| 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 | R | 39.2 | Very low | 33.6 | Very low | 297 Ų | 297 | 148.5 Ų | 148.5 | 100% | 1.121 | 86% | 0.856 | S | S | * | * | 0 | 143.1 | 0 | -101.6 | -174.8 | -168.2 | -158.6 | 3.5 | 107.9 | |||||
| 2 | L | 32.2 | Very low | 33.2 | Very low | 169 Ų | 169 | 150.6 Ų | 150.6 | 89% | 0.885 | 85% | 0.852 | S | S | * | * | trans | 81.4 | 93.8 | 175.4 | -55.8 | 156.2 | 0 | 0 | 0 | 112.7 | ||||
| 3 | S | 32.9 | Very low | 33.1 | Very low | 120 Ų | 120 | 148.8 Ų | 148.8 | 84% | 0.839 | 85% | 0.853 | S | S | * | * | 60.8 | 99.2 | 62.9 | -158.7 | 0 | 0 | 0 | 0 | 112.7 | |||||
| 4 | G | 31.5 | Very low | 32.8 | Very low | 80 Ų | 80 | 149.3 Ų | 149.3 | 83% | 0.825 | 85% | 0.851 | S | S | * | * | trans | -125.8 | 108.4 | 172.6 | 0 | 0 | 0 | 0 | 0 | 110.1 | ||||
| 5 | S | 34.2 | Very low | 32.8 | Very low | 120 Ų | 120 | 146.6 Ų | 146.6 | 84% | 0.839 | 85% | 0.845 | S | S | * | * | P | Polyproline II helix | trans | -69.7 | 139 | -178.8 | -60.2 | 0 | 0 | 0 | 0 | 112.4 | ||
| 6 | R | 33.9 | Very low | 32.9 | Very low | 242 Ų | 242 | 149.4 Ų | 149.4 | 91% | 0.913 | 85% | 0.849 | S | S | * | * | P | Polyproline II helix | trans | -80.2 | 122.3 | -180 | -162.1 | 179.2 | -78.4 | -177.1 | -5.2 | 109.7 | ||
| 7 | A | 34.5 | Very low | 32.9 | Very low | 98 Ų | 98 | 149.2 Ų | 149.2 | 81% | 0.81 | 84% | 0.844 | S | S | * | * | P | Polyproline II helix | trans | -76.3 | 139.6 | 176.5 | 0 | 0 | 0 | 0 | 0 | 111.7 | ||
| 8 | V | 34.2 | Very low | 32.9 | Very low | 132 Ų | 132 | 145.6 Ų | 145.6 | 80% | 0.8 | 83% | 0.827 | S | S | * | * | P | Polyproline II helix | trans | -93.3 | 134.1 | 174.8 | 177.2 | 0 | 0 | 0 | 0 | 108.5 | ||
| 9 | P | 32.8 | Very low | 33.1 | Very low | 119 Ų | 119 | 148.5 Ų | 148.5 | 77% | 0.773 | 83% | 0.829 | S | S | * | * | P | Polyproline II helix | trans | -80.6 | 133.5 | 177.4 | 24.2 | -18.9 | 0 | 0 | 0 | 111.9 | ||
| 10 | T | 31.9 | Very low | 33.1 | Very low | 128 Ų | 128 | 150.7 Ų | 150.7 | 79% | 0.785 | 83% | 0.826 | S | S | * | * | P | Polyproline II helix | trans | -75.4 | 136.4 | 169.6 | 43.3 | 0 | 0 | 0 | 0 | 111 | ||
| 11 | P | 32.6 | Very low | 33.2 | Very low | 128 Ų | 128 | 150.1 Ų | 150.1 | 83% | 0.831 | 82% | 0.819 | S | S | * | * | P | Polyproline II helix | trans | -81.9 | 125.1 | 172.1 | 10.9 | 3.7 | 0 | 0 | 0 | 111.2 | ||
| 12 | H | 28.9 | Very low | 33.1 | Very low | 174 Ų | 174 | 143.1 Ų | 143.1 | 81% | 0.806 | 80% | 0.803 | S | S | * | * | P | Polyproline II helix | trans | -66.2 | 130.7 | 164.5 | -101.5 | -72.3 | 0 | 0 | 0 | 110.1 | ||
| 13 | C | 31.7 | Very low | 33.3 | Very low | 127 Ų | 127 | 144.1 Ų | 144.1 | 86% | 0.858 | 80% | 0.803 | S | S | * | * | trans | -89.9 | 106.8 | 161.5 | -80.1 | 0 | 0 | 0 | 0 | 108.3 | S15 | C13-S15 PolarHBondContact O-N 3.37Š| ||
| 14 | D | 29.1 | Very low | 33.3 | Very low | 156 Ų | 156 | 149.5 Ų | 149.5 | 83% | 0.834 | 81% | 0.805 | S | S | * | * | trans | -69.4 | 119.9 | 166.4 | -78.4 | -32.4 | 0 | 0 | 0 | 109.6 | ||||
| 15 | S | 32.6 | Very low | 33.2 | Very low | 109 Ų | 109 | 151.1 Ų | 151.1 | 76% | 0.762 | 80% | 0.801 | S | S | * | * | trans | -78.3 | 115.7 | 172.5 | 49.7 | 0 | 0 | 0 | 0 | 109.6 | C13 | C13-S15 PolarHBondContact O-N 3.37Š| ||
| 16 | E | 34.1 | Very low | 32.8 | Very low | 192 Ų | 192 | 152 Ų | 152 | 90% | 0.897 | 81% | 0.805 | S | S | * | * | trans | -168.1 | 93.1 | 144.3 | -82.2 | -124 | 144.5 | 0 | 0 | 109.7 | ||||
| 17 | L | 33.8 | Very low | 32.7 | Very low | 146 Ų | 146 | 146.9 Ų | 146.9 | 76% | 0.764 | 80% | 0.795 | S | S | * | * | trans | -141 | 144.4 | 161.5 | -118.2 | 105.6 | 0 | 0 | 0 | 110.3 | M21 | L17-M21 HydrophobicContact CD2-CE 4.03Š| ||
| 18 | P | 31.8 | Very low | 32.5 | Very low | 84 Ų | 84 | 147.5 Ų | 147.5 | 55% | 0.545 | 79% | 0.793 | S | S | . | * | trans | -67.4 | 146 | -170.1 | -18.8 | 31.6 | 0 | 0 | 0 | 115 | Y20 | P18-Y20 HydrophobicContact CB-CD1 4Å; P18-Y20 HydrophobicContact CB-CE1 3.78Å; P18-Y20 HydrophobicContact CG-CE1 4.37Å; P18-Y20 PolarHBondContact O-N 3.48Å | ||
| 19 | K | 36.4 | Very low | 32.5 | Very low | 200 Ų | 200 | 147.2 Ų | 147.2 | 87% | 0.87 | 79% | 0.786 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -62.4 | 15.2 | -170 | -76.3 | 179.3 | 175.6 | 175.2 | 0 | 118.6 | ||
| 20 | Y | 34.9 | Very low | 32.5 | Very low | 192 Ų | 192 | 148.1 Ų | 148.1 | 75% | 0.753 | 79% | 0.79 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -103.6 | 6.8 | -179.2 | 64.7 | -96.3 | 0 | 0 | 0 | 115.5 | P18 | P18-Y20 HydrophobicContact CB-CD1 4Å; P18-Y20 HydrophobicContact CB-CE1 3.78Å; P18-Y20 HydrophobicContact CG-CE1 4.37Å; P18-Y20 PolarHBondContact O-N 3.48Å |
| 21 | M | 34.1 | Very low | 32.6 | Very low | 140 Ų | 140 | 147.8 Ų | 147.8 | 69% | 0.69 | 78% | 0.781 | S | S | * | * | trans | -115.2 | 39.8 | 177 | -78.5 | -150.9 | -78 | 0 | 0 | 114.3 | L17 | L17-M21 HydrophobicContact CD2-CE 4.03Š| ||
| 22 | L | 37.1 | Very low | 32.7 | Very low | 150 Ų | 150 | 150.6 Ų | 150.6 | 79% | 0.785 | 79% | 0.789 | S | S | * | * | trans | -104.1 | 77.6 | 175.3 | -94.9 | 126.8 | 0 | 0 | 0 | 111.9 | ||||
| 23 | H | 35.8 | Very low | 32.9 | Very low | 190 Ų | 190 | 144 Ų | 144 | 88% | 0.88 | 77% | 0.768 | S | S | * | * | trans | -165.3 | 69.7 | 149.5 | -110.1 | -57.6 | 0 | 0 | 0 | 111 | ||||
| 24 | R | 33.8 | Very low | 33.1 | Very low | 232 Ų | 232 | 143.8 Ų | 143.8 | 88% | 0.875 | 76% | 0.763 | S | S | * | * | trans | -139.4 | 130.3 | 152.7 | -74.5 | -163.9 | 179.2 | -137.6 | 0.1 | 109 | C26 | R24-C26 PolarHBondContact O-N 3.37Š| ||
| 25 | P | 28.5 | Very low | 33.9 | Very low | 115 Ų | 115 | 144.8 Ų | 144.8 | 75% | 0.747 | 76% | 0.756 | S | S | * | * | trans | -66.2 | 134.4 | 177.1 | 27.1 | -31.1 | 0 | 0 | 0 | 109.6 | I27 | P25-I27 PolarHBondContact O-N 2.71Š| ||
| 26 | C | 27.4 | Very low | 34.5 | Very low | 138 Ų | 138 | 145.7 Ų | 145.7 | 93% | 0.932 | 75% | 0.752 | S | S | * | * | trans | -65.3 | 103.1 | 168.5 | -82.2 | 0 | 0 | 0 | 0 | 108.5 | R24 S28 | R24-C26 PolarHBondContact O-N 3.37Å; C26-S28 PolarHBondContact O-N 3.21Å | ||
| 27 | I | 31.7 | Very low | 35.3 | Very low | 135 Ų | 135 | 142.5 Ų | 142.5 | 69% | 0.692 | 75% | 0.746 | S | S | * | * | trans | -81 | 113.5 | 166.7 | -62.4 | 173.8 | 0 | 0 | 0 | 106.5 | P25 L29 | P25-I27 PolarHBondContact O-N 2.71Å; I27-L29 HydrophobicContact CG2-CG 4.44Å; I27-L29 PolarHBondContact O-N 2.92Å | ||
| 28 | S | 29.9 | Very low | 36.6 | Very low | 110 Ų | 110 | 137.8 Ų | 137.8 | 77% | 0.769 | 73% | 0.725 | S | S | * | * | trans | -63.3 | 99.8 | 168.5 | 53.7 | 0 | 0 | 0 | 0 | 109.5 | C26 T30 | C26-S28 PolarHBondContact O-N 3.21Å; S28-T30 PolarHBondContact O-N 3.22Å | ||
| 29 | L | 33.3 | Very low | 37.6 | Very low | 126 Ų | 126 | 136 Ų | 136 | 66% | 0.66 | 72% | 0.722 | S | S | * | * | trans | -86.9 | 90.5 | 170.9 | -81 | 163 | 0 | 0 | 0 | 109.5 | I27 M31 | I27-L29 HydrophobicContact CG2-CG 4.44Å; I27-L29 PolarHBondContact O-N 2.92Å; L29-M31 VanDerWaalsContact C-N 3.33Å; L29-M31 HydrophobicContact CD2-CG 3.73Å; L29-M31 HydrophobicContact CD2-SD 3.9Å; L29-M31 PolarHBondContact O-N 3.49Å | ||
| 30 | T | 34.3 | Very low | 38.5 | Very low | 138 Ų | 138 | 131.1 Ų | 131.1 | 85% | 0.847 | 71% | 0.713 | S | S | * | * | trans | -78.5 | 90.1 | 146.3 | 46.6 | 0 | 0 | 0 | 0 | 107.4 | S28 | S28-T30 PolarHBondContact O-N 3.22Š| ||
| 31 | M | 32.4 | Very low | 39.4 | Very low | 122 Ų | 122 | 125.7 Ų | 125.7 | 60% | 0.601 | 70% | 0.703 | S | S | * | * | trans | -120.4 | 99.3 | 166.4 | -77.8 | -159.1 | 94.7 | 0 | 0 | 109.7 | L29 G33 | L29-M31 VanDerWaalsContact C-N 3.33Å; L29-M31 HydrophobicContact CD2-CG 3.73Å; L29-M31 HydrophobicContact CD2-SD 3.9Å; L29-M31 PolarHBondContact O-N 3.49Å; M31-G33 PolarHBondContact O-N 3.12Å | ||
| 32 | N | 35.2 | Very low | 40.7 | Very low | 186 Ų | 186 | 123.3 Ų | 123.3 | 100% | 0.995 | 69% | 0.693 | S | S | * | * | trans | -77 | 59.2 | 158 | -146.8 | 20.7 | 0 | 0 | 0 | 108.5 | ||||
| 33 | G | 34 | Very low | 42.2 | Very low | 35 Ų | 35 | 117.9 Ų | 117.9 | 36% | 0.361 | 66% | 0.664 | S | S | . | * | trans | -116.7 | 107.5 | 176.6 | 0 | 0 | 0 | 0 | 0 | 107.9 | M31 Y35 | M31-G33 PolarHBondContact O-N 3.12Å; G33-Y35 VanDerWaalsContact C-N 3.33Å; G33-Y35 PolarHBondContact O-N 3.31Å | ||
| 34 | T | 35.2 | Very low | 44.1 | Very low | 123 Ų | 123 | 113.4 Ų | 113.4 | 76% | 0.755 | 65% | 0.651 | S | S | * | * | trans | -58.5 | 100.6 | 163.7 | 35.9 | 0 | 0 | 0 | 0 | 107.7 | N36 | T34-N36 PolarHBondContact O-N 3.33Š| ||
| 35 | Y | 45.3 | Very low | 46.4 | Very low | 177 Ų | 177 | 104.2 Ų | 104.2 | 69% | 0.694 | 62% | 0.616 | S | S | * | * | trans | -63.3 | 95.3 | 160.6 | -68.9 | -84 | 0 | 0 | 0 | 105.9 | G33 T37 | G33-Y35 VanDerWaalsContact C-N 3.33Å; G33-Y35 PolarHBondContact O-N 3.31Å; Y35-T37 PolarHBondContact O-N 3.11Å | ||
| 36 | N | 44.7 | Very low | 49.2 | Very low | 128 Ų | 128 | 101.7 Ų | 101.7 | 68% | 0.684 | 60% | 0.6 | S | S | * | * | trans | -64.2 | 87.5 | 168.7 | -71.5 | -20.9 | 0 | 0 | 0 | 106.8 | T34 C38 | T34-N36 PolarHBondContact O-N 3.33Å; N36-C38 PolarHBondContact O-N 3.39Å | ||
