-E256 PolarHBondContact O-N 2.96Å |
| 255 | E | 92.5 | Very high | 93.6 | Very high | 113 Ų | 113 | 39.3 Ų | 39.3 | 53% | 0.528 | 22% | 0.22 | S | C | . | . | G | 310 helix | trans | -72.6 | -18.8 | 174.3 | -60.9 | -174.9 | 168.8 | 0 | 0 | 113.2 | R130 S253 Y257 | R130-E255 IonicContact NH1-OE2 3.87Å; S253-E255 PolarHBondContact O-N 3.25Å; E255-Y257 WeakPolarHBondContact O-CD1 3.05Å; E255-Y257 PolarHBondContact O-N 3.41Å |
| 256 | E | 94.3 | Very high | 93.8 | Very high | 10 Ų | 10 | 37.5 Ų | 37.5 | 5% | 0.047 | 21% | 0.211 | C | C | . | . | G | 310 helix | trans | -90.1 | 26.9 | -173.4 | -65 | -69.2 | -174.5 | 0 | 0 | 113.5 | R129 R130 L252 S253 A254 I258 F259 G260 | R129-E256 IonicContact CZ-OE1 3.85Å; R129-E256 IonicContact CZ-OE2 3.13Å; R129-E256 IonicContact NE-OE1 3.95Å; R129-E256 IonicContact NE-OE2 2.66Å; R129-E256 PolarHBondContact NE-OE2 3.41Å; R129-E256 IonicContact NH2-OE1 2.88Å; R129-E256 PolarHBondContact NH2-OE1 2.88Å; R129-E256 IonicContact NH2-OE2 2.87Å; R129-E256 PolarHBondContact NH2-OE2 2.92Å; R130-E256 IonicContact CZ-OE1 3.12Å; R130-E256 IonicContact NE-OE1 2.8Å; R130-E256 PolarHBondContact NE-OE1 3.28Å; R130-E256 IonicContact NH2-OE1 2.66Å; R130-E256 PolarHBondContact NH2-OE1 3.24Å; L252-E256 HydrophobicContact CB-CB 4.31Å; L252-E256 HydrophobicContact CD2-CB 3.7Å; L252-E256 HydrophobicContact CD2-CG 4.23Å; S253-E256 WeakPolarHBondContact O-CB 3.13Å; S253-E256 PolarHBondContact O-N 3.35Å; A254-E256 VanDerWaalsContact C-N 3.27Å; A254-E256 PolarHBondContact O-N 2.96Å; E256-I258 PolarHBondContact O-N 3.45Å; E256-F259 HydrophobicContact CB-CB 4.23Å; E256-F259 WeakPolarHBondContact O-CB 3.3Å; E256-F259 PolarHBondContact O-N 2.98Å; E256-G260 PolarHBondContact O-N 2.92Å |
| 257 | Y | 95.8 | Very high | 94.1 | Very high | 28 Ų | 28 | 37 Ų | 37 | 11% | 0.11 | 20% | 0.204 | C | C | . | . | H | α-helix | trans | -64.2 | -28.9 | -176.1 | 65.3 | -92 | 0 | 0 | 0 | 112.9 | K72 I76 N135 E255 A261 | K72-Y257 HydrophobicContact CD-CD1 3.99Å; K72-Y257 HydrophobicContact CD-CD2 3.84Å; K72-Y257 HydrophobicContact CD-CE1 4.41Å; K72-Y257 HydrophobicContact CD-CE2 4.23Å; K72-Y257 HydrophobicContact CD-CG 3.7Å; K72-Y257 VanDerWaalsContact CE-CD2 3.5Å; K72-Y257 HydrophobicContact CG-CD2 4.1Å; K72-Y257 HydrophobicContact CG-CG 4.23Å; K72-Y257 PolarHBondContact NZ-OH 3.28Å; I76-Y257 HydrophobicContact CD1-CD2 3.47Å; I76-Y257 VanDerWaalsContact CD1-CD2 3.47Å; I76-Y257 HydrophobicContact CD1-CE2 3.89Å; N135-Y257 PolarHBondContact ND2-OH 3.11Å; E255-Y257 WeakPolarHBondContact O-CD1 3.05Å; E255-Y257 PolarHBondContact O-N 3.41Å; Y257-A261 WeakPolarHBondContact O-CB 3.14Å; Y257-A261 PolarHBondContact O-N 2.88Å; Y257-A261 VanDerWaalsContact O-N 3.11Å |
| 258 | I | 97.2 | Very high | 94.7 | Very high | 1 Ų | 1 | 34.6 Ų | 34.6 | 1% | 0.005 | 18% | 0.176 | C | C | . | . | H | α-helix | trans | -70.8 | -39.3 | 173.4 | -61.2 | -71.4 | 0 | 0 | 0 | 110.6 | I76 L122 R129 N135 L139 E256 L262 | I76-I258 HydrophobicContact CD1-CD1 4.41Å; L122-I258 HydrophobicContact CD2-CG2 3.94Å; R129-I258 HydrophobicContact CG-CB 3.71Å; R129-I258 HydrophobicContact CG-CG2 3.69Å; N135-I258 HydrophobicContact CB-CD1 4.39Å; N135-I258 HydrophobicContact CB-CG1 4.03Å; L139-I258 HydrophobicContact CB-CD1 4.49Å; L139-I258 HydrophobicContact CB-CG2 4.34Å; L139-I258 HydrophobicContact CD1-CG2 4.22Å; L139-I258 HydrophobicContact CD2-CD1 3.74Å; L139-I258 HydrophobicContact CD2-CG2 4.32Å; E256-I258 PolarHBondContact O-N 3.45Å; I258-L262 WeakPolarHBondContact O-CB 3.46Å; I258-L262 PolarHBondContact O-N 2.96Å |