| 37 | T | 51.8 | Low | 52.1 | Low | 126 Ų | 126 | 100.3 Ų | 100.3 | 77% | 0.773 | 59% | 0.589 | S | S | * | * | trans | -61.9 | 112 | 166.8 | 42.9 | 0 | 0 | 0 | 0 | 106.1 | Y35 G39 | Y35-T37 PolarHBondContact O-N 3.11Å; T37-G39 PolarHBondContact O-N 3Å | ||
| 38 | C | 60.5 | Low | 54.9 | Low | 46 Ų | 46 | 99 Ų | 99 | 31% | 0.311 | 59% | 0.588 | S | S | . | * | trans | -59.8 | 108.2 | 171.5 | -53.1 | 0 | 0 | 0 | 0 | 106.3 | N36 S40 C278 | N36-C38 PolarHBondContact O-N 3.39Å; C38-S40 PolarHBondContact O-N 3.14Å; C38-C278 WeakPolarHBondContact CA-SG 3.36Å; C38-C278 HydrophobicContact CB-CB 3.79Å; C38-C278 WeakPolarHBondContact CB-SG 3.38Å; C38-C278 WeakPolarHBondContact SG-CA 3.39Å; C38-C278 WeakPolarHBondContact SG-CB 3.33Å; C38-C278 CovalentContact SG-SG 2.03Å; C38-C278 PolarHBondContact SG-SG 2.96Å | ||
| 39 | G | 52.4 | Low | 57.7 | Low | 47 Ų | 47 | 97 Ų | 97 | 49% | 0.485 | 57% | 0.567 | S | S | . | * | trans | -49.5 | 139.6 | -180 | 0 | 0 | 0 | 0 | 0 | 109.8 | T37 S41 | T37-G39 PolarHBondContact O-N 3Å; G39-S41 PolarHBondContact O-N 3.47Å | ||
| 40 | S | 55.8 | Low | 60.3 | Low | 98 Ų | 98 | 95.6 Ų | 95.6 | 69% | 0.685 | 56% | 0.556 | S | S | * | * | trans | -71.1 | 54.9 | 171.6 | 53.1 | 0 | 0 | 0 | 0 | 110.3 | C38 D42 | C38-S40 PolarHBondContact O-N 3.14Å; S40-D42 PolarHBondContact O-N 3.04Å | ||
| 41 | S | 55.3 | Low | 62.9 | Low | 77 Ų | 77 | 94.8 Ų | 94.8 | 54% | 0.538 | 55% | 0.546 | S | S | . | . | trans | -62 | 130.2 | 174.4 | -49.2 | 0 | 0 | 0 | 0 | 108.4 | G39 R285 | G39-S41 PolarHBondContact O-N 3.47Å; S41-R285 PolarHBondContact O-NH1 3.31Å | ||
| 42 | D | 60.3 | Low | 65.8 | Low | 91 Ų | 91 | 90.9 Ų | 90.9 | 49% | 0.487 | 54% | 0.537 | S | S | . | . | trans | -51.4 | 141.3 | 166 | -76.3 | -58.1 | 0 | 0 | 0 | 110.8 | S40 T44 R194 | S40-D42 PolarHBondContact O-N 3.04Å; D42-T44 VanDerWaalsContact C-N 3.31Å; D42-T44 PolarHBondContact O-N 3.41Å; D42-R194 IonicContact OD1-CZ 3.28Å; D42-R194 IonicContact OD1-NH1 3.04Å; D42-R194 PolarHBondContact OD1-NH1 2.98Å; D42-R194 IonicContact OD1-NH2 2.8Å; D42-R194 PolarHBondContact OD1-NH2 3.46Å | ||
| 43 | L | 69.4 | Low | 68.4 | Low | 35 Ų | 35 | 83.9 Ų | 83.9 | 18% | 0.183 | 50% | 0.498 | C | S | . | . | trans | -66.3 | 94.4 | 175.2 | -170 | 67.6 | 0 | 0 | 0 | 108.4 | W45 E282 R285 R286 F289 | L43-W45 HydrophobicContact CD2-CZ2 4.02Å; L43-W45 HydrophobicContact CG-CZ2 4.41Å; L43-E282 WeakPolarHBondContact CD1-OE1 3.25Å; L43-R285 HydrophobicContact CD1-CB 4.47Å; L43-R285 HydrophobicContact CD1-CG 4.09Å; L43-R285 HydrophobicContact CD2-CG 4.45Å; L43-R286 HydrophobicContact CD1-CB 4.46Å; L43-R286 HydrophobicContact CD1-CG 3.37Å; L43-R286 HydrophobicContact CG-CG 4.42Å; L43-F289 HydrophobicContact CD2-CB 3.74Å; L43-F289 HydrophobicContact CD2-CD2 4.04Å; L43-F289 HydrophobicContact CD2-CG 3.85Å | ||
| 44 | T | 75.6 | Confident | 71 | Confident | 97 Ų | 97 | 85.8 Ų | 85.8 | 60% | 0.595 | 50% | 0.495 | S | S | * | . | trans | -85.6 | 122.5 | 179.9 | 55.2 | 0 | 0 | 0 | 0 | 109.7 | D42 R286 | D42-T44 VanDerWaalsContact C-N 3.31Å; D42-T44 PolarHBondContact O-N 3.41Å; T44-R286 PolarHBondContact O-NH1 3.42Å; T44-R286 VanDerWaalsContact O-NH1 3.17Å; T44-R286 PolarHBondContact O-NH2 3.37Å; T44-R286 VanDerWaalsContact O-NH2 3.13Å | ||
| 45 | W | 81.8 | Confident | 73.8 | Confident | 38 Ų | 38 | 82.4 Ų | 82.4 | 14% | 0.144 | 48% | 0.479 | C | S | . | . | trans | -111.8 | 144.8 | 172.9 | -68.7 | 104.9 | 0 | 0 | 0 | 109.7 | L43 I49 K50 F53 R286 F289 I290 | L43-W45 HydrophobicContact CD2-CZ2 4.02Å; L43-W45 HydrophobicContact CG-CZ2 4.41Å; W45-I49 HydrophobicContact CB-CB 4.41Å; W45-I49 HydrophobicContact CB-CG2 4.27Å; W45-I49 HydrophobicContact CD2-CG2 4.07Å; W45-I49 HydrophobicContact CE3-CB 4.46Å; W45-I49 HydrophobicContact CE3-CD1 4.11Å; W45-I49 HydrophobicContact CE3-CG2 3.7Å; W45-I49 HydrophobicContact CG-CG2 4.34Å; W45-I49 HydrophobicContact CZ3-CD1 4.45Å; W45-I49 HydrophobicContact CZ3-CG2 4.37Å; W45-K50 HydrophobicContact CB-CG 3.75Å; W45-K50 VanDerWaalsContact O-CE 3.26Å; W45-K50 WeakPolarHBondContact O-CE 3.44Å; W45-F53 HydrophobicContact CD2-CE2 4.13Å; W45-F53 HydrophobicContact CG-CE2 4.31Å; W45-R286 HydrophobicContact CH2-CB 3.86Å; W45-R286 HydrophobicContact CH2-CG 3.76Å; W45-R286 HydrophobicContact CZ2-CB 3.91Å; W45-R286 HydrophobicContact CZ2-CG 3.72Å; W45-F289 HydrophobicContact CZ2-CD1 4.36Å; W45-F289 AromaticContact NE1-CD1 4Å; W45-I290 HydrophobicContact CH2-CD1 3.98Å; W45-I290 HydrophobicContact CH2-CG1 4.37Å; W45-I290 HydrophobicContact CZ2-CG1 4.47Å | ||
| 46 | P | 88.1 | Confident | 76.1 | Confident | 62 Ų | 62 | 77.4 Ų | 77.4 | 40% | 0.403 | 46% | 0.46 | S | S | . | . | trans | -51 | 145.4 | 168 | -24.9 | 33 | 0 | 0 | 0 | 111.4 | T48 I49 K50 | P46-T48 PolarHBondContact O-N 2.95Å; P46-T48 VanDerWaalsContact O-N 3.16Å; P46-I49 HydrophobicContact CB-CG1 4.3Å; P46-I49 HydrophobicContact CG-CD1 3.99Å; P46-I49 HydrophobicContact CG-CG1 4.31Å; P46-I49 PolarHBondContact O-N 3.33Å; P46-K50 PolarHBondContact O-N 2.95Å | ||
| 47 | P | 88 | Confident | 78.4 | Confident | 109 Ų | 109 | 71.5 Ų | 71.5 | 71% | 0.708 | 43% | 0.428 | S | S | * | . | H | α-helix | trans | -54 | -36.7 | -179.5 | -27.1 | 34.5 | 0 | 0 | 0 | 113.7 | K50 L51 | P47-K50 PolarHBondContact O-N 3.38Å; P47-L51 WeakPolarHBondContact O-CB 3.29Å; P47-L51 PolarHBondContact O-N 3.3Å |
| 48 | T | 90.3 | Very high | 80.4 | Confident | 108 Ų | 108 | 66.8 Ų | 66.8 | 66% | 0.663 | 41% | 0.405 | S | S | * | . | H | α-helix | trans | -62.9 | -42.5 | 176.7 | 50.4 | 0 | 0 | 0 | 0 | 112.5 | P46 L51 G52 | P46-T48 PolarHBondContact O-N 2.95Å; P46-T48 VanDerWaalsContact O-N 3.16Å; T48-L51 PolarHBondContact O-N 3.45Å; T48-G52 PolarHBondContact O-N 3.02Å |
| 49 | I | 88.5 | Confident | 82 | Confident | 67 Ų | 67 | 69.8 Ų | 69.8 | 34% | 0.344 | 42% | 0.416 | S | S | . | . | H | α-helix | trans | -69.6 | -40.7 | 177.4 | -62.9 | -172.8 | 0 | 0 | 0 | 110.4 | W45 P46 G52 F53 | W45-I49 HydrophobicContact CB-CB 4.41Å; W45-I49 HydrophobicContact CB-CG2 4.27Å; W45-I49 HydrophobicContact CD2-CG2 4.07Å; W45-I49 HydrophobicContact CE3-CB 4.46Å; W45-I49 HydrophobicContact CE3-CD1 4.11Å; W45-I49 HydrophobicContact CE3-CG2 3.7Å; W45-I49 HydrophobicContact CG-CG2 4.34Å; W45-I49 HydrophobicContact CZ3-CD1 4.45Å; W45-I49 HydrophobicContact CZ3-CG2 4.37Å; P46-I49 HydrophobicContact CB-CG1 4.3Å; P46-I49 HydrophobicContact CG-CD1 3.99Å; P46-I49 HydrophobicContact CG-CG1 4.31Å; P46-I49 PolarHBondContact O-N 3.33Å; I49-G52 PolarHBondContact O-N 2.98Å; I49-F53 HydrophobicContact CG2-CD2 3.9Å; I49-F53 HydrophobicContact CG2-CE2 3.37Å; I49-F53 HydrophobicContact CG2-CZ 4.02Å; I49-F53 VanDerWaalsContact O-CD2 3.26Å; I49-F53 WeakPolarHBondContact O-CD2 3.44Å; I49-F53 PolarHBondContact O-N 3.44Å |
| 50 | K | 87.2 | Confident | 84.1 | Confident | 97 Ų | 97 | 68 Ų | 68 | 42% | 0.422 | 40% | 0.396 | S | S | . | . | H | α-helix | trans | -58.1 | -49.3 | 173.5 | -69.6 | -175.4 | 175.5 | -178.2 | 0 | 111 | W45 P46 P47 G52 F53 Y54 | W45-K50 HydrophobicContact CB-CG 3.75Å; W45-K50 VanDerWaalsContact O-CE 3.26Å; W45-K50 WeakPolarHBondContact O-CE 3.44Å; P46-K50 PolarHBondContact O-N 2.95Å; P47-K50 PolarHBondContact O-N 3.38Å; K50-G52 VanDerWaalsContact C-N 3.26Å; K50-G52 PolarHBondContact O-N 2.62Å; K50-F53 PolarHBondContact O-N 3.15Å; K50-F53 VanDerWaalsContact O-N 3.09Å; K50-Y54 HydrophobicContact CB-CE2 4.37Å; K50-Y54 WeakPolarHBondContact O-CD2 3.37Å; K50-Y54 PolarHBondContact O-N 3.13Å |
| 51 | L | 90.3 | Very high | 86 | Confident | 122 Ų | 122 | 65.1 Ų | 65.1 | 64% | 0.639 | 37% | 0.373 | S | S | * | . | H | α-helix | trans | -57.4 | -41.5 | 176.1 | -177.7 | 62.9 | 0 | 0 | 0 | 111.4 | P47 T48 F53 Y54 A55 | P47-L51 WeakPolarHBondContact O-CB 3.29Å; P47-L51 PolarHBondContact O-N 3.3Å; T48-L51 PolarHBondContact O-N 3.45Å; L51-F53 PolarHBondContact O-N 3.2Å; L51-Y54 PolarHBondContact O-N 3.41Å; L51-A55 WeakPolarHBondContact O-CB 3.21Å; L51-A55 PolarHBondContact O-N 2.94Å |
| 52 | G | 92.3 | Very high | 87.9 | Confident | 40 Ų | 40 | 65.8 Ų | 65.8 | 41% | 0.412 | 37% | 0.373 | S | S | . | . | H | α-helix | trans | -57.2 | -44.5 | 173.2 | 0 | 0 | 0 | 0 | 0 | 113.2 | T48 I49 K50 A55 Y56 | T48-G52 PolarHBondContact O-N 3.02Å; I49-G52 PolarHBondContact O-N 2.98Å; K50-G52 VanDerWaalsContact C-N 3.26Å; K50-G52 PolarHBondContact O-N 2.62Å; G52-A55 PolarHBondContact O-N 2.84Å; G52-Y56 VanDerWaalsContact O-CB 3.27Å; G52-Y56 WeakPolarHBondContact O-CB 3.43Å; G52-Y56 PolarHBondContact O-N 3.39Å |
| 53 | F | 89.4 | Confident | 89.7 | Confident | 39 Ų | 39 | 65 Ų | 65 | 17% | 0.171 | 37% | 0.369 | C | S | . | . | H | α-helix | trans | -66.1 | -40.5 | 175.9 | -69.7 | -53.9 | 0 | 0 | 0 | 112.9 | W45 I49 K50 L51 Y56 L57 F289 I290 K293 | W45-F53 HydrophobicContact CD2-CE2 4.13Å; W45-F53 HydrophobicContact CG-CE2 4.31Å; I49-F53 HydrophobicContact CG2-CD2 3.9Å; I49-F53 HydrophobicContact CG2-CE2 3.37Å; I49-F53 HydrophobicContact CG2-CZ 4.02Å; I49-F53 VanDerWaalsContact O-CD2 3.26Å; I49-F53 WeakPolarHBondContact O-CD2 3.44Å; I49-F53 PolarHBondContact O-N 3.44Å; K50-F53 PolarHBondContact O-N 3.15Å; K50-F53 VanDerWaalsContact O-N 3.09Å; L51-F53 PolarHBondContact O-N 3.2Å; F53-Y56 PolarHBondContact O-N 3.19Å; F53-L57 VanDerWaalsContact O-CG 3.31Å; F53-L57 WeakPolarHBondContact O-CG 3.15Å; F53-L57 PolarHBondContact O-N 3.27Å; F53-F289 HydrophobicContact CD1-CE1 4.04Å; F53-F289 AromaticContact CD2-CE1 3.7Å; F53-F289 HydrophobicContact CD2-CE1 3.7Å; F53-F289 HydrophobicContact CD2-CZ 4.3Å; F53-F289 HydrophobicContact CE1-CD1 4.36Å; F53-F289 AromaticContact CE1-CE1 3.87Å; F53-F289 HydrophobicContact CE1-CE1 3.87Å; F53-F289 HydrophobicContact CE2-CD1 4.11Å; F53-F289 AromaticContact CE2-CE1 3.49Å; F53-F289 HydrophobicContact CE2-CE1 3.49Å; F53-F289 VanDerWaalsContact CE2-CE1 3.49Å; F53-F289 HydrophobicContact CE2-CZ 4.45Å; F53-F289 AromaticContact CG-CE1 3.98Å; F53-F289 HydrophobicContact CG-CE1 3.98Å; F53-F289 AromaticContact CZ-CD1 3.93Å; F53-F289 HydrophobicContact CZ-CD1 3.93Å; F53-F289 AromaticContact CZ-CE1 3.6Å; F53-F289 HydrophobicContact CZ-CE1 3.6Å; F53-I290 HydrophobicContact CZ-CG1 4.32Å; F53-K293 HydrophobicContact CD1-CG 4.22Å; F53-K293 HydrophobicContact CE1-CG 4.35Å |
| 54 | Y | 89.9 | Confident | 91 | Very high | 75 Ų | 75 | 63.4 Ų | 63.4 | 29% | 0.294 | 36% | 0.36 | S | S | . | . | H | α-helix | trans | -63.7 | -45.6 | 175.2 | -74.7 | -68.6 | 0 | 0 | 0 | 111.8 | K50 L51 Y56 L57 G58 L107 Q111 | K50-Y54 HydrophobicContact CB-CE2 4.37Å; K50-Y54 WeakPolarHBondContact O-CD2 3.37Å; K50-Y54 PolarHBondContact O-N 3.13Å; L51-Y54 PolarHBondContact O-N 3.41Å; Y54-Y56 VanDerWaalsContact C-N 3.35Å; Y54-Y56 PolarHBondContact O-N 3Å; Y54-L57 PolarHBondContact O-N 3.23Å; Y54-G58 PolarHBondContact O-N 3.29Å; Y54-L107 HydrophobicContact CD1-CD2 3.63Å; Y54-L107 HydrophobicContact CE1-CD2 3.82Å; Y54-Q111 WeakPolarHBondContact OH-CG 3.48Å |
| 55 | A | 93.3 | Very high | 92 | Very high | 52 Ų | 52 | 61.6 Ų | 61.6 | 43% | 0.43 | 35% | 0.346 | S | S | . | . | H | α-helix | trans | -60.6 | -45.1 | 176.2 | 0 | 0 | 0 | 0 | 0 | 111.2 | L51 G52 L57 G58 I59 | L51-A55 WeakPolarHBondContact O-CB 3.21Å; L51-A55 PolarHBondContact O-N 2.94Å; G52-A55 PolarHBondContact O-N 2.84Å; A55-L57 PolarHBondContact O-N 3.49Å; A55-G58 PolarHBondContact O-N 3.1Å; A55-I59 VanDerWaalsContact O-CG1 3.31Å; A55-I59 WeakPolarHBondContact O-CG1 3.36Å; A55-I59 PolarHBondContact O-N 3.22Å |
| 56 | Y | 94 | Very high | 92.8 | Very high | 72 Ų | 72 | 65.2 Ų | 65.2 | 28% | 0.282 | 37% | 0.368 | S | S | . | . | H | α-helix | trans | -56.9 | -49.7 | 175.4 | 172.5 | -103.8 | 0 | 0 | 0 | 112.4 | G52 F53 Y54 G58 I59 L60 K293 A297 | G52-Y56 VanDerWaalsContact O-CB 3.27Å; G52-Y56 WeakPolarHBondContact O-CB 3.43Å; G52-Y56 PolarHBondContact O-N 3.39Å; F53-Y56 PolarHBondContact O-N 3.19Å; Y54-Y56 VanDerWaalsContact C-N 3.35Å; Y54-Y56 PolarHBondContact O-N 3Å; Y56-G58 VanDerWaalsContact C-N 3.33Å; Y56-G58 PolarHBondContact O-N 3.43Å; Y56-I59 PolarHBondContact O-N 2.95Å; Y56-L60 HydrophobicContact CD1-CD1 4.18Å; Y56-L60 HydrophobicContact CE1-CD1 3.46Å; Y56-L60 VanDerWaalsContact CE1-CD1 3.46Å; Y56-L60 HydrophobicContact CE1-CG 4.13Å; Y56-L60 HydrophobicContact CE2-CD1 4.31Å; Y56-L60 HydrophobicContact CE2-CD2 4.3Å; Y56-L60 HydrophobicContact CE2-CG 4.22Å; Y56-L60 WeakPolarHBondContact O-CG 3.49Å; Y56-L60 PolarHBondContact O-N 3.32Å; Y56-K293 HydrophobicContact CE1-CB 4.07Å; Y56-K293 WeakPolarHBondContact CE1-O 3.4Å; Y56-K293 PolarHBondContact OH-O 3.4Å; Y56-A297 WeakPolarHBondContact OH-CB 3.39Å |
| 57 | L | 91.9 | Very high | 93.1 | Very high | 3 Ų | 3 | 64.9 Ų | 64.9 | 2% | 0.016 | 36% | 0.362 | C | S | . | . | H | α-helix | trans | -66.2 | -34.9 | 178.5 | -68.5 | 175.7 | 0 | 0 | 0 | 112.2 | F53 Y54 A55 L60 L61 L103 L107 K293 | F53-L57 VanDerWaalsContact O-CG 3.31Å; F53-L57 WeakPolarHBondContact O-CG 3.15Å; F53-L57 PolarHBondContact O-N 3.27Å; Y54-L57 PolarHBondContact O-N 3.23Å; A55-L57 PolarHBondContact O-N 3.49Å; L57-L60 HydrophobicContact CD2-CD1 4.29Å; L57-L60 PolarHBondContact O-N 3.18Å; L57-L61 WeakPolarHBondContact O-CB 3.42Å; L57-L61 PolarHBondContact O-N 3.23Å; L57-L103 HydrophobicContact CB-CD2 4.31Å; L57-L103 HydrophobicContact CD2-CD1 4.28Å; L57-L103 HydrophobicContact CD2-CD2 4.43Å; L57-L103 WeakPolarHBondContact O-CD2 3.21Å; L57-L107 HydrophobicContact CB-CD2 4Å; L57-L107 HydrophobicContact CD1-CD2 3.36Å; L57-L107 HydrophobicContact CD1-CG 4.44Å; L57-L107 HydrophobicContact CG-CD2 4.32Å; L57-K293 HydrophobicContact CD2-CD 4.25Å |
| 58 | G | 93.9 | Very high | 93.6 | Very high | 28 Ų | 28 | 59.7 Ų | 59.7 | 29% | 0.289 | 33% | 0.329 | S | S | . | . | H | α-helix | trans | -63.8 | -40.8 | 172.2 | 0 | 0 | 0 | 0 | 0 | 112.7 | Y54 A55 Y56 L61 V62 | Y54-G58 PolarHBondContact O-N 3.29Å; A55-G58 PolarHBondContact O-N 3.1Å; Y56-G58 VanDerWaalsContact C-N 3.33Å; Y56-G58 PolarHBondContact O-N 3.43Å; G58-L61 WeakPolarHBondContact O-CB 3.34Å; G58-L61 PolarHBondContact O-N 3.34Å; G58-V62 WeakPolarHBondContact O-CG2 3.49Å; G58-V62 PolarHBondContact O-N 2.72Å |
| 59 | I | 95.2 | Very high | 93.9 | Very high | 108 Ų | 108 | 57.2 Ų | 57.2 | 55% | 0.554 | 32% | 0.316 | S | S | * | . | H | α-helix | trans | -63.4 | -47.5 | 174.1 | -68.3 | 165.5 | 0 | 0 | 0 | 110.2 | A55 Y56 L61 V62 L63 | A55-I59 VanDerWaalsContact O-CG1 3.31Å; A55-I59 WeakPolarHBondContact O-CG1 3.36Å; A55-I59 PolarHBondContact O-N 3.22Å; Y56-I59 PolarHBondContact O-N 2.95Å; I59-L61 VanDerWaalsContact C-N 3.28Å; I59-L61 PolarHBondContact O-N 2.93Å; I59-V62 PolarHBondContact O-N 3.39Å; I59-L63 WeakPolarHBondContact O-CB 3.39Å; I59-L63 PolarHBondContact O-N 3.41Å |
| 60 | L | 95.3 | Very high | 94.2 | Very high | 11 Ų | 11 | 58.8 Ų | 58.8 | 6% | 0.058 | 33% | 0.325 | C | S | . | . | H | α-helix | trans | -59.4 | -40.2 | 176.2 | -69.5 | -173.2 | 0 | 0 | 0 | 112 | Y56 L57 G64 L100 D296 C300 | Y56-L60 HydrophobicContact CD1-CD1 4.18Å; Y56-L60 HydrophobicContact CE1-CD1 3.46Å; Y56-L60 VanDerWaalsContact CE1-CD1 3.46Å; Y56-L60 HydrophobicContact CE1-CG 4.13Å; Y56-L60 HydrophobicContact CE2-CD1 4.31Å; Y56-L60 HydrophobicContact CE2-CD2 4.3Å; Y56-L60 HydrophobicContact CE2-CG 4.22Å; Y56-L60 WeakPolarHBondContact O-CG 3.49Å; Y56-L60 PolarHBondContact O-N 3.32Å; L57-L60 HydrophobicContact CD2-CD1 4.29Å; L57-L60 PolarHBondContact O-N 3.18Å; L60-G64 VanDerWaalsContact O-CA 3.25Å; L60-G64 WeakPolarHBondContact O-CA 3.45Å; L60-G64 PolarHBondContact O-N 3.32Å; L60-L100 VanDerWaalsContact O-CD2 3.31Å; L60-L100 WeakPolarHBondContact O-CD2 3.34Å; L60-D296 HydrophobicContact CD1-CB 3.68Å; L60-C300 HydrophobicContact CD2-CB 4.36Å |
| 61 | L | 95.9 | Very high | 94.5 | Very high | 37 Ų | 37 | 54.6 Ų | 54.6 | 19% | 0.194 | 31% | 0.308 | C | S | . | . | H | α-helix | trans | -59 | -55.9 | 177 | -178.8 | 58.1 | 0 | 0 | 0 | 111.2 | L57 G58 I59 L65 L100 L103 P104 | L57-L61 WeakPolarHBondContact O-CB 3.42Å; L57-L61 PolarHBondContact O-N 3.23Å; G58-L61 WeakPolarHBondContact O-CB 3.34Å; G58-L61 PolarHBondContact O-N 3.34Å; I59-L61 VanDerWaalsContact C-N 3.28Å; I59-L61 PolarHBondContact O-N 2.93Å; L61-L65 HydrophobicContact CD1-CD1 3.71Å; L61-L65 HydrophobicContact CD1-CG 4.16Å; L61-L65 HydrophobicContact CG-CD1 4.12Å; L61-L65 VanDerWaalsContact O-CB 3.29Å; L61-L65 WeakPolarHBondContact O-CB 3.45Å; L61-L65 WeakPolarHBondContact O-CG 3.34Å; L61-L65 PolarHBondContact O-N 3.2Å; L61-L100 HydrophobicContact CD1-CB 4.23Å; L61-L100 HydrophobicContact CD1-CD2 4.44Å; L61-L100 WeakPolarHBondContact CD1-O 3.35Å; L61-L103 HydrophobicContact CB-CD2 4.14Å; L61-L103 HydrophobicContact CD1-CB 4.48Å; L61-P104 HydrophobicContact CD2-CG 4.24Å |
| 62 | V | 96.4 | Very high | 94.8 | Very high | 90 Ų | 90 | 50.9 Ų | 50.9 | 55% | 0.545 | 29% | 0.288 | S | S | . | . | H | α-helix | trans | -65.8 | -51.9 | -176.1 | 174.3 | 0 | 0 | 0 | 0 | 110.6 | G58 I59 L65 L66 | G58-V62 WeakPolarHBondContact O-CG2 3.49Å; G58-V62 PolarHBondContact O-N 2.72Å; I59-V62 PolarHBondContact O-N 3.39Å; V62-L65 PolarHBondContact O-N 2.94Å; V62-L66 HydrophobicContact CG1-CD1 4.1Å; V62-L66 VanDerWaalsContact O-CG 3.28Å; V62-L66 WeakPolarHBondContact O-CG 3.14Å; V62-L66 PolarHBondContact O-N 3.37Å; V62-L66 VanDerWaalsContact O-N 3.12Å |
| 63 | L | 97 | Very high | 94.9 | Very high | 76 Ų | 76 | 55.2 Ų | 55.2 | 40% | 0.398 | 29% | 0.293 | S | S | . | . | H | α-helix | trans | -65 | -45.2 | -177.3 | -176.5 | 61.3 | 0 | 0 | 0 | 111.1 | I59 L66 L67 C300 | I59-L63 WeakPolarHBondContact O-CB 3.39Å; I59-L63 PolarHBondContact O-N 3.41Å; L63-L66 PolarHBondContact O-N 3.5Å; L63-L67 HydrophobicContact CD1-CD1 3.73Å; L63-L67 HydrophobicContact CD1-CG 3.96Å; L63-L67 HydrophobicContact CD2-CD1 4.28Å; L63-L67 HydrophobicContact CG-CD1 3.62Å; L63-L67 HydrophobicContact CG-CG 4.24Å; L63-L67 WeakPolarHBondContact O-CB 3.38Å; L63-L67 VanDerWaalsContact O-CG 3.25Å; L63-L67 WeakPolarHBondContact O-CG 3.38Å; L63-L67 PolarHBondContact O-N 2.89Å; L63-C300 HydrophobicContact CD2-CB 4.41Å |