| 259 | F | 96.9 | Very high | 95.2 | Very high | 34 Ų | 34 | 32 Ų | 32 | 15% | 0.149 | 17% | 0.166 | C | C | . | . | H | α-helix | trans | -66.1 | -47.3 | 177.9 | -169.1 | -106.4 | 0 | 0 | 0 | 110.8 | V123 L252 E256 A261 L262 Q263 | V123-F259 HydrophobicContact CG1-CE2 4.43Å; V123-F259 HydrophobicContact CG2-CE2 4.28Å; L252-F259 HydrophobicContact CD1-CD1 4.42Å; L252-F259 HydrophobicContact CD2-CD1 3.62Å; L252-F259 HydrophobicContact CD2-CE1 4.26Å; E256-F259 HydrophobicContact CB-CB 4.23Å; E256-F259 WeakPolarHBondContact O-CB 3.3Å; E256-F259 PolarHBondContact O-N 2.98Å; F259-A261 VanDerWaalsContact C-N 3.34Å; F259-A261 PolarHBondContact O-N 3.05Å; F259-L262 WeakPolarHBondContact O-CB 3.47Å; F259-L262 PolarHBondContact O-N 3.42Å; F259-Q263 HydrophobicContact CD1-CG 4.19Å; F259-Q263 HydrophobicContact CE1-CG 3.91Å; F259-Q263 HydrophobicContact CE2-CG 4.38Å; F259-Q263 VanDerWaalsContact CE2-NE2 3.35Å; F259-Q263 HydrophobicContact CZ-CG 4.04Å; F259-Q263 WeakPolarHBondContact O-CG 3.31Å; F259-Q263 PolarHBondContact O-N 2.97Å |
| 260 | G | 97.4 | Very high | 95.7 | Very high | 0 Ų | 0 | 27.9 Ų | 27.9 | 0% | 0 | 15% | 0.148 | C | C | . | . | H | α-helix | trans | -59.3 | -44.9 | 177.7 | 0 | 0 | 0 | 0 | 0 | 112.1 | E256 L264 | E256-G260 PolarHBondContact O-N 2.92Å; G260-L264 PolarHBondContact O-N 2.8Å; G260-L264 VanDerWaalsContact O-N 3.16Å |
| 261 | A | 98.1 | Very high | 96.2 | Very high | 0 Ų | 0 | 24.8 Ų | 24.8 | 0% | 0 | 13% | 0.132 | C | C | . | . | H | α-helix | trans | -65.8 | -41.5 | 177 | 0 | 0 | 0 | 0 | 0 | 112.3 | V73 I76 Q80 Y257 F259 Y265 | V73-A261 HydrophobicContact CG1-CB 4.24Å; I76-A261 HydrophobicContact CB-CB 3.9Å; I76-A261 HydrophobicContact CG2-CB 3.52Å; Q80-A261 PolarHBondContact OE1-O 3.24Å; Y257-A261 WeakPolarHBondContact O-CB 3.14Å; Y257-A261 PolarHBondContact O-N 2.88Å; Y257-A261 VanDerWaalsContact O-N 3.11Å; F259-A261 VanDerWaalsContact C-N 3.34Å; F259-A261 PolarHBondContact O-N 3.05Å; A261-Y265 WeakPolarHBondContact O-CB 3.4Å; A261-Y265 PolarHBondContact O-N 2.9Å |
| 262 | L | 97.9 | Very high | 96.6 | Very high | 0 Ų | 0 | 20.4 Ų | 20.4 | 0% | 0 | 11% | 0.111 | C | C | . | . | H | α-helix | trans | -56.9 | -49.5 | 176.7 | 174 | 67.1 | 0 | 0 | 0 | 112.2 | Y119 L122 V123 L139 F142 I258 F259 L266 | Y119-L262 HydrophobicContact CD2-CD1 4.34Å; Y119-L262 HydrophobicContact CD2-CD2 4.24Å; Y119-L262 HydrophobicContact CE2-CD2 4.37Å; L122-L262 HydrophobicContact CB-CD2 3.78Å; L122-L262 HydrophobicContact CD1-CD1 4.27Å; L122-L262 HydrophobicContact CD1-CD2 4.3Å; V123-L262 HydrophobicContact CG2-CD2 4Å; L139-L262 HydrophobicContact CD1-CB 4.38Å; L139-L262 HydrophobicContact CD1-CD1 4.42Å; F142-L262 HydrophobicContact CD1-CD1 3.57Å; F142-L262 HydrophobicContact CD2-CD1 4.09Å; F142-L262 HydrophobicContact CE1-CD1 3.16Å; F142-L262 HydrophobicContact CE2-CD1 3.71Å; F142-L262 HydrophobicContact CG-CD1 4.03Å; F142-L262 HydrophobicContact CZ-CD1 3.25Å; I258-L262 WeakPolarHBondContact O-CB 3.46Å; I258-L262 PolarHBondContact O-N 2.96Å; F259-L262 WeakPolarHBondContact O-CB 3.47Å; F259-L262 PolarHBondContact O-N 3.42Å; L262-L266 HydrophobicContact CD1-CD1 4.31Å; L262-L266 HydrophobicContact CG-CD1 4.32Å; L262-L266 WeakPolarHBondContact O-CG 3.36Å; L262-L266 PolarHBondContact O-N 3.34Å |