| 64 | G | 96.9 | Very high | 95 | Very high | 0 Ų | 0 | 55.1 Ų | 55.1 | 0% | 0 | 30% | 0.295 | C | S | . | . | H | α-helix | trans | -61.3 | -44.9 | 178.6 | 0 | 0 | 0 | 0 | 0 | 112.1 | L60 L66 L67 N68 | L60-G64 VanDerWaalsContact O-CA 3.25Å; L60-G64 WeakPolarHBondContact O-CA 3.45Å; L60-G64 PolarHBondContact O-N 3.32Å; G64-L66 VanDerWaalsContact C-N 3.35Å; G64-L66 PolarHBondContact O-N 3.46Å; G64-L67 PolarHBondContact O-N 3.2Å; G64-N68 VanDerWaalsContact O-CB 3.28Å; G64-N68 WeakPolarHBondContact O-CB 3.47Å; G64-N68 PolarHBondContact O-N 2.96Å; G64-N68 PolarHBondContact O-ND2 3.45Å |
| 65 | L | 97.3 | Very high | 95.2 | Very high | 59 Ų | 59 | 51.7 Ų | 51.7 | 31% | 0.309 | 28% | 0.282 | S | S | . | . | H | α-helix | trans | -62.2 | -44.1 | 178 | -76.7 | 172.4 | 0 | 0 | 0 | 111.1 | L61 V62 S69 L97 L100 | L61-L65 HydrophobicContact CD1-CD1 3.71Å; L61-L65 HydrophobicContact CD1-CG 4.16Å; L61-L65 HydrophobicContact CG-CD1 4.12Å; L61-L65 VanDerWaalsContact O-CB 3.29Å; L61-L65 WeakPolarHBondContact O-CB 3.45Å; L61-L65 WeakPolarHBondContact O-CG 3.34Å; L61-L65 PolarHBondContact O-N 3.2Å; V62-L65 PolarHBondContact O-N 2.94Å; L65-S69 WeakPolarHBondContact O-CB 3.48Å; L65-S69 PolarHBondContact O-N 3.09Å; L65-S69 PolarHBondContact O-OG 2.77Å; L65-L97 HydrophobicContact CD2-CD2 3.92Å; L65-L100 HydrophobicContact CD2-CB 3.82Å; L65-L100 HydrophobicContact CD2-CD1 4.32Å; L65-L100 HydrophobicContact CG-CB 4.1Å; L65-L100 HydrophobicContact CG-CD1 4.4Å |
| 66 | L | 96.9 | Very high | 95 | Very high | 115 Ų | 115 | 52.1 Ų | 52.1 | 60% | 0.602 | 28% | 0.281 | S | S | * | . | H | α-helix | trans | -62.4 | -52.3 | 178 | -69.6 | 172.7 | 0 | 0 | 0 | 111.7 | V62 L63 G64 L70 | V62-L66 HydrophobicContact CG1-CD1 4.1Å; V62-L66 VanDerWaalsContact O-CG 3.28Å; V62-L66 WeakPolarHBondContact O-CG 3.14Å; V62-L66 PolarHBondContact O-N 3.37Å; V62-L66 VanDerWaalsContact O-N 3.12Å; L63-L66 PolarHBondContact O-N 3.5Å; G64-L66 VanDerWaalsContact C-N 3.35Å; G64-L66 PolarHBondContact O-N 3.46Å; L66-L70 WeakPolarHBondContact O-CB 3.38Å; L66-L70 PolarHBondContact O-N 3.48Å |
| 67 | L | 96.2 | Very high | 94.8 | Very high | 54 Ų | 54 | 52.7 Ų | 52.7 | 28% | 0.283 | 30% | 0.295 | S | S | . | . | H | α-helix | trans | -65 | -47.2 | -175.9 | -68.1 | 173.6 | 0 | 0 | 0 | 111.9 | L63 G64 A71 A303 | L63-L67 HydrophobicContact CD1-CD1 3.73Å; L63-L67 HydrophobicContact CD1-CG 3.96Å; L63-L67 HydrophobicContact CD2-CD1 4.28Å; L63-L67 HydrophobicContact CG-CD1 3.62Å; L63-L67 HydrophobicContact CG-CG 4.24Å; L63-L67 WeakPolarHBondContact O-CB 3.38Å; L63-L67 VanDerWaalsContact O-CG 3.25Å; L63-L67 WeakPolarHBondContact O-CG 3.38Å; L63-L67 PolarHBondContact O-N 2.89Å; G64-L67 PolarHBondContact O-N 3.2Å; L67-A71 VanDerWaalsContact O-CB 3.26Å; L67-A71 WeakPolarHBondContact O-CB 3.3Å; L67-A71 PolarHBondContact O-N 2.89Å; L67-A303 HydrophobicContact CB-CB 4.18Å; L67-A303 HydrophobicContact CD1-CB 3.76Å; L67-A303 HydrophobicContact CD2-CB 4.17Å; L67-A303 HydrophobicContact CG-CB 4.26Å |
| 68 | N | 96.9 | Very high | 94.6 | Very high | 0 Ų | 0 | 60 Ų | 60 | 0% | 0 | 32% | 0.322 | C | S | . | . | H | α-helix | trans | -73.1 | -37.7 | -177.4 | -71.7 | -73.9 | 0 | 0 | 0 | 112.4 | G64 A71 L72 L97 C299 Y306 | G64-N68 VanDerWaalsContact O-CB 3.28Å; G64-N68 WeakPolarHBondContact O-CB 3.47Å; G64-N68 PolarHBondContact O-N 2.96Å; G64-N68 PolarHBondContact O-ND2 3.45Å; N68-A71 PolarHBondContact O-N 3.34Å; N68-L72 VanDerWaalsContact O-CB 3.27Å; N68-L72 WeakPolarHBondContact O-CB 3.25Å; N68-L72 PolarHBondContact O-N 3.41Å; N68-L97 HydrophobicContact CB-CD1 4.44Å; N68-L97 HydrophobicContact CB-CD2 3.74Å; N68-L97 HydrophobicContact CB-CG 3.8Å; N68-C299 PolarHBondContact ND2-O 2.91Å; N68-Y306 WeakPolarHBondContact OD1-CE2 3.35Å; N68-Y306 PolarHBondContact OD1-OH 3.12Å; N68-Y306 VanDerWaalsContact OD1-OH 3.11Å |
| 69 | S | 96.6 | Very high | 94.2 | Very high | 57 Ų | 57 | 59.2 Ų | 59.2 | 40% | 0.399 | 31% | 0.311 | S | S | . | . | H | α-helix | trans | -67.2 | -42.1 | 175.8 | -56.6 | 0 | 0 | 0 | 0 | 111.3 | L65 L72 W73 | L65-S69 WeakPolarHBondContact O-CB 3.48Å; L65-S69 PolarHBondContact O-N 3.09Å; L65-S69 PolarHBondContact O-OG 2.77Å; S69-L72 PolarHBondContact O-N 2.95Å; S69-W73 WeakPolarHBondContact O-CB 3.42Å; S69-W73 PolarHBondContact O-N 3.43Å |
| 70 | L | 95.3 | Very high | 93.5 | Very high | 100 Ų | 100 | 62.2 Ų | 62.2 | 52% | 0.524 | 32% | 0.322 | S | S | . | . | H | α-helix | trans | -62.1 | -46.5 | 174.9 | 178.6 | 62.2 | 0 | 0 | 0 | 111 | L66 L72 W73 V74 | L66-L70 WeakPolarHBondContact O-CB 3.38Å; L66-L70 PolarHBondContact O-N 3.48Å; L70-L72 PolarHBondContact O-N 3.41Å; L70-W73 HydrophobicContact CD1-CE3 4.04Å; L70-W73 HydrophobicContact CD1-CZ3 4.43Å; L70-W73 PolarHBondContact O-N 3.25Å; L70-V74 HydrophobicContact CD1-CG2 4.34Å; L70-V74 WeakPolarHBondContact O-CG2 3.28Å; L70-V74 PolarHBondContact O-N 2.95Å |
| 71 | A | 94.4 | Very high | 93 | Very high | 9 Ų | 9 | 71.2 Ų | 71.2 | 7% | 0.074 | 36% | 0.356 | C | S | . | . | H | α-helix | trans | -59.1 | -48.3 | 176.7 | 0 | 0 | 0 | 0 | 0 | 111.2 | L67 N68 W73 V74 F75 Y306 | L67-A71 VanDerWaalsContact O-CB 3.26Å; L67-A71 WeakPolarHBondContact O-CB 3.3Å; L67-A71 PolarHBondContact O-N 2.89Å; N68-A71 PolarHBondContact O-N 3.34Å; A71-W73 VanDerWaalsContact C-N 3.33Å; A71-W73 PolarHBondContact O-N 3.24Å; A71-V74 PolarHBondContact O-N 3.43Å; A71-F75 HydrophobicContact CB-CE1 4.37Å; A71-F75 HydrophobicContact CB-CE2 4Å; A71-F75 HydrophobicContact CB-CZ 3.88Å; A71-F75 WeakPolarHBondContact O-CB 3.29Å; A71-F75 WeakPolarHBondContact O-CD1 3.43Å; A71-F75 WeakPolarHBondContact O-CD2 3.38Å; A71-F75 WeakPolarHBondContact O-CG 3.21Å; A71-F75 PolarHBondContact O-N 2.86Å; A71-Y306 HydrophobicContact CB-CD2 3.28Å; A71-Y306 HydrophobicContact CB-CE2 3.68Å; A71-Y306 HydrophobicContact CB-CG 3.89Å |
| 72 | L | 95.1 | Very high | 92.6 | Very high | 43 Ų | 43 | 75.2 Ų | 75.2 | 23% | 0.225 | 37% | 0.368 | C | S | . | . | H | α-helix | trans | -61 | -41.3 | 178.4 | -169.6 | 64.9 | 0 | 0 | 0 | 111.8 | N68 S69 L70 F75 C76 T90 V94 L97 | N68-L72 VanDerWaalsContact O-CB 3.27Å; N68-L72 WeakPolarHBondContact O-CB 3.25Å; N68-L72 PolarHBondContact O-N 3.41Å; S69-L72 PolarHBondContact O-N 2.95Å; L70-L72 PolarHBondContact O-N 3.41Å; L72-F75 PolarHBondContact O-N 2.99Å; L72-C76 VanDerWaalsContact O-CB 3.29Å; L72-C76 WeakPolarHBondContact O-CB 3.25Å; L72-C76 PolarHBondContact O-N 3.09Å; L72-C76 PolarHBondContact O-SG 3.01Å; L72-C76 VanDerWaalsContact O-SG 3.34Å; L72-T90 HydrophobicContact CD1-CG2 3.79Å; L72-V94 HydrophobicContact CD1-CG2 4.27Å; L72-L97 HydrophobicContact CD2-CD1 3.82Å |
| 73 | W | 94.9 | Very high | 92.3 | Very high | 132 Ų | 132 | 73.6 Ų | 73.6 | 50% | 0.5 | 36% | 0.359 | S | S | . | . | H | α-helix | trans | -63.3 | -46.9 | 174.3 | 174.5 | 80.8 | 0 | 0 | 0 | 112.3 | S69 L70 A71 F75 C76 C77 R78 | S69-W73 WeakPolarHBondContact O-CB 3.42Å; S69-W73 PolarHBondContact O-N 3.43Å; L70-W73 HydrophobicContact CD1-CE3 4.04Å; L70-W73 HydrophobicContact CD1-CZ3 4.43Å; L70-W73 PolarHBondContact O-N 3.25Å; A71-W73 VanDerWaalsContact C-N 3.33Å; A71-W73 PolarHBondContact O-N 3.24Å; W73-F75 VanDerWaalsContact C-N 3.31Å; W73-F75 PolarHBondContact O-N 3.45Å; W73-C76 PolarHBondContact O-N 2.93Å; W73-C77 WeakPolarHBondContact O-CA 3.38Å; W73-C77 VanDerWaalsContact O-CB 3.24Å; W73-C77 WeakPolarHBondContact O-CB 3.45Å; W73-C77 PolarHBondContact O-N 3.2Å; W73-R78 HydrophobicContact CE3-CG 4.24Å; W73-R78 HydrophobicContact CH2-CG 3.77Å; W73-R78 HydrophobicContact CZ2-CG 4.11Å; W73-R78 HydrophobicContact CZ3-CG 3.83Å |
| 74 | V | 92.4 | Very high | 92.1 | Very high | 37 Ų | 37 | 71.5 Ų | 71.5 | 22% | 0.224 | 35% | 0.347 | C | S | . | . | I | π-helix | trans | -59.6 | -46.2 | 176.1 | 171.1 | 0 | 0 | 0 | 0 | 110.1 | L70 A71 R78 M79 | L70-V74 HydrophobicContact CD1-CG2 4.34Å; L70-V74 WeakPolarHBondContact O-CG2 3.28Å; L70-V74 PolarHBondContact O-N 2.95Å; A71-V74 PolarHBondContact O-N 3.43Å; V74-R78 HydrophobicContact CG1-CB 4.34Å; V74-R78 WeakPolarHBondContact O-CA 3.34Å; V74-R78 WeakPolarHBondContact O-CB 3.38Å; V74-R78 PolarHBondContact O-N 3.35Å; V74-M79 HydrophobicContact CG1-CG 4.48Å; V74-M79 PolarHBondContact O-N 3.01Å; V74-M79 VanDerWaalsContact O-N 3.14Å |
| 75 | F | 92.4 | Very high | 91.6 | Very high | 3 Ų | 3 | 71.7 Ų | 71.7 | 1% | 0.013 | 35% | 0.348 | C | S | . | . | I | π-helix | trans | -64.1 | -52.7 | -178.4 | -59.7 | -8.7 | 0 | 0 | 0 | 109.4 | A71 L72 W73 M79 R86 M89 Y306 M309 | A71-F75 HydrophobicContact CB-CE1 4.37Å; A71-F75 HydrophobicContact CB-CE2 4Å; A71-F75 HydrophobicContact CB-CZ 3.88Å; A71-F75 WeakPolarHBondContact O-CB 3.29Å; A71-F75 WeakPolarHBondContact O-CD1 3.43Å; A71-F75 WeakPolarHBondContact O-CD2 3.38Å; A71-F75 WeakPolarHBondContact O-CG 3.21Å; A71-F75 PolarHBondContact O-N 2.86Å; L72-F75 PolarHBondContact O-N 2.99Å; W73-F75 VanDerWaalsContact C-N 3.31Å; W73-F75 PolarHBondContact O-N 3.45Å; F75-M79 HydrophobicContact CD1-SD 3.78Å; F75-M79 HydrophobicContact CG-SD 4.49Å; F75-R86 HydrophobicContact CB-CG 4.4Å; F75-R86 PolarHBondContact O-NE 2.99Å; F75-R86 PolarHBondContact O-NH2 3.24Å; F75-M89 HydrophobicContact CD2-CB 4.39Å; F75-M89 HydrophobicContact CE2-CB 3.72Å; F75-M89 HydrophobicContact CZ-CB 4.28Å; F75-Y306 AromaticContact CE2-CD1 3.91Å; F75-Y306 HydrophobicContact CE2-CD1 3.91Å; F75-Y306 HydrophobicContact CE2-CE1 4.21Å; F75-Y306 HydrophobicContact CE2-CG 4.26Å; F75-Y306 AromaticContact CZ-CD1 3.67Å; F75-Y306 HydrophobicContact CZ-CD1 3.67Å; F75-Y306 HydrophobicContact CZ-CD2 4.5Å; F75-Y306 HydrophobicContact CZ-CE1 4.42Å; F75-Y306 AromaticContact CZ-CG 3.74Å; F75-Y306 HydrophobicContact CZ-CG 3.74Å; F75-M309 HydrophobicContact CD1-CE 3.31Å; F75-M309 HydrophobicContact CE1-CE 3Å; F75-M309 HydrophobicContact CE1-SD 4.27Å; F75-M309 HydrophobicContact CE2-CE 4.36Å; F75-M309 HydrophobicContact CG-CE 4.15Å; F75-M309 HydrophobicContact CZ-CE 3.57Å; F75-M309 HydrophobicContact CZ-SD 4.32Å |
| 76 | C | 90.4 | Very high | 91.4 | Very high | 60 Ų | 60 | 69 Ų | 69 | 41% | 0.405 | 33% | 0.334 | S | S | . | . | I | π-helix | trans | -72.2 | -39.7 | -175.2 | -67.2 | 0 | 0 | 0 | 0 | 113.5 | L72 W73 | L72-C76 VanDerWaalsContact O-CB 3.29Å; L72-C76 WeakPolarHBondContact O-CB 3.25Å; L72-C76 PolarHBondContact O-N 3.09Å; L72-C76 PolarHBondContact O-SG 3.01Å; L72-C76 VanDerWaalsContact O-SG 3.34Å; W73-C76 PolarHBondContact O-N 2.93Å |
| 77 | C | 89.6 | Confident | 91.3 | Very high | 85 Ų | 85 | 64.3 Ų | 64.3 | 57% | 0.574 | 31% | 0.309 | S | S | * | . | I | π-helix | trans | -107.4 | -24.8 | -166.4 | -56.3 | 0 | 0 | 0 | 0 | 114.7 | W73 | W73-C77 WeakPolarHBondContact O-CA 3.38Å; W73-C77 VanDerWaalsContact O-CB 3.24Å; W73-C77 WeakPolarHBondContact O-CB 3.45Å; W73-C77 PolarHBondContact O-N 3.2Å |
| 78 | R | 87.1 | Confident | 91.3 | Very high | 156 Ų | 156 | 62.6 Ų | 62.6 | 59% | 0.589 | 30% | 0.299 | S | S | * | . | I | π-helix | trans | -105.4 | -26.5 | -174.5 | -57.6 | -70 | -84.9 | 120.2 | -5.2 | 113.2 | W73 V74 | W73-R78 HydrophobicContact CE3-CG 4.24Å; W73-R78 HydrophobicContact CH2-CG 3.77Å; W73-R78 HydrophobicContact CZ2-CG 4.11Å; W73-R78 HydrophobicContact CZ3-CG 3.83Å; V74-R78 HydrophobicContact CG1-CB 4.34Å; V74-R78 WeakPolarHBondContact O-CA 3.34Å; V74-R78 WeakPolarHBondContact O-CB 3.38Å; V74-R78 PolarHBondContact O-N 3.35Å |
| 79 | M | 86.1 | Confident | 91.1 | Very high | 11 Ų | 11 | 62.6 Ų | 62.6 | 5% | 0.054 | 30% | 0.299 | C | S | . | . | trans | -89.2 | 118.5 | 179.5 | -64.4 | 177.4 | 82 | 0 | 0 | 111.3 | V74 F75 R86 M309 F313 | V74-M79 HydrophobicContact CG1-CG 4.48Å; V74-M79 PolarHBondContact O-N 3.01Å; V74-M79 VanDerWaalsContact O-N 3.14Å; F75-M79 HydrophobicContact CD1-SD 3.78Å; F75-M79 HydrophobicContact CG-SD 4.49Å; M79-R86 VanDerWaalsContact CB-NH1 3.31Å; M79-R86 VanDerWaalsContact O-CZ 3.27Å; M79-R86 PolarHBondContact O-NH1 3.41Å; M79-R86 PolarHBondContact O-NH2 2.81Å; M79-R86 HydrophobicContact SD-CG 4.46Å; M79-M309 HydrophobicContact CE-CE 3.55Å; M79-M309 HydrophobicContact CE-SD 4.39Å; M79-M309 HydrophobicContact SD-CE 3.38Å; M79-M309 WeakPolarHBondContact SD-CE 3.26Å; M79-F313 HydrophobicContact CB-CD2 4.37Å; M79-F313 HydrophobicContact CB-CE2 4.09Å; M79-F313 HydrophobicContact CB-CZ 4.17Å; M79-F313 HydrophobicContact CE-CB 3.67Å; M79-F313 HydrophobicContact CE-CD2 3.69Å; M79-F313 HydrophobicContact CE-CG 3.71Å; M79-F313 HydrophobicContact CG-CD1 3.95Å; M79-F313 HydrophobicContact CG-CD2 4.11Å; M79-F313 HydrophobicContact CG-CE1 4.04Å; M79-F313 HydrophobicContact CG-CE2 4.19Å; M79-F313 HydrophobicContact CG-CG 3.99Å; M79-F313 HydrophobicContact CG-CZ 4.17Å | ||
| 80 | Q | 80.1 | Confident | 91.1 | Very high | 171 Ų | 171 | 60.6 Ų | 60.6 | 80% | 0.799 | 29% | 0.285 | S | S | * | . | trans | -73.4 | -32.1 | -176 | -162.2 | 68.2 | 7.1 | 0 | 0 | 113.5 | ||||
| 81 | R | 85.1 | Confident | 91.2 | Very high | 200 Ų | 200 | 57.4 Ų | 57.4 | 76% | 0.755 | 27% | 0.268 | S | S | * | . | S | Bend | trans | -112.9 | 128.9 | -174.3 | -64 | -176.7 | -175.1 | 161.9 | 2.2 | 111.6 | R86 | R81-R86 PolarHBondContact O-NH1 3.16Š|
| 82 | W | 88.1 | Confident | 91.3 | Very high | 122 Ų | 122 | 57 Ų | 57 | 46% | 0.462 | 27% | 0.265 | S | S | . | . | trans | -79.6 | 121 | 172.4 | -73.7 | 91.6 | 0 | 0 | 0 | 109.8 | R86 I87 P160 | W82-R86 HydrophobicContact CE3-CG 3.95Å; W82-R86 HydrophobicContact CZ3-CG 4.08Å; W82-I87 HydrophobicContact CE3-CG1 3.75Å; W82-I87 HydrophobicContact CZ3-CG1 4.25Å; W82-P160 WeakPolarHBondContact O-CG 3.33Å | ||
| 83 | T | 89.9 | Confident | 91.3 | Very high | 56 Ų | 56 | 55 Ų | 55 | 34% | 0.344 | 25% | 0.254 | S | S | . | . | trans | -110.5 | 162.5 | 173.3 | 62.5 | 0 | 0 | 0 | 0 | 109.5 | T85 R86 I87 | T83-T85 VanDerWaalsContact C-N 3.31Å; T83-T85 PolarHBondContact O-N 2.93Å; T83-R86 PolarHBondContact O-N 2.89Å; T83-R86 WeakPolarHBondContact OG1-CB 3.26Å; T83-R86 PolarHBondContact OG1-N 2.87Å; T83-I87 WeakPolarHBondContact O-CG1 3.38Å; T83-I87 PolarHBondContact O-N 3.4Å; T83-I87 VanDerWaalsContact O-N 3.07Å | ||
| 84 | E | 91.4 | Very high | 91.5 | Very high | 32 Ų | 32 | 51.4 Ų | 51.4 | 15% | 0.15 | 25% | 0.246 | C | C | . | . | H | α-helix | trans | -56.3 | -48.1 | 178.2 | -60.1 | 77.4 | -170.2 | 0 | 0 | 110.7 | R86 I87 Y88 R158 S159 A163 | E84-R86 PolarHBondContact O-N 3.38Å; E84-I87 WeakPolarHBondContact O-CB 3.3Å; E84-I87 PolarHBondContact O-N 3.29Å; E84-I87 VanDerWaalsContact O-N 3.15Å; E84-Y88 HydrophobicContact CB-CE2 4.35Å; E84-Y88 WeakPolarHBondContact O-CD2 3.24Å; E84-Y88 PolarHBondContact O-N 3.43Å; E84-Y88 VanDerWaalsContact O-N 3.11Å; E84-R158 HydrophobicContact CG-CB 4.24Å; E84-S159 WeakPolarHBondContact OE1-CA 3.45Å; E84-S159 PolarHBondContact OE1-N 3.47Å; E84-A163 HydrophobicContact CB-CB 3.89Å; E84-A163 HydrophobicContact CG-CB 4.16Å |
| 85 | T | 88.1 | Confident | 91.7 | Very high | 4 Ų | 4 | 49.7 Ų | 49.7 | 3% | 0.025 | 24% | 0.236 | C | C | . | . | H | α-helix | trans | -61.6 | -42.7 | 178 | -49 | 0 | 0 | 0 | 0 | 112.1 | T83 I87 Y88 M89 R144 M248 M309 | T83-T85 VanDerWaalsContact C-N 3.31Å; T83-T85 PolarHBondContact O-N 2.93Å; T85-I87 VanDerWaalsContact C-N 3.26Å; T85-I87 PolarHBondContact O-N 2.96Å; T85-Y88 PolarHBondContact O-N 3.41Å; T85-M89 HydrophobicContact CG2-CE 4.07Å; T85-M89 HydrophobicContact CG2-CG 4.25Å; T85-M89 VanDerWaalsContact O-CG 3.24Å; T85-M89 WeakPolarHBondContact O-CG 3.32Å; T85-M89 PolarHBondContact O-N 3.29Å; T85-R144 VanDerWaalsContact OG1-CZ 3.24Å; T85-R144 PolarHBondContact OG1-NH1 3.41Å; T85-R144 PolarHBondContact OG1-NH2 2.81Å; T85-M248 HydrophobicContact CG2-CE 3.73Å; T85-M309 HydrophobicContact CG2-CG 4.4Å |
| 86 | R | 91.9 | Very high | 91.9 | Very high | 2 Ų | 2 | 49.6 Ų | 49.6 | 1% | 0.008 | 24% | 0.236 | C | C | . | . | H | α-helix | trans | -59.1 | -40.3 | 176 | 175.9 | 176.6 | 160.8 | -169 | 0.9 | 111.1 | F75 M79 R81 W82 T83 E84 M89 T90 M309 | F75-R86 HydrophobicContact CB-CG 4.4Å; F75-R86 PolarHBondContact O-NE 2.99Å; F75-R86 PolarHBondContact O-NH2 3.24Å; M79-R86 VanDerWaalsContact CB-NH1 3.31Å; M79-R86 VanDerWaalsContact O-CZ 3.27Å; M79-R86 PolarHBondContact O-NH1 3.41Å; M79-R86 PolarHBondContact O-NH2 2.81Å; M79-R86 HydrophobicContact SD-CG 4.46Å; R81-R86 PolarHBondContact O-NH1 3.16Å; W82-R86 HydrophobicContact CE3-CG 3.95Å; W82-R86 HydrophobicContact CZ3-CG 4.08Å; T83-R86 PolarHBondContact O-N 2.89Å; T83-R86 WeakPolarHBondContact OG1-CB 3.26Å; T83-R86 PolarHBondContact OG1-N 2.87Å; E84-R86 PolarHBondContact O-N 3.38Å; R86-M89 PolarHBondContact O-N 2.93Å; R86-T90 WeakPolarHBondContact O-CB 3.47Å; R86-T90 PolarHBondContact O-N 3.49Å; R86-T90 PolarHBondContact O-OG1 2.93Å; R86-M309 HydrophobicContact CB-SD 4.1Å |
| 87 | I | 96 | Very high | 92.3 | Very high | 17 Ų | 17 | 48 Ų | 48 | 9% | 0.087 | 22% | 0.224 | C | C | . | . | H | α-helix | trans | -63.8 | -45.5 | 177.8 | -69 | 172.5 | 0 | 0 | 0 | 111.6 | W82 T83 E84 T85 T90 N91 P160 A163 A164 | W82-I87 HydrophobicContact CE3-CG1 3.75Å; W82-I87 HydrophobicContact CZ3-CG1 4.25Å; T83-I87 WeakPolarHBondContact O-CG1 3.38Å; T83-I87 PolarHBondContact O-N 3.4Å; T83-I87 VanDerWaalsContact O-N 3.07Å; E84-I87 WeakPolarHBondContact O-CB 3.3Å; E84-I87 PolarHBondContact O-N 3.29Å; E84-I87 VanDerWaalsContact O-N 3.15Å; T85-I87 VanDerWaalsContact C-N 3.26Å; T85-I87 PolarHBondContact O-N 2.96Å; I87-T90 PolarHBondContact O-N 3.01Å; I87-N91 PolarHBondContact O-N 3.32Å; I87-N91 PolarHBondContact O-ND2 3.46Å; I87-P160 HydrophobicContact CD1-CB 3.62Å; I87-P160 WeakPolarHBondContact CD1-O 3.4Å; I87-A163 HydrophobicContact CB-CB 4.23Å; I87-A163 HydrophobicContact CD1-CB 4.28Å; I87-A163 HydrophobicContact CG2-CB 4.2Å; I87-A164 HydrophobicContact CD1-CB 4.41Å; I87-A164 HydrophobicContact CG2-CB 4.3Å |
| 88 | Y | 95.3 | Very high | 92.6 | Very high | 17 Ų | 17 | 46.9 Ų | 46.9 | 7% | 0.067 | 22% | 0.216 | C | C | . | . | H | α-helix | trans | -61.8 | -45.4 | 175.8 | -64 | -55.1 | 0 | 0 | 0 | 111.8 | E84 T85 T90 N91 L92 L136 A139 I140 D143 A163 V166 C167 | E84-Y88 HydrophobicContact CB-CE2 4.35Å; E84-Y88 WeakPolarHBondContact O-CD2 3.24Å; E84-Y88 PolarHBondContact O-N 3.43Å; E84-Y88 VanDerWaalsContact O-N 3.11Å; T85-Y88 PolarHBondContact O-N 3.41Å; Y88-T90 PolarHBondContact O-N 2.88Å; Y88-N91 PolarHBondContact O-N 3.23Å; Y88-L92 WeakPolarHBondContact O-CB 3.43Å; Y88-L92 PolarHBondContact O-N 3.39Å; Y88-L136 HydrophobicContact CD1-CD2 4.06Å; Y88-A139 HydrophobicContact CD1-CB 4.11Å; Y88-A139 HydrophobicContact CE1-CB 3.81Å; Y88-I140 HydrophobicContact CD2-CG1 4.05Å; Y88-I140 HydrophobicContact CG-CG1 3.94Å; Y88-D143 HydrophobicContact CE2-CB 4.06Å; Y88-A163 HydrophobicContact CE1-CB 4.29Å; Y88-A163 HydrophobicContact CE2-CB 4.02Å; Y88-V166 HydrophobicContact CE1-CB 4.22Å; Y88-V166 HydrophobicContact CE1-CG1 3.95Å; Y88-C167 WeakPolarHBondContact CD1-SG 3.3Å |