| 263 | Q | 97.4 | Very high | 96.8 | Very high | 29 Ų | 29 | 21 Ų | 21 | 14% | 0.136 | 11% | 0.114 | C | C | . | . | H | α-helix | trans | -69.2 | -49.4 | -177.1 | -62.3 | -64 | 8.5 | 0 | 0 | 111.9 | D240 F259 Y265 L266 D267 | D240-Q263 HydrophobicContact CB-CB 4.4Å; D240-Q263 WeakPolarHBondContact OD2-CB 3.18Å; F259-Q263 HydrophobicContact CD1-CG 4.19Å; F259-Q263 HydrophobicContact CE1-CG 3.91Å; F259-Q263 HydrophobicContact CE2-CG 4.38Å; F259-Q263 VanDerWaalsContact CE2-NE2 3.35Å; F259-Q263 HydrophobicContact CZ-CG 4.04Å; F259-Q263 WeakPolarHBondContact O-CG 3.31Å; F259-Q263 PolarHBondContact O-N 2.97Å; Q263-Y265 PolarHBondContact O-N 2.98Å; Q263-L266 WeakPolarHBondContact O-CB 3.19Å; Q263-L266 PolarHBondContact O-N 3.38Å; Q263-D267 PolarHBondContact O-N 3.31Å |
| 264 | L | 98.1 | Very high | 97 | Very high | 2 Ų | 2 | 19.1 Ų | 19.1 | 1% | 0.01 | 10% | 0.099 | C | C | . | . | H | α-helix | trans | -57.3 | -39.4 | 176.1 | -75.2 | -175.8 | 0 | 0 | 0 | 112.1 | V73 Y74 L77 L237 D240 I244 G260 D267 V268 | V73-L264 HydrophobicContact CG1-CD1 4.29Å; Y74-L264 HydrophobicContact CE1-CD1 4.31Å; Y74-L264 HydrophobicContact CE2-CD1 4.48Å; L77-L264 HydrophobicContact CD1-CB 4.1Å; L77-L264 HydrophobicContact CD2-CB 3.9Å; L77-L264 HydrophobicContact CD2-CD1 3.85Å; L237-L264 HydrophobicContact CD1-CD2 3.67Å; D240-L264 HydrophobicContact CB-CD2 3.85Å; D240-L264 HydrophobicContact CB-CG 4.45Å; I244-L264 HydrophobicContact CD1-CD1 3.24Å; I244-L264 HydrophobicContact CD1-CD2 4.2Å; I244-L264 HydrophobicContact CD1-CG 3.48Å; I244-L264 VanDerWaalsContact CD1-CG 3.48Å; G260-L264 PolarHBondContact O-N 2.8Å; G260-L264 VanDerWaalsContact O-N 3.16Å; L264-D267 PolarHBondContact O-N 3.37Å; L264-V268 WeakPolarHBondContact O-CB 3.37Å; L264-V268 WeakPolarHBondContact O-CG2 3.35Å; L264-V268 PolarHBondContact O-N 3.37Å |
| 265 | Y | 98.5 | Very high | 97.1 | Very high | 0 Ų | 0 | 17.8 Ų | 17.8 | 0% | 0 | 9% | 0.086 | C | C | . | . | H | α-helix | trans | -67 | -39.9 | 177.9 | 173.3 | -109.5 | 0 | 0 | 0 | 112.3 | L77 Q80 L81 T84 F142 T143 F146 S147 A261 Q263 V269 | L77-Y265 HydrophobicContact CD1-CD2 4.47Å; Q80-Y265 HydrophobicContact CB-CD2 3.54Å; Q80-Y265 HydrophobicContact CB-CE2 3.73Å; Q80-Y265 HydrophobicContact CB-CG 3.99Å; L81-Y265 HydrophobicContact CD2-CD2 3.92Å; L81-Y265 HydrophobicContact CD2-CE2 4.22Å; L81-Y265 HydrophobicContact CG-CD2 4.4Å; T84-Y265 VanDerWaalsContact OG1-CE2 3.31Å; T84-Y265 WeakPolarHBondContact OG1-CE2 3.49Å; T84-Y265 PolarHBondContact OG1-OH 2.86Å; F142-Y265 HydrophobicContact CD1-CE1 4.38Å; F142-Y265 AromaticContact CE1-CD1 3.62Å; F142-Y265 HydrophobicContact CE1-CD1 3.62Å; F142-Y265 AromaticContact CE1-CE1 3.66Å; F142-Y265 HydrophobicContact CE1-CE1 3.66Å; F142-Y265 HydrophobicContact CZ-CD1 4.36Å; F142-Y265 HydrophobicContact CZ-CE1 4.42Å; T143-Y265 HydrophobicContact CG2-CE1 4.42Å; F146-Y265 HydrophobicContact CB-CE1 4.18Å; F146-Y265 HydrophobicContact CD1-CD1 4.12Å; F146-Y265 AromaticContact CD1-CE1 3.48Å; F146-Y265 HydrophobicContact CD1-CE1 3.48Å; F146-Y265 VanDerWaalsContact CD1-CE1 3.48Å; F146-Y265 AromaticContact CD1-CZ 3.94Å; F146-Y265 HydrophobicContact CE1-CE1 4.34Å; F146-Y265 HydrophobicContact CG-CE1 4.3Å; S147-Y265 PolarHBondContact OG-OH 3.44Å; A261-Y265 WeakPolarHBondContact O-CB 3.4Å; A261-Y265 PolarHBondContact O-N 2.9Å; Q263-Y265 PolarHBondContact O-N 2.98Å; Y265-V269 HydrophobicContact CD2-CG2 3.78Å; Y265-V269 HydrophobicContact CE2-CG2 3.43Å; Y265-V269 VanDerWaalsContact CE2-CG2 3.43Å; Y265-V269 HydrophobicContact CG-CG2 4.49Å; Y265-V269 WeakPolarHBondContact O-CB 3.28Å; Y265-V269 WeakPolarHBondContact O-CG2 3.41Å; Y265-V269 PolarHBondContact O-N 3.37Å |