| 89 | M | 93.4 | Very high | 93 | Very high | 0 Ų | 0 | 39.7 Ų | 39.7 | 0% | 0 | 19% | 0.189 | C | C | . | . | H | α-helix | trans | -65.5 | -38.1 | 178.9 | -64.8 | -61 | -177 | 0 | 0 | 112.6 | F75 T85 R86 L92 A93 I140 M248 C305 Y306 M309 | F75-M89 HydrophobicContact CD2-CB 4.39Å; F75-M89 HydrophobicContact CE2-CB 3.72Å; F75-M89 HydrophobicContact CZ-CB 4.28Å; T85-M89 HydrophobicContact CG2-CE 4.07Å; T85-M89 HydrophobicContact CG2-CG 4.25Å; T85-M89 VanDerWaalsContact O-CG 3.24Å; T85-M89 WeakPolarHBondContact O-CG 3.32Å; T85-M89 PolarHBondContact O-N 3.29Å; R86-M89 PolarHBondContact O-N 2.93Å; M89-L92 WeakPolarHBondContact O-CB 3.39Å; M89-L92 PolarHBondContact O-N 3.46Å; M89-L92 HydrophobicContact SD-CD2 4.38Å; M89-A93 PolarHBondContact O-N 3.4Å; M89-I140 HydrophobicContact CE-CD1 3.9Å; M89-I140 HydrophobicContact SD-CD1 3.93Å; M89-M248 HydrophobicContact CE-CE 3.3Å; M89-C305 HydrophobicContact CE-CB 3.64Å; M89-C305 HydrophobicContact SD-CB 3.91Å; M89-Y306 HydrophobicContact CB-CD1 4.22Å; M89-Y306 HydrophobicContact CB-CE1 4.11Å; M89-Y306 HydrophobicContact CG-CD1 4.39Å; M89-Y306 HydrophobicContact SD-CD1 3.95Å; M89-Y306 HydrophobicContact SD-CE1 3.92Å; M89-M309 HydrophobicContact CB-SD 4.22Å; M89-M309 HydrophobicContact CG-SD 3.97Å |
| 90 | T | 95.8 | Very high | 93.5 | Very high | 16 Ų | 16 | 39.2 Ų | 39.2 | 10% | 0.098 | 19% | 0.187 | C | C | . | . | H | α-helix | trans | -62.3 | -43.8 | 173.7 | -67.8 | 0 | 0 | 0 | 0 | 111.2 | L72 R86 I87 Y88 L92 A93 V94 | L72-T90 HydrophobicContact CD1-CG2 3.79Å; R86-T90 WeakPolarHBondContact O-CB 3.47Å; R86-T90 PolarHBondContact O-N 3.49Å; R86-T90 PolarHBondContact O-OG1 2.93Å; I87-T90 PolarHBondContact O-N 3.01Å; Y88-T90 PolarHBondContact O-N 2.88Å; T90-L92 VanDerWaalsContact C-N 3.3Å; T90-L92 PolarHBondContact O-N 3.48Å; T90-A93 PolarHBondContact O-N 2.96Å; T90-V94 VanDerWaalsContact O-CG2 3.29Å; T90-V94 WeakPolarHBondContact O-CG2 3.39Å; T90-V94 PolarHBondContact O-N 3.06Å |
| 91 | N | 97.5 | Very high | 94.2 | Very high | 33 Ų | 33 | 35 Ų | 35 | 18% | 0.176 | 18% | 0.175 | C | C | . | . | H | α-helix | trans | -65.8 | -35.2 | 176.5 | -81.6 | -93.2 | 0 | 0 | 0 | 112.2 | I87 Y88 V94 A95 L136 C167 W171 | I87-N91 PolarHBondContact O-N 3.32Å; I87-N91 PolarHBondContact O-ND2 3.46Å; Y88-N91 PolarHBondContact O-N 3.23Å; N91-V94 PolarHBondContact O-N 3.25Å; N91-A95 PolarHBondContact O-N 3.06Å; N91-L136 HydrophobicContact CB-CD1 3.91Å; N91-L136 HydrophobicContact CB-CD2 4.04Å; N91-C167 PolarHBondContact ND2-SG 3.4Å; N91-C167 VanDerWaalsContact ND2-SG 3.44Å; N91-W171 PolarHBondContact OD1-NE1 2.96Å |
| 92 | L | 95.8 | Very high | 94.5 | Very high | 1 Ų | 1 | 25.6 Ų | 25.6 | 1% | 0.005 | 14% | 0.14 | C | C | . | . | H | α-helix | trans | -64.1 | -50.3 | 175.9 | -170.4 | 60.5 | 0 | 0 | 0 | 110.6 | Y88 M89 T90 V94 A95 D96 S133 L136 D302 Y306 | Y88-L92 WeakPolarHBondContact O-CB 3.43Å; Y88-L92 PolarHBondContact O-N 3.39Å; M89-L92 WeakPolarHBondContact O-CB 3.39Å; M89-L92 PolarHBondContact O-N 3.46Å; M89-L92 HydrophobicContact SD-CD2 4.38Å; T90-L92 VanDerWaalsContact C-N 3.3Å; T90-L92 PolarHBondContact O-N 3.48Å; L92-V94 VanDerWaalsContact C-N 3.29Å; L92-V94 PolarHBondContact O-N 3.2Å; L92-A95 WeakPolarHBondContact O-CB 3.39Å; L92-A95 PolarHBondContact O-N 2.92Å; L92-A95 VanDerWaalsContact O-N 3.09Å; L92-D96 PolarHBondContact O-N 3.05Å; L92-S133 WeakPolarHBondContact CD1-OG 3.34Å; L92-L136 HydrophobicContact CB-CD1 3.96Å; L92-L136 HydrophobicContact CD1-CB 4.31Å; L92-L136 HydrophobicContact CD1-CD1 4.07Å; L92-D302 HydrophobicContact CD2-CB 4.05Å; L92-D302 HydrophobicContact CG-CB 4.45Å; L92-Y306 HydrophobicContact CD2-CE1 4.46Å |
| 93 | A | 96.8 | Very high | 94.6 | Very high | 0 Ų | 0 | 20 Ų | 20 | 0% | 0 | 12% | 0.119 | C | C | . | . | H | α-helix | trans | -59.1 | -38.6 | 176.2 | 0 | 0 | 0 | 0 | 0 | 112.5 | M89 T90 D96 L97 Y306 | M89-A93 PolarHBondContact O-N 3.4Å; T90-A93 PolarHBondContact O-N 2.96Å; A93-D96 PolarHBondContact O-N 3.26Å; A93-L97 WeakPolarHBondContact O-CB 3.3Å; A93-L97 VanDerWaalsContact O-CG 3.25Å; A93-L97 WeakPolarHBondContact O-CG 3.36Å; A93-L97 PolarHBondContact O-N 2.95Å; A93-Y306 VanDerWaalsContact CA-OH 3.29Å; A93-Y306 WeakPolarHBondContact CA-OH 3.27Å; A93-Y306 HydrophobicContact CB-CE2 4.48Å; A93-Y306 WeakPolarHBondContact CB-OH 3.45Å; A93-Y306 PolarHBondContact N-OH 3.22Å |
| 94 | V | 97.5 | Very high | 94.6 | Very high | 56 Ų | 56 | 20.2 Ų | 20.2 | 34% | 0.339 | 12% | 0.121 | S | C | . | . | H | α-helix | trans | -63.9 | -46.7 | 174.5 | 168.7 | 0 | 0 | 0 | 0 | 111.1 | L72 T90 N91 L92 D96 L97 C98 W171 | L72-V94 HydrophobicContact CD1-CG2 4.27Å; T90-V94 VanDerWaalsContact O-CG2 3.29Å; T90-V94 WeakPolarHBondContact O-CG2 3.39Å; T90-V94 PolarHBondContact O-N 3.06Å; N91-V94 PolarHBondContact O-N 3.25Å; L92-V94 VanDerWaalsContact C-N 3.29Å; L92-V94 PolarHBondContact O-N 3.2Å; V94-D96 VanDerWaalsContact C-N 3.29Å; V94-D96 PolarHBondContact O-N 3.02Å; V94-L97 PolarHBondContact O-N 2.75Å; V94-C98 PolarHBondContact O-N 3.14Å; V94-C98 PolarHBondContact O-SG 3.02Å; V94-W171 HydrophobicContact CG1-CZ2 4.38Å |
| 95 | A | 97.3 | Very high | 94.4 | Very high | 2 Ų | 2 | 23 Ų | 23 | 2% | 0.017 | 13% | 0.133 | C | C | . | . | H | α-helix | trans | -61.2 | -38.9 | 177.6 | 0 | 0 | 0 | 0 | 0 | 111.9 | N91 L92 C98 L99 N129 M132 W171 | N91-A95 PolarHBondContact O-N 3.06Å; L92-A95 WeakPolarHBondContact O-CB 3.39Å; L92-A95 PolarHBondContact O-N 2.92Å; L92-A95 VanDerWaalsContact O-N 3.09Å; A95-C98 PolarHBondContact O-N 3.02Å; A95-L99 PolarHBondContact O-N 3.3Å; A95-L99 VanDerWaalsContact O-N 3.14Å; A95-N129 PolarHBondContact O-ND2 3.45Å; A95-M132 HydrophobicContact CB-CB 4.31Å; A95-M132 HydrophobicContact CB-CG 4.05Å; A95-W171 HydrophobicContact CB-CH2 4.05Å; A95-W171 HydrophobicContact CB-CZ2 4.22Å |
| 96 | D | 97.1 | Very high | 94.2 | Very high | 0 Ų | 0 | 22.9 Ų | 22.9 | 0% | 0 | 13% | 0.132 | C | C | . | . | H | α-helix | trans | -68.7 | -43.3 | 177.1 | -71 | -30.5 | 0 | 0 | 0 | 112.4 | L92 A93 V94 C98 L99 L100 N129 C299 | L92-D96 PolarHBondContact O-N 3.05Å; A93-D96 PolarHBondContact O-N 3.26Å; V94-D96 VanDerWaalsContact C-N 3.29Å; V94-D96 PolarHBondContact O-N 3.02Å; D96-C98 VanDerWaalsContact C-N 3.3Å; D96-C98 PolarHBondContact O-N 3.35Å; D96-L99 WeakPolarHBondContact O-CB 3.42Å; D96-L99 PolarHBondContact O-N 3.01Å; D96-L99 VanDerWaalsContact O-N 3.17Å; D96-L100 WeakPolarHBondContact O-CB 3.31Å; D96-L100 WeakPolarHBondContact O-CD1 3.32Å; D96-L100 WeakPolarHBondContact O-CG 3.45Å; D96-L100 PolarHBondContact O-N 3.3Å; D96-N129 WeakPolarHBondContact CA-ND2 3.35Å; D96-N129 PolarHBondContact N-ND2 3.24Å; D96-N129 PolarHBondContact OD1-ND2 3.07Å; D96-C299 HydrophobicContact CB-CB 3.91Å |
| 97 | L | 97.5 | Very high | 93.8 | Very high | 28 Ų | 28 | 24.4 Ų | 24.4 | 15% | 0.147 | 14% | 0.14 | C | C | . | . | H | α-helix | trans | -61 | -39.6 | 173.9 | -72.2 | 171.5 | 0 | 0 | 0 | 111.8 | L65 N68 L72 A93 V94 L99 L100 C101 | L65-L97 HydrophobicContact CD2-CD2 3.92Å; N68-L97 HydrophobicContact CB-CD1 4.44Å; N68-L97 HydrophobicContact CB-CD2 3.74Å; N68-L97 HydrophobicContact CB-CG 3.8Å; L72-L97 HydrophobicContact CD2-CD1 3.82Å; A93-L97 WeakPolarHBondContact O-CB 3.3Å; A93-L97 VanDerWaalsContact O-CG 3.25Å; A93-L97 WeakPolarHBondContact O-CG 3.36Å; A93-L97 PolarHBondContact O-N 2.95Å; V94-L97 PolarHBondContact O-N 2.75Å; L97-L99 PolarHBondContact O-N 3.5Å; L97-L100 HydrophobicContact CD2-CD1 4.37Å; L97-L100 PolarHBondContact O-N 3.38Å; L97-C101 WeakPolarHBondContact O-CB 3.19Å; L97-C101 PolarHBondContact O-N 2.85Å; L97-C101 PolarHBondContact O-SG 3.14Å |
| 98 | C | 96.6 | Very high | 93.1 | Very high | 60 Ų | 60 | 28.8 Ų | 28.8 | 41% | 0.405 | 16% | 0.16 | S | C | . | . | H | α-helix | trans | -59.7 | -44.9 | 173.6 | -69.8 | 0 | 0 | 0 | 0 | 111.9 | V94 A95 D96 A102 I125 | V94-C98 PolarHBondContact O-N 3.14Å; V94-C98 PolarHBondContact O-SG 3.02Å; A95-C98 PolarHBondContact O-N 3.02Å; D96-C98 VanDerWaalsContact C-N 3.3Å; D96-C98 PolarHBondContact O-N 3.35Å; C98-A102 PolarHBondContact O-N 3.12Å; C98-A102 VanDerWaalsContact O-N 3.09Å; C98-I125 HydrophobicContact CB-CG2 4.23Å; C98-I125 WeakPolarHBondContact O-CG2 3.41Å |
| 99 | L | 95.6 | Very high | 92.4 | Very high | 6 Ų | 6 | 28.2 Ų | 28.2 | 3% | 0.031 | 16% | 0.159 | C | C | . | . | H | α-helix | trans | -60.8 | -47.3 | 174.6 | 168.4 | 65.3 | 0 | 0 | 0 | 111.7 | A95 D96 L97 C101 A102 L103 Y126 N129 C299 | A95-L99 PolarHBondContact O-N 3.3Å; A95-L99 VanDerWaalsContact O-N 3.14Å; D96-L99 WeakPolarHBondContact O-CB 3.42Å; D96-L99 PolarHBondContact O-N 3.01Å; D96-L99 VanDerWaalsContact O-N 3.17Å; L97-L99 PolarHBondContact O-N 3.5Å; L99-C101 VanDerWaalsContact C-N 3.32Å; L99-C101 PolarHBondContact O-N 3.38Å; L99-A102 CarbonylContact O-C 3.53Å; L99-A102 WeakPolarHBondContact O-CA 3.37Å; L99-A102 WeakPolarHBondContact O-CB 3.4Å; L99-A102 PolarHBondContact O-N 3.23Å; L99-L103 PolarHBondContact O-N 3.16Å; L99-Y126 HydrophobicContact CD1-CD2 3.57Å; L99-Y126 HydrophobicContact CD1-CE2 4.25Å; L99-Y126 HydrophobicContact CD1-CG 4.35Å; L99-N129 HydrophobicContact CB-CB 3.78Å; L99-N129 HydrophobicContact CD2-CB 4.29Å; L99-N129 WeakPolarHBondContact CD2-OD1 3.48Å; L99-N129 HydrophobicContact CG-CB 4.45Å; L99-C299 HydrophobicContact CD2-CB 4.39Å |
| 100 | L | 96.4 | Very high | 91.4 | Very high | 1 Ų | 1 | 30.8 Ų | 30.8 | 1% | 0.005 | 17% | 0.172 | C | C | . | . | H | α-helix | trans | -62.6 | -40.7 | -177.4 | -69.1 | 161.2 | 0 | 0 | 0 | 111.3 | L60 L61 L65 D96 L97 A102 L103 P104 | L60-L100 VanDerWaalsContact O-CD2 3.31Å; L60-L100 WeakPolarHBondContact O-CD2 3.34Å; L61-L100 HydrophobicContact CD1-CB 4.23Å; L61-L100 HydrophobicContact CD1-CD2 4.44Å; L61-L100 WeakPolarHBondContact CD1-O 3.35Å; L65-L100 HydrophobicContact CD2-CB 3.82Å; L65-L100 HydrophobicContact CD2-CD1 4.32Å; L65-L100 HydrophobicContact CG-CB 4.1Å; L65-L100 HydrophobicContact CG-CD1 4.4Å; D96-L100 WeakPolarHBondContact O-CB 3.31Å; D96-L100 WeakPolarHBondContact O-CD1 3.32Å; D96-L100 WeakPolarHBondContact O-CG 3.45Å; D96-L100 PolarHBondContact O-N 3.3Å; L97-L100 HydrophobicContact CD2-CD1 4.37Å; L97-L100 PolarHBondContact O-N 3.38Å; L100-A102 VanDerWaalsContact C-N 3.28Å; L100-A102 PolarHBondContact O-N 2.92Å; L100-L103 WeakPolarHBondContact O-CB 3.47Å; L100-L103 PolarHBondContact O-N 2.96Å; L100-P104 WeakPolarHBondContact O-CD 3.38Å |
| 101 | C | 94.6 | Very high | 90.3 | Very high | 81 Ų | 81 | 36.6 Ų | 36.6 | 55% | 0.547 | 20% | 0.198 | S | C | . | . | H | α-helix | trans | -64.5 | -31.1 | 171.8 | -70.1 | 0 | 0 | 0 | 0 | 112.9 | L97 L99 P104 | L97-C101 WeakPolarHBondContact O-CB 3.19Å; L97-C101 PolarHBondContact O-N 2.85Å; L97-C101 PolarHBondContact O-SG 3.14Å; L99-C101 VanDerWaalsContact C-N 3.32Å; L99-C101 PolarHBondContact O-N 3.38Å; C101-P104 WeakPolarHBondContact O-CD 3.25Å |
| 102 | A | 92.1 | Very high | 88.9 | Confident | 3 Ų | 3 | 38.9 Ų | 38.9 | 3% | 0.025 | 21% | 0.211 | C | C | . | . | H | α-helix | trans | -77.9 | -22.7 | 176.2 | 0 | 0 | 0 | 0 | 0 | 113.1 | C98 L99 L100 F105 V106 I125 | C98-A102 PolarHBondContact O-N 3.12Å; C98-A102 VanDerWaalsContact O-N 3.09Å; L99-A102 CarbonylContact O-C 3.53Å; L99-A102 WeakPolarHBondContact O-CA 3.37Å; L99-A102 WeakPolarHBondContact O-CB 3.4Å; L99-A102 PolarHBondContact O-N 3.23Å; L100-A102 VanDerWaalsContact C-N 3.28Å; L100-A102 PolarHBondContact O-N 2.92Å; A102-F105 WeakPolarHBondContact O-CB 3.36Å; A102-F105 PolarHBondContact O-N 3.47Å; A102-V106 WeakPolarHBondContact O-CG2 3.13Å; A102-V106 PolarHBondContact O-N 3.33Å; A102-V106 VanDerWaalsContact O-N 3.08Å; A102-I125 HydrophobicContact CB-CB 4.03Å; A102-I125 HydrophobicContact CB-CD1 4.05Å; A102-I125 HydrophobicContact CB-CG2 3.71Å |
| 103 | L | 90.4 | Very high | 87.4 | Confident | 5 Ų | 5 | 42.9 Ų | 42.9 | 3% | 0.026 | 24% | 0.235 | C | C | . | . | H | α-helix | trans | -59.6 | -38.5 | -171 | -158.5 | 67.5 | 0 | 0 | 0 | 114.9 | L57 L61 L99 L100 F105 V106 L107 | L57-L103 HydrophobicContact CB-CD2 4.31Å; L57-L103 HydrophobicContact CD2-CD1 4.28Å; L57-L103 HydrophobicContact CD2-CD2 4.43Å; L57-L103 WeakPolarHBondContact O-CD2 3.21Å; L61-L103 HydrophobicContact CB-CD2 4.14Å; L61-L103 HydrophobicContact CD1-CB 4.48Å; L99-L103 PolarHBondContact O-N 3.16Å; L100-L103 WeakPolarHBondContact O-CB 3.47Å; L100-L103 PolarHBondContact O-N 2.96Å; L103-F105 VanDerWaalsContact C-N 3.26Å; L103-F105 PolarHBondContact O-N 3.34Å; L103-V106 HydrophobicContact CD1-CB 4.46Å; L103-V106 WeakPolarHBondContact O-CB 3.22Å; L103-V106 PolarHBondContact O-N 3.16Å; L103-L107 WeakPolarHBondContact O-CG 3.42Å; L103-L107 PolarHBondContact O-N 2.89Å |
| 104 | P | 89.2 | Confident | 86.2 | Confident | 60 Ų | 60 | 44.8 Ų | 44.8 | 39% | 0.39 | 25% | 0.248 | S | C | . | . | H | α-helix | trans | -58.1 | -37.8 | 172.9 | -25.9 | 35.6 | 0 | 0 | 0 | 113.2 | L61 L100 C101 L107 H108 | L61-P104 HydrophobicContact CD2-CG 4.24Å; L100-P104 WeakPolarHBondContact O-CD 3.38Å; C101-P104 WeakPolarHBondContact O-CD 3.25Å; P104-L107 WeakPolarHBondContact O-CB 3.29Å; P104-L107 PolarHBondContact O-N 3.33Å; P104-H108 PolarHBondContact O-N 3.42Å |
| 105 | F | 87.3 | Confident | 85.1 | Confident | 92 Ų | 92 | 46.9 Ų | 46.9 | 40% | 0.404 | 26% | 0.258 | S | S | . | . | H | α-helix | trans | -71.9 | -38.9 | 177 | -54.2 | -72.1 | 0 | 0 | 0 | 111.3 | A102 L103 L107 H108 S109 L118 | A102-F105 WeakPolarHBondContact O-CB 3.36Å; A102-F105 PolarHBondContact O-N 3.47Å; L103-F105 VanDerWaalsContact C-N 3.26Å; L103-F105 PolarHBondContact O-N 3.34Å; F105-L107 VanDerWaalsContact C-N 3.29Å; F105-L107 PolarHBondContact O-N 2.83Å; F105-H108 PolarHBondContact O-N 2.9Å; F105-S109 WeakPolarHBondContact O-CB 3.27Å; F105-S109 PolarHBondContact O-N 3.44Å; F105-S109 PolarHBondContact O-OG 3.46Å; F105-L118 HydrophobicContact CB-CG 4.41Å; F105-L118 HydrophobicContact CD1-CD1 3.86Å; F105-L118 HydrophobicContact CD1-CD2 3.6Å; F105-L118 HydrophobicContact CD1-CG 3.91Å; F105-L118 HydrophobicContact CE1-CD1 4.14Å; F105-L118 HydrophobicContact CE1-CD2 4.02Å; F105-L118 HydrophobicContact CG-CD1 4.12Å; F105-L118 HydrophobicContact CG-CD2 4.45Å; F105-L118 HydrophobicContact CG-CG 4.31Å |
| 106 | V | 83.8 | Confident | 84.5 | Confident | 0 Ų | 0 | 49.1 Ų | 49.1 | 0% | 0 | 27% | 0.271 | C | S | . | . | H | α-helix | trans | -57.4 | -45.1 | 171 | 179.8 | 0 | 0 | 0 | 0 | 110.6 | A102 L103 H108 S109 L110 F191 | A102-V106 WeakPolarHBondContact O-CG2 3.13Å; A102-V106 PolarHBondContact O-N 3.33Å; A102-V106 VanDerWaalsContact O-N 3.08Å; L103-V106 HydrophobicContact CD1-CB 4.46Å; L103-V106 WeakPolarHBondContact O-CB 3.22Å; L103-V106 PolarHBondContact O-N 3.16Å; V106-H108 VanDerWaalsContact C-N 3.32Å; V106-H108 PolarHBondContact O-N 2.83Å; V106-S109 PolarHBondContact O-N 3.41Å; V106-L110 HydrophobicContact CG1-CD1 4.27Å; V106-L110 HydrophobicContact CG1-CG 4.48Å; V106-L110 VanDerWaalsContact O-CG 3.25Å; V106-L110 WeakPolarHBondContact O-CG 3.37Å; V106-L110 PolarHBondContact O-N 2.95Å; V106-F191 HydrophobicContact CB-CE1 4.44Å; V106-F191 HydrophobicContact CB-CE2 4.46Å; V106-F191 HydrophobicContact CB-CZ 4.15Å; V106-F191 HydrophobicContact CG1-CD1 3.96Å; V106-F191 HydrophobicContact CG1-CD2 4.46Å; V106-F191 HydrophobicContact CG1-CE1 3.74Å; V106-F191 HydrophobicContact CG1-CE2 4.27Å; V106-F191 HydrophobicContact CG1-CG 4.31Å; V106-F191 HydrophobicContact CG1-CZ 3.9Å; V106-F191 HydrophobicContact CG2-CE1 4.02Å; V106-F191 HydrophobicContact CG2-CE2 4.27Å; V106-F191 HydrophobicContact CG2-CZ 3.61Å |
| 107 | L | 83.1 | Confident | 83.9 | Confident | 34 Ų | 34 | 54.3 Ų | 54.3 | 18% | 0.178 | 31% | 0.305 | C | S | . | . | H | α-helix | trans | -61.5 | -40.7 | 178.6 | -74.3 | 177.6 | 0 | 0 | 0 | 112.5 | Y54 L57 L103 P104 F105 L110 | Y54-L107 HydrophobicContact CD1-CD2 3.63Å; Y54-L107 HydrophobicContact CE1-CD2 3.82Å; L57-L107 HydrophobicContact CB-CD2 4Å; L57-L107 HydrophobicContact CD1-CD2 3.36Å; L57-L107 HydrophobicContact CD1-CG 4.44Å; L57-L107 HydrophobicContact CG-CD2 4.32Å; L103-L107 WeakPolarHBondContact O-CG 3.42Å; L103-L107 PolarHBondContact O-N 2.89Å; P104-L107 WeakPolarHBondContact O-CB 3.29Å; P104-L107 PolarHBondContact O-N 3.33Å; F105-L107 VanDerWaalsContact C-N 3.29Å; F105-L107 PolarHBondContact O-N 2.83Å; L107-L110 HydrophobicContact CD2-CD1 4.48Å; L107-L110 PolarHBondContact O-N 3.24Å |
| 108 | H | 82.6 | Confident | 83.3 | Confident | 110 Ų | 110 | 56.7 Ų | 56.7 | 51% | 0.509 | 32% | 0.317 | S | S | . | . | H | α-helix | trans | -65.7 | -47.1 | 175 | -175.2 | 61.3 | 0 | 0 | 0 | 111.7 | P104 F105 V106 L110 Q111 D112 | P104-H108 PolarHBondContact O-N 3.42Å; F105-H108 PolarHBondContact O-N 2.9Å; V106-H108 VanDerWaalsContact C-N 3.32Å; V106-H108 PolarHBondContact O-N 2.83Å; H108-L110 PolarHBondContact O-N 3.04Å; H108-Q111 WeakPolarHBondContact O-CB 3.46Å; H108-Q111 PolarHBondContact O-N 3.41Å; H108-D112 PolarHBondContact O-N 3.08Å; H108-D112 VanDerWaalsContact O-N 3.14Å |
| 109 | S | 79 | Confident | 82.8 | Confident | 4 Ų | 4 | 53.9 Ų | 53.9 | 3% | 0.028 | 30% | 0.298 | C | S | . | . | H | α-helix | trans | -68.2 | -15.8 | 178.6 | -60.5 | 0 | 0 | 0 | 0 | 114.2 | F105 V106 Q111 D112 C119 | F105-S109 WeakPolarHBondContact O-CB 3.27Å; F105-S109 PolarHBondContact O-N 3.44Å; F105-S109 PolarHBondContact O-OG 3.46Å; V106-S109 PolarHBondContact O-N 3.41Å; S109-Q111 VanDerWaalsContact C-N 3.31Å; S109-D112 CarbonylContact C-O 3.49Å; S109-D112 WeakPolarHBondContact CA-O 3.29Å; S109-D112 CarbonylContact O-C 3.51Å; S109-C119 WeakPolarHBondContact OG-CB 3.36Å |