| 266 | L | 98.1 | Very high | 97.3 | Very high | 11 Ų | 11 | 12.4 Ų | 12.4 | 6% | 0.058 | 6% | 0.061 | C | C | . | . | H | α-helix | trans | -60.4 | -45.7 | 172.1 | -79 | 167.1 | 0 | 0 | 0 | 111.7 | F115 Y119 F142 F146 L262 Q263 N270 | F115-L266 HydrophobicContact CE2-CD2 3.79Å; F115-L266 HydrophobicContact CZ-CD2 3.79Å; Y119-L266 HydrophobicContact CD2-CD1 3.75Å; Y119-L266 HydrophobicContact CE2-CD1 3.25Å; F142-L266 HydrophobicContact CE2-CD2 4.43Å; F142-L266 HydrophobicContact CZ-CD1 4.31Å; F142-L266 HydrophobicContact CZ-CD2 3.8Å; F142-L266 HydrophobicContact CZ-CG 3.95Å; F146-L266 HydrophobicContact CD1-CD2 4.17Å; F146-L266 HydrophobicContact CE1-CD2 3.72Å; F146-L266 HydrophobicContact CZ-CD2 4.28Å; L262-L266 HydrophobicContact CD1-CD1 4.31Å; L262-L266 HydrophobicContact CG-CD1 4.32Å; L262-L266 WeakPolarHBondContact O-CG 3.36Å; L262-L266 PolarHBondContact O-N 3.34Å; Q263-L266 WeakPolarHBondContact O-CB 3.19Å; Q263-L266 PolarHBondContact O-N 3.38Å; L266-N270 WeakPolarHBondContact O-CB 3.34Å; L266-N270 VanDerWaalsContact O-CG 3.3Å; L266-N270 PolarHBondContact O-N 3.27Å; L266-N270 PolarHBondContact O-ND2 2.89Å |
| 267 | D | 97.9 | Very high | 97.2 | Very high | 5 Ų | 5 | 13 Ų | 13 | 3% | 0.027 | 7% | 0.067 | C | C | . | . | H | α-helix | trans | -61.2 | -49.7 | 179.7 | -68.7 | -22.5 | 0 | 0 | 0 | 111.8 | Y236 L237 D240 Q263 L264 L271 | Y236-D267 VanDerWaalsContact C-OD2 3.27Å; Y236-D267 WeakPolarHBondContact CB-OD1 3.45Å; L237-D267 VanDerWaalsContact CA-OD2 3.27Å; L237-D267 WeakPolarHBondContact CA-OD2 3.28Å; L237-D267 HydrophobicContact CB-CB 4.09Å; L237-D267 HydrophobicContact CD1-CB 4.12Å; L237-D267 PolarHBondContact N-OD2 3.35Å; D240-D267 VanDerWaalsContact OD2-OD2 3.08Å; Q263-D267 PolarHBondContact O-N 3.31Å; L264-D267 PolarHBondContact O-N 3.37Å; D267-L271 WeakPolarHBondContact O-CB 3.41Å; D267-L271 PolarHBondContact O-N 2.86Å |
| 268 | V | 98.3 | Very high | 97.1 | Very high | 22 Ų | 22 | 15.1 Ų | 15.1 | 13% | 0.133 | 8% | 0.077 | C | C | . | . | H | α-helix | trans | -62.9 | -47.7 | -178.1 | 174.3 | 0 | 0 | 0 | 0 | 111.2 | L81 L237 L264 F272 | L81-V268 HydrophobicContact CD1-CG1 4.21Å; L81-V268 HydrophobicContact CD2-CB 4.23Å; L81-V268 HydrophobicContact CD2-CG1 3.61Å; L237-V268 HydrophobicContact CD1-CG2 4.3Å; L264-V268 WeakPolarHBondContact O-CB 3.37Å; L264-V268 WeakPolarHBondContact O-CG2 3.35Å; L264-V268 PolarHBondContact O-N 3.37Å; V268-F272 WeakPolarHBondContact O-CB 3.47Å; V268-F272 PolarHBondContact O-N 3.15Å |
| 269 | V | 98.5 | Very high | 96.7 | Very high | 3 Ų | 3 | 18.4 Ų | 18.4 | 2% | 0.018 | 9% | 0.091 | C | C | . | . | H | α-helix | trans | -73.3 | -38.1 | -176.5 | 176.8 | 0 | 0 | 0 | 0 | 111.8 | L81 T84 F146 T150 Y265 F272 L273 | L81-V269 HydrophobicContact CD2-CG2 4.16Å; T84-V269 HydrophobicContact CG2-CG2 4.36Å; F146-V269 HydrophobicContact CD1-CB 4.33Å; F146-V269 HydrophobicContact CD1-CG1 4.14Å; F146-V269 HydrophobicContact CE1-CB 3.55Å; F146-V269 HydrophobicContact CE1-CG1 3.49Å; F146-V269 VanDerWaalsContact CE1-CG1 3.49Å; F146-V269 HydrophobicContact CE1-CG2 4.3Å; F146-V269 HydrophobicContact CE2-CG1 4.06Å; F146-V269 HydrophobicContact CZ-CB 3.89Å; F146-V269 HydrophobicContact CZ-CG1 3.45Å; F146-V269 VanDerWaalsContact CZ-CG1 3.45Å; T150-V269 HydrophobicContact CG2-CG1 4.05Å; T150-V269 VanDerWaalsContact OG1-CG1 3.27Å; T150-V269 WeakPolarHBondContact OG1-CG1 3.41Å; Y265-V269 HydrophobicContact CD2-CG2 3.78Å; Y265-V269 HydrophobicContact CE2-CG2 3.43Å; Y265-V269 VanDerWaalsContact CE2-CG2 3.43Å; Y265-V269 HydrophobicContact CG-CG2 4.49Å; Y265-V269 WeakPolarHBondContact O-CB 3.28Å; Y265-V269 WeakPolarHBondContact O-CG2 3.41Å; Y265-V269 PolarHBondContact O-N 3.37Å; V269-F272 WeakPolarHBondContact O-CB 3.29Å; V269-F272 PolarHBondContact O-N 2.71Å; V269-L273 HydrophobicContact CG1-CD1 4.35Å; V269-L273 WeakPolarHBondContact O-CG 3.35Å; V269-L273 PolarHBondContact O-N 3.03Å |
| 270 | N | 97.6 | Very high | 95.4 | Very high | 38 Ų | 38 | 18 Ų | 18 | 20% | 0.203 | 10% | 0.096 | C | C | . | . | H | α-helix | trans | -67.2 | -41.6 | 174.7 | -74.9 | -49.3 | 0 | 0 | 0 | 111.5 | F233 L266 F272 L273 I274 | F233-N270 HydrophobicContact CD1-CB 3.8Å; F233-N270 HydrophobicContact CD2-CB 4.19Å; F233-N270 HydrophobicContact CE1-CB 3.51Å; F233-N270 WeakPolarHBondContact CE1-ND2 3.48Å; F233-N270 HydrophobicContact CE2-CB 3.93Å; F233-N270 HydrophobicContact CG-CB 4.12Å; F233-N270 HydrophobicContact CZ-CB 3.58Å; L266-N270 WeakPolarHBondContact O-CB 3.34Å; L266-N270 VanDerWaalsContact O-CG 3.3Å; L266-N270 PolarHBondContact O-N 3.27Å; L266-N270 PolarHBondContact O-ND2 2.89Å; N270-F272 VanDerWaalsContact C-N 3.28Å; N270-F272 PolarHBondContact O-N 2.81Å; N270-L273 PolarHBondContact O-N 3.41Å; N270-I274 WeakPolarHBondContact O-CB 3.36Å; N270-I274 WeakPolarHBondContact O-CD1 3.05Å; N270-I274 VanDerWaalsContact O-CG1 3.23Å; N270-I274 WeakPolarHBondContact O-CG1 3.19Å; N270-I274 PolarHBondContact O-N 3.13Å |
| 271 | L | 97.9 | Very high | 93.4 | Very high | 3 Ų | 3 | 23.9 Ų | 23.9 | 2% | 0.016 | 13% | 0.127 | C | C | . | . | H | α-helix | trans | -58 | -44.7 | 173.1 | -171.7 | 63.9 | 0 | 0 | 0 | 110.2 | T169 L172 A230 F233 D267 L273 I274 I275 | T169-L271 HydrophobicContact CG2-CB 4.25Å; T169-L271 HydrophobicContact CG2-CD2 4.26Å; T169-L271 HydrophobicContact CG2-CG 4.2Å; L172-L271 HydrophobicContact CB-CD2 3.96Å; L172-L271 HydrophobicContact CD1-CD1 4.43Å; L172-L271 HydrophobicContact CD1-CD2 4.24Å; L172-L271 HydrophobicContact CD1-CG 4.44Å; A230-L271 HydrophobicContact CB-CD1 4.11Å; F233-L271 HydrophobicContact CB-CD1 4.49Å; D267-L271 WeakPolarHBondContact O-CB 3.41Å; D267-L271 PolarHBondContact O-N 2.86Å; L271-L273 PolarHBondContact O-N 2.94Å; L271-I274 PolarHBondContact O-N 3.32Å; L271-I275 HydrophobicContact CD1-CG1 4.4Å; L271-I275 HydrophobicContact CG-CG1 4.4Å; L271-I275 WeakPolarHBondContact O-CB 3.17Å; L271-I275 VanDerWaalsContact O-CG1 3.26Å; L271-I275 WeakPolarHBondContact O-CG1 3.42Å; L271-I275 PolarHBondContact O-N 3.27Å |
| 272 | F | 98.1 | Very high | 91.2 | Very high | 15 Ų | 15 | 31.9 Ų | 31.9 | 7% | 0.066 | 16% | 0.158 | C | C | . | . | H | α-helix | trans | -55.3 | -50.9 | 173.4 | 165.9 | -112.3 | 0 | 0 | 0 | 113 | T150 T154 V162 A165 V166 T169 V268 V269 N270 I274 I275 L276 | T150-F272 HydrophobicContact CG2-CD1 3.99Å; T150-F272 HydrophobicContact CG2-CE1 3.75Å; T154-F272 HydrophobicContact CG2-CE1 3.55Å; T154-F272 HydrophobicContact CG2-CZ 3.6Å; V162-F272 HydrophobicContact CG1-CZ 4.21Å; A165-F272 HydrophobicContact CB-CD2 4.16Å; A165-F272 HydrophobicContact CB-CE2 3.9Å; V166-F272 HydrophobicContact CG2-CD2 4.11Å; V166-F272 HydrophobicContact CG2-CE2 3.54Å; V166-F272 HydrophobicContact CG2-CZ 4.19Å; T169-F272 HydrophobicContact CG2-CB 3.91Å; T169-F272 VanDerWaalsContact OG1-CA 3.3Å; T169-F272 WeakPolarHBondContact OG1-CA 3.47Å; V268-F272 WeakPolarHBondContact O-CB 3.47Å; V268-F272 PolarHBondContact O-N 3.15Å; V269-F272 WeakPolarHBondContact O-CB 3.29Å; V269-F272 PolarHBondContact O-N 2.71Å; N270-F272 VanDerWaalsContact C-N 3.28Å; N270-F272 PolarHBondContact O-N 2.81Å; F272-I274 VanDerWaalsContact C-N 3.31Å; F272-I274 PolarHBondContact O-N 3.04Å; F272-I275 PolarHBondContact O-N 3.48Å; F272-L276 HydrophobicContact CE1-CD2 4.43Å; F272-L276 HydrophobicContact CZ-CD2 4.08Å; F272-L276 VanDerWaalsContact O-CB 3.24Å; F272-L276 WeakPolarHBondContact O-CB 3.23Å; F272-L276 PolarHBondContact O-N 3.31Å |
| 273 | L | 97.1 | Very high | 88.1 | Confident | 26 Ų | 26 | 38.5 Ų | 38.5 | 14% | 0.136 | 19% | 0.193 | C | C | . | . | H | α-helix | trans | -63.8 | -35.9 | -179.5 | -70.4 | 174.9 | 0 | 0 | 0 | 112.4 | F146 T150 I153 V269 N270 L271 S277 | F146-L273 HydrophobicContact CE2-CD1 4.37Å; T150-L273 HydrophobicContact CG2-CD2 4.07Å; I153-L273 HydrophobicContact CB-CD2 4.11Å; I153-L273 HydrophobicContact CD1-CD1 4.04Å; I153-L273 HydrophobicContact CD1-CD2 4.14Å; I153-L273 HydrophobicContact CG2-CD2 3.87Å; V269-L273 HydrophobicContact CG1-CD1 4.35Å; V269-L273 WeakPolarHBondContact O-CG 3.35Å; V269-L273 PolarHBondContact O-N 3.03Å; N270-L273 PolarHBondContact O-N 3.41Å; L271-L273 PolarHBondContact O-N 2.94Å; L273-S277 PolarHBondContact O-N 2.87Å; L273-S277 VanDerWaalsContact O-N 3.11Å |
| 274 | I | 96.2 | Very high | 85 | Confident | 22 Ų | 22 | 46.1 Ų | 46.1 | 11% | 0.113 | 25% | 0.249 | C | C | . | . | H | α-helix | trans | -68.3 | -48.9 | 176.2 | -67.7 | 160.4 | 0 | 0 | 0 | 110.7 | G226 A229 A230 F233 N270 L271 F272 L276 S277 F278 | G226-I274 WeakPolarHBondContact O-CG2 3.32Å; A229-I274 HydrophobicContact CB-CD1 3.69Å; A229-I274 HydrophobicContact CB-CG1 4.3Å; A230-I274 HydrophobicContact CB-CG2 3.8Å; F233-I274 HydrophobicContact CD2-CD1 3.34Å; F233-I274 HydrophobicContact CE2-CD1 3.79Å; F233-I274 HydrophobicContact CG-CD1 4.26Å; N270-I274 WeakPolarHBondContact O-CB 3.36Å; N270-I274 WeakPolarHBondContact O-CD1 3.05Å; N270-I274 VanDerWaalsContact O-CG1 3.23Å; N270-I274 WeakPolarHBondContact O-CG1 3.19Å; N270-I274 PolarHBondContact O-N 3.13Å; L271-I274 PolarHBondContact O-N 3.32Å; F272-I274 VanDerWaalsContact C-N 3.31Å; F272-I274 PolarHBondContact O-N 3.04Å; I274-L276 VanDerWaalsContact C-N 3.3Å; I274-L276 PolarHBondContact O-N 2.85Å; I274-S277 VanDerWaalsContact O-CB 3.32Å; I274-S277 WeakPolarHBondContact O-CB 3.39Å; I274-S277 PolarHBondContact O-N 3.4Å; I274-S277 VanDerWaalsContact O-N 3.1Å; I274-S277 PolarHBondContact O-OG 3.19Å; I274-F278 HydrophobicContact CG2-CZ 4.17Å |
| 275 | I | 96.5 | Very high | 84.4 | Confident | 11 Ų | 11 | 48.3 Ų | 48.3 | 6% | 0.056 | 26% | 0.261 | C | S | . | . | H | α-helix | trans | -60.9 | -42.5 | 177.3 | -64.8 | -53.8 | 0 | 0 | 0 | 110.5 | A165 I168 L172 A230 L271 F272 S277 F278 F279 | A165-I275 HydrophobicContact CB-CG2 4.08Å; I168-I275 HydrophobicContact CB-CG2 3.92Å; I168-I275 HydrophobicContact CD1-CG2 4.4Å; I168-I275 HydrophobicContact CG2-CD1 4.42Å; I168-I275 HydrophobicContact CG2-CG1 4.37Å; I168-I275 HydrophobicContact CG2-CG2 3.68Å; L172-I275 HydrophobicContact CD1-CD1 3.82Å; L172-I275 HydrophobicContact CD1-CG1 4.01Å; A230-I275 HydrophobicContact CB-CD1 4.44Å; L271-I275 HydrophobicContact CD1-CG1 4.4Å; L271-I275 HydrophobicContact CG-CG1 4.4Å; L271-I275 WeakPolarHBondContact O-CB 3.17Å; L271-I275 VanDerWaalsContact O-CG1 3.26Å; L271-I275 WeakPolarHBondContact O-CG1 3.42Å; L271-I275 PolarHBondContact O-N 3.27Å; F272-I275 PolarHBondContact O-N 3.48Å; I275-S277 PolarHBondContact O-N 3.48Å; I275-F278 HydrophobicContact CD1-CD2 4.22Å; I275-F278 HydrophobicContact CD1-CE2 3.91Å; I275-F278 WeakPolarHBondContact O-CB 3.22Å; I275-F278 PolarHBondContact O-N 3.02Å; I275-F278 VanDerWaalsContact O-N 3.1Å; I275-F279 HydrophobicContact CG2-CD2 4.45Å; I275-F279 HydrophobicContact CG2-CE2 3.94Å; I275-F279 VanDerWaalsContact O-CD2 3.29Å; I275-F279 WeakPolarHBondContact O-CD2 3.32Å |
| 276 | L | 96 | Very high | 83.6 | Confident | 0 Ų | 0 | 50.8 Ų | 50.8 | 0% | 0 | 28% | 0.275 | C | S | . | . | H | α-helix | trans | -56.6 | -38.3 | 175 | 178.9 | 61 | 0 | 0 | 0 | 112.1 | T154 Y157 V162 A165 F272 I274 F278 F279 G280 | T154-L276 HydrophobicContact CG2-CD2 3.76Å; Y157-L276 HydrophobicContact CD1-CD1 3.63Å; Y157-L276 HydrophobicContact CD1-CD2 4.29Å; Y157-L276 HydrophobicContact CD1-CG 3.65Å; Y157-L276 HydrophobicContact CD2-CD2 3.9Å; Y157-L276 HydrophobicContact CD2-CG 4.16Å; Y157-L276 HydrophobicContact CE1-CD1 4.22Å; Y157-L276 HydrophobicContact CE1-CD2 4.5Å; Y157-L276 HydrophobicContact CE1-CG 3.78Å; Y157-L276 VanDerWaalsContact CE1-O 3.32Å; Y157-L276 WeakPolarHBondContact CE1-O 3.49Å; Y157-L276 HydrophobicContact CE2-CD2 4.14Å; Y157-L276 HydrophobicContact CE2-CG 4.28Å; Y157-L276 HydrophobicContact CG-CD1 3.85Å; Y157-L276 HydrophobicContact CG-CD2 3.99Å; Y157-L276 HydrophobicContact CG-CG 3.86Å; V162-L276 HydrophobicContact CB-CD1 4.4Å; V162-L276 HydrophobicContact CG2-CD1 3.85Å; V162-L276 HydrophobicContact CG2-CD2 4.45Å; A165-L276 HydrophobicContact CB-CB 3.82Å; A165-L276 HydrophobicContact CB-CD1 3.93Å; F272-L276 HydrophobicContact CE1-CD2 4.43Å; F272-L276 HydrophobicContact CZ-CD2 4.08Å; F272-L276 VanDerWaalsContact O-CB 3.24Å; F272-L276 WeakPolarHBondContact O-CB 3.23Å; F272-L276 PolarHBondContact O-N 3.31Å; I274-L276 VanDerWaalsContact C-N 3.3Å; I274-L276 PolarHBondContact O-N 2.85Å; L276-F278 PolarHBondContact O-N 3.49Å; L276-F278 VanDerWaalsContact O-N 3.11Å; L276-F279 PolarHBondContact O-N 2.87Å; L276-G280 PolarHBondContact O-N 2.81Å |
| 277 | S | 92.9 | Very high | 82.8 | Confident | 23 Ų | 23 | 53.1 Ų | 53.1 | 16% | 0.161 | 29% | 0.287 | C | S | . | . | H | α-helix | trans | -61.6 | -20 | 179.9 | 85.4 | 0 | 0 | 0 | 0 | 114.1 | Q222 L273 I274 I275 | Q222-S277 PolarHBondContact NE2-O 2.86Å; L273-S277 PolarHBondContact O-N 2.87Å; L273-S277 VanDerWaalsContact O-N 3.11Å; I274-S277 VanDerWaalsContact O-CB 3.32Å; I274-S277 WeakPolarHBondContact O-CB 3.39Å; I274-S277 PolarHBondContact O-N 3.4Å; I274-S277 VanDerWaalsContact O-N 3.1Å; I274-S277 PolarHBondContact O-OG 3.19Å; I275-S277 PolarHBondContact O-N 3.48Å |
| 278 | F | 92.5 | Very high | 81.9 | Confident | 73 Ų | 73 | 55.9 Ų | 55.9 | 32% | 0.32 | 30% | 0.303 | S | S | . | . | H | α-helix | trans | -79.6 | -25.8 | 175.9 | -58.1 | -31.5 | 0 | 0 | 0 | 113.7 | G226 I274 I275 L276 | G226-F278 VanDerWaalsContact C-CZ 3.43Å; I274-F278 HydrophobicContact CG2-CZ 4.17Å; I275-F278 HydrophobicContact CD1-CD2 4.22Å; I275-F278 HydrophobicContact CD1-CE2 3.91Å; I275-F278 WeakPolarHBondContact O-CB 3.22Å; I275-F278 PolarHBondContact O-N 3.02Å; I275-F278 VanDerWaalsContact O-N 3.1Å; L276-F278 PolarHBondContact O-N 3.49Å; L276-F278 VanDerWaalsContact O-N 3.11Å |
| 279 | F | 88.3 | Confident | 80.9 | Confident | 69 Ų | 69 | 58 Ų | 58 | 30% | 0.303 | 31% | 0.313 | S | S | . | . | H | α-helix | trans | -101.7 | 1.1 | -177.9 | -60.4 | -77.8 | 0 | 0 | 0 | 113.2 | S161 I164 I168 I275 L276 N281 | S161-F279 VanDerWaalsContact CB-O 3.3Å; S161-F279 WeakPolarHBondContact CB-O 3.17Å; S161-F279 PolarHBondContact OG-O 3.03Å; I164-F279 HydrophobicContact CG2-CD1 4.05Å; I164-F279 HydrophobicContact CG2-CD2 4.17Å; I164-F279 HydrophobicContact CG2-CE1 3.75Å; I164-F279 HydrophobicContact CG2-CE2 3.9Å; I164-F279 HydrophobicContact CG2-CG 4.25Å; I164-F279 HydrophobicContact CG2-CZ 3.68Å; I168-F279 HydrophobicContact CD1-CE1 4.48Å; I168-F279 HydrophobicContact CD1-CE2 3.52Å; I168-F279 HydrophobicContact CD1-CZ 3.35Å; I275-F279 HydrophobicContact CG2-CD2 4.45Å; I275-F279 HydrophobicContact CG2-CE2 3.94Å; I275-F279 VanDerWaalsContact O-CD2 3.29Å; I275-F279 WeakPolarHBondContact O-CD2 3.32Å; L276-F279 PolarHBondContact O-N 2.87Å; F279-N281 VanDerWaalsContact C-N 3.32Å; F279-N281 PolarHBondContact O-N 2.85Å |
| 280 | G | 70.7 | Confident | 79.7 | Confident | 25 Ų | 25 | 61.7 Ų | 61.7 | 26% | 0.258 | 33% | 0.333 | S | S | . | . | trans | -69.9 | 86.2 | 176.4 | 0 | 0 | 0 | 0 | 0 | 111.8 | Y157 L276 R282 | Y157-G280 VanDerWaalsContact CD1-CA 3.46Å; Y157-G280 VanDerWaalsContact CE1-CA 3.43Å; L276-G280 PolarHBondContact O-N 2.81Å; G280-R282 PolarHBondContact O-N 2.67Å; G280-R282 VanDerWaalsContact O-N 3.14Å | ||
| 281 | N | 55.2 | Low | 78.4 | Confident | 124 Ų | 124 | 63.4 Ų | 63.4 | 66% | 0.663 | 34% | 0.342 | S | S | * | . | trans | -64.2 | 108.6 | 160.9 | -99.3 | 23.8 | 0 | 0 | 0 | 108 | F279 D283 | F279-N281 VanDerWaalsContact C-N 3.32Å; F279-N281 PolarHBondContact O-N 2.85Å; N281-D283 PolarHBondContact ND2-OD2 3.34Å; N281-D283 PolarHBondContact O-N 3.12Å | ||
| 282 | R | 51.4 | Low | 77 | Confident | 169 Ų | 169 | 68 Ų | 68 | 64% | 0.638 | 37% | 0.367 | S | S | * | . | trans | -79 | 67.4 | 168.4 | -65.7 | -179.7 | 173.2 | 117.2 | -1.1 | 108.3 | G280 S284 | G280-R282 PolarHBondContact O-N 2.67Å; G280-R282 VanDerWaalsContact O-N 3.14Å; R282-S284 VanDerWaalsContact C-N 3.29Å; R282-S284 PolarHBondContact O-N 2.83Å; R282-S284 VanDerWaalsContact O-N 3.08Å | ||
| 283 | D | 32.4 | Very low | 75.2 | Confident | 138 Ų | 138 | 72.4 Ų | 72.4 | 74% | 0.738 | 39% | 0.392 | S | S | * | . | trans | -80.1 | 87.2 | 169.6 | -63.4 | -26 | 0 | 0 | 0 | 107.3 | N281 | N281-D283 PolarHBondContact ND2-OD2 3.34Å; N281-D283 PolarHBondContact O-N 3.12Å | ||
| 284 | S | 33.1 | Very low | 73.2 | Confident | 189 Ų | 189 | 76.6 Ų | 76.6 | 100% | 1.322 | 42% | 0.416 | S | S | * | . | trans | -126.5 | 0 | 157.2 | -52 | 0 | 0 | 0 | 0 | 107.8 | R282 | R282-S284 VanDerWaalsContact C-N 3.29Å; R282-S284 PolarHBondContact O-N 2.83Å; R282-S284 VanDerWaalsContact O-N 3.08Å |
Retrieved 284 of 284 residues in 78.2 ms
(Link to these results)