| 110 | L | 73.5 | Confident | 82.4 | Confident | 55 Ų | 55 | 55.9 Ų | 55.9 | 29% | 0.288 | 31% | 0.308 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -75.9 | -19 | 169.6 | -74.1 | 170.5 | 0 | 0 | 0 | 112.9 | V106 L107 H108 F191 | V106-L110 HydrophobicContact CG1-CD1 4.27Å; V106-L110 HydrophobicContact CG1-CG 4.48Å; V106-L110 VanDerWaalsContact O-CG 3.25Å; V106-L110 WeakPolarHBondContact O-CG 3.37Å; V106-L110 PolarHBondContact O-N 2.95Å; L107-L110 HydrophobicContact CD2-CD1 4.48Å; L107-L110 PolarHBondContact O-N 3.24Å; H108-L110 PolarHBondContact O-N 3.04Å; L110-F191 HydrophobicContact CD2-CB 3.68Å; L110-F191 HydrophobicContact CG-CB 4.41Å |
| 111 | Q | 72.4 | Confident | 82.1 | Confident | 138 Ų | 138 | 60.9 Ų | 60.9 | 65% | 0.645 | 33% | 0.334 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -93.2 | -40.4 | 176.6 | -65.4 | 179.7 | -23.2 | 0 | 0 | 111.7 | Y54 H108 S109 | Y54-Q111 WeakPolarHBondContact OH-CG 3.48Å; H108-Q111 WeakPolarHBondContact O-CB 3.46Å; H108-Q111 PolarHBondContact O-N 3.41Å; S109-Q111 VanDerWaalsContact C-N 3.31Å |
| 112 | D | 68.9 | Low | 81.9 | Confident | 81 Ų | 81 | 57.2 Ų | 57.2 | 43% | 0.433 | 31% | 0.309 | S | S | . | . | trans | -118.8 | 109.1 | 175.9 | -176.9 | 19.1 | 0 | 0 | 0 | 109.5 | H108 S109 S114 | H108-D112 PolarHBondContact O-N 3.08Å; H108-D112 VanDerWaalsContact O-N 3.14Å; S109-D112 CarbonylContact C-O 3.49Å; S109-D112 WeakPolarHBondContact CA-O 3.29Å; S109-D112 CarbonylContact O-C 3.51Å; D112-S114 PolarHBondContact O-N 3.49Å; D112-S114 PolarHBondContact OD1-N 3.39Å; D112-S114 PolarHBondContact OD1-OG 3Å; D112-S114 PolarHBondContact OD2-OG 3.39Å | ||
| 113 | T | 63.8 | Low | 81.7 | Confident | 85 Ų | 85 | 57.4 Ų | 57.4 | 52% | 0.521 | 31% | 0.309 | S | S | . | . | trans | -81.9 | 28.6 | -177.3 | 59.4 | 0 | 0 | 0 | 0 | 112.2 | D115 | T113-D115 PolarHBondContact O-N 2.94Š| ||
| 114 | S | 70.6 | Confident | 81.8 | Confident | 40 Ų | 40 | 58.5 Ų | 58.5 | 28% | 0.28 | 32% | 0.322 | S | S | . | . | trans | -67.5 | 127.4 | 177.8 | 51.5 | 0 | 0 | 0 | 0 | 109.7 | D112 T116 | D112-S114 PolarHBondContact O-N 3.49Å; D112-S114 PolarHBondContact OD1-N 3.39Å; D112-S114 PolarHBondContact OD1-OG 3Å; D112-S114 PolarHBondContact OD2-OG 3.39Å; S114-T116 PolarHBondContact O-N 3.18Å | ||
| 115 | D | 75.6 | Confident | 82 | Confident | 100 Ų | 100 | 58 Ų | 58 | 54% | 0.535 | 32% | 0.315 | S | S | . | . | trans | -73.7 | 74.6 | 178 | -173.2 | 14 | 0 | 0 | 0 | 110.1 | T113 Q120 | T113-D115 PolarHBondContact O-N 2.94Å; D115-Q120 WeakPolarHBondContact OD1-CG 3.32Å; D115-Q120 PolarHBondContact OD1-NE2 2.95Å | ||
| 116 | T | 84.1 | Confident | 82.2 | Confident | 49 Ų | 49 | 54.4 Ų | 54.4 | 30% | 0.301 | 30% | 0.299 | S | S | . | . | trans | -98.9 | 151.3 | -178.8 | 61.5 | 0 | 0 | 0 | 0 | 110.8 | S114 L118 C119 Q120 | S114-T116 PolarHBondContact O-N 3.18Å; T116-L118 PolarHBondContact O-N 3.37Å; T116-C119 WeakPolarHBondContact O-CA 3.47Å; T116-C119 VanDerWaalsContact O-CB 3.31Å; T116-C119 WeakPolarHBondContact O-CB 3.37Å; T116-C119 PolarHBondContact O-N 3.39Å; T116-C119 VanDerWaalsContact OG1-CB 3.26Å; T116-C119 WeakPolarHBondContact OG1-CB 3.27Å; T116-C119 PolarHBondContact OG1-N 3.48Å; T116-Q120 WeakPolarHBondContact O-CG 3.36Å; T116-Q120 PolarHBondContact O-N 3.38Å | ||
| 117 | P | 84.5 | Confident | 82.6 | Confident | 109 Ų | 109 | 56.2 Ų | 56.2 | 71% | 0.708 | 31% | 0.309 | S | S | * | . | H | α-helix | trans | -53.1 | -33.1 | 175.5 | -27.7 | 35.1 | 0 | 0 | 0 | 113.7 | Q120 L121 | P117-Q120 PolarHBondContact O-N 2.85Å; P117-L121 VanDerWaalsContact O-CB 3.27Å; P117-L121 WeakPolarHBondContact O-CB 3.22Å; P117-L121 PolarHBondContact O-N 2.95Å |
| 118 | L | 85.9 | Confident | 83.1 | Confident | 78 Ų | 78 | 55.7 Ų | 55.7 | 41% | 0.408 | 31% | 0.307 | S | S | . | . | H | α-helix | trans | -69.9 | -39.2 | 177.3 | -173.6 | 60.8 | 0 | 0 | 0 | 112.5 | F105 T116 S122 | F105-L118 HydrophobicContact CB-CG 4.41Å; F105-L118 HydrophobicContact CD1-CD1 3.86Å; F105-L118 HydrophobicContact CD1-CD2 3.6Å; F105-L118 HydrophobicContact CD1-CG 3.91Å; F105-L118 HydrophobicContact CE1-CD1 4.14Å; F105-L118 HydrophobicContact CE1-CD2 4.02Å; F105-L118 HydrophobicContact CG-CD1 4.12Å; F105-L118 HydrophobicContact CG-CD2 4.45Å; F105-L118 HydrophobicContact CG-CG 4.31Å; T116-L118 PolarHBondContact O-N 3.37Å; L118-S122 WeakPolarHBondContact O-CB 3.28Å; L118-S122 PolarHBondContact O-N 2.72Å; L118-S122 PolarHBondContact O-OG 2.95Å |
| 119 | C | 86.3 | Confident | 83.7 | Confident | 0 Ų | 0 | 50.9 Ų | 50.9 | 0% | 0 | 29% | 0.285 | C | S | . | . | H | α-helix | trans | -64.1 | -43.7 | 172.8 | 174 | 0 | 0 | 0 | 0 | 111.1 | S109 T116 S122 Q123 C192 | S109-C119 WeakPolarHBondContact OG-CB 3.36Å; T116-C119 WeakPolarHBondContact O-CA 3.47Å; T116-C119 VanDerWaalsContact O-CB 3.31Å; T116-C119 WeakPolarHBondContact O-CB 3.37Å; T116-C119 PolarHBondContact O-N 3.39Å; T116-C119 VanDerWaalsContact OG1-CB 3.26Å; T116-C119 WeakPolarHBondContact OG1-CB 3.27Å; T116-C119 PolarHBondContact OG1-N 3.48Å; C119-S122 WeakPolarHBondContact CA-OG 3.37Å; C119-S122 PolarHBondContact O-OG 3.46Å; C119-Q123 WeakPolarHBondContact O-CB 3.23Å; C119-Q123 PolarHBondContact O-N 3.24Å; C119-C192 HydrophobicContact CB-CB 4.21Å; C119-C192 WeakPolarHBondContact CB-SG 3.3Å; C119-C192 WeakPolarHBondContact SG-CA 3.5Å; C119-C192 WeakPolarHBondContact SG-CB 3.34Å; C119-C192 CovalentContact SG-SG 2.03Å; C119-C192 PolarHBondContact SG-SG 2.96Å |
| 120 | Q | 87.4 | Confident | 84.4 | Confident | 49 Ų | 49 | 51.8 Ų | 51.8 | 23% | 0.229 | 29% | 0.288 | C | S | . | . | H | α-helix | trans | -65.2 | -43.7 | 176.5 | -57.4 | -170.3 | 4.4 | 0 | 0 | 111.9 | D115 T116 P117 Q123 G124 C192 F193 | D115-Q120 WeakPolarHBondContact OD1-CG 3.32Å; D115-Q120 PolarHBondContact OD1-NE2 2.95Å; T116-Q120 WeakPolarHBondContact O-CG 3.36Å; T116-Q120 PolarHBondContact O-N 3.38Å; P117-Q120 PolarHBondContact O-N 2.85Å; Q120-Q123 PolarHBondContact O-N 3.5Å; Q120-G124 PolarHBondContact O-N 3.35Å; Q120-C192 PolarHBondContact N-SG 2.9Å; Q120-C192 VanDerWaalsContact N-SG 3.38Å; Q120-F193 HydrophobicContact CB-CE2 4.09Å; Q120-F193 HydrophobicContact CB-CZ 3.89Å; Q120-F193 HydrophobicContact CG-CE1 4.07Å; Q120-F193 HydrophobicContact CG-CE2 3.89Å; Q120-F193 HydrophobicContact CG-CZ 3.32Å |
| 121 | L | 89.1 | Confident | 85.4 | Confident | 106 Ų | 106 | 49.9 Ų | 49.9 | 56% | 0.555 | 28% | 0.277 | S | S | * | . | H | α-helix | trans | -62.8 | -47.3 | 177.7 | 178.5 | 61.6 | 0 | 0 | 0 | 111.6 | P117 Q123 G124 I125 | P117-L121 VanDerWaalsContact O-CB 3.27Å; P117-L121 WeakPolarHBondContact O-CB 3.22Å; P117-L121 PolarHBondContact O-N 2.95Å; L121-Q123 VanDerWaalsContact C-N 3.31Å; L121-Q123 PolarHBondContact O-N 3.26Å; L121-G124 WeakPolarHBondContact O-CA 3.28Å; L121-G124 PolarHBondContact O-N 2.91Å; L121-G124 VanDerWaalsContact O-N 3.11Å; L121-I125 HydrophobicContact CD1-CD1 4.3Å; L121-I125 HydrophobicContact CD1-CG1 4.47Å; L121-I125 HydrophobicContact CG-CD1 4.14Å; L121-I125 WeakPolarHBondContact O-CG1 3.15Å; L121-I125 PolarHBondContact O-N 2.97Å |
| 122 | S | 90.3 | Very high | 86.6 | Confident | 3 Ų | 3 | 43.3 Ų | 43.3 | 2% | 0.021 | 25% | 0.246 | C | C | . | . | H | α-helix | trans | -63.2 | -38 | 177.6 | 59.6 | 0 | 0 | 0 | 0 | 111.7 | L118 C119 I125 Y126 F191 | L118-S122 WeakPolarHBondContact O-CB 3.28Å; L118-S122 PolarHBondContact O-N 2.72Å; L118-S122 PolarHBondContact O-OG 2.95Å; C119-S122 WeakPolarHBondContact CA-OG 3.37Å; C119-S122 PolarHBondContact O-OG 3.46Å; S122-I125 PolarHBondContact O-N 2.81Å; S122-Y126 VanDerWaalsContact O-CB 3.29Å; S122-Y126 WeakPolarHBondContact O-CB 3.5Å; S122-Y126 PolarHBondContact O-N 3.11Å; S122-F191 WeakPolarHBondContact OG-CE2 3.26Å |
| 123 | Q | 88.8 | Confident | 87.9 | Confident | 7 Ų | 7 | 39.4 Ų | 39.4 | 3% | 0.033 | 23% | 0.225 | C | C | . | . | H | α-helix | trans | -64 | -40.6 | 172 | 176 | 163.1 | -26.4 | 0 | 0 | 111.6 | C119 Q120 L121 Y126 L127 G189 F191 C192 | C119-Q123 WeakPolarHBondContact O-CB 3.23Å; C119-Q123 PolarHBondContact O-N 3.24Å; Q120-Q123 PolarHBondContact O-N 3.5Å; L121-Q123 VanDerWaalsContact C-N 3.31Å; L121-Q123 PolarHBondContact O-N 3.26Å; Q123-Y126 WeakPolarHBondContact O-CB 3.4Å; Q123-Y126 PolarHBondContact O-N 3.29Å; Q123-L127 HydrophobicContact CG-CD1 4.16Å; Q123-L127 HydrophobicContact CG-CG 4.49Å; Q123-L127 WeakPolarHBondContact O-CG 3.24Å; Q123-L127 PolarHBondContact O-N 2.92Å; Q123-G189 PolarHBondContact NE2-O 3.44Å; Q123-F191 VanDerWaalsContact CA-CZ 3.44Å; Q123-F191 HydrophobicContact CB-CE1 4.11Å; Q123-F191 HydrophobicContact CB-CE2 4.13Å; Q123-F191 HydrophobicContact CB-CZ 3.69Å; Q123-C192 HydrophobicContact CB-CB 4.14Å |
| 124 | G | 91.3 | Very high | 89.4 | Confident | 28 Ų | 28 | 35.4 Ų | 35.4 | 29% | 0.289 | 20% | 0.201 | S | C | . | . | H | α-helix | trans | -60.5 | -46.7 | 175.1 | 0 | 0 | 0 | 0 | 0 | 112.6 | Q120 L121 Y126 L127 T128 | Q120-G124 PolarHBondContact O-N 3.35Å; L121-G124 WeakPolarHBondContact O-CA 3.28Å; L121-G124 PolarHBondContact O-N 2.91Å; L121-G124 VanDerWaalsContact O-N 3.11Å; G124-Y126 VanDerWaalsContact C-N 3.34Å; G124-L127 PolarHBondContact O-N 3.23Å; G124-T128 VanDerWaalsContact O-CB 3.3Å; G124-T128 WeakPolarHBondContact O-CB 3.47Å; G124-T128 PolarHBondContact O-N 2.99Å; G124-T128 PolarHBondContact O-OG1 3.07Å |
| 125 | I | 93.7 | Very high | 90.6 | Very high | 51 Ų | 51 | 34.8 Ų | 34.8 | 26% | 0.262 | 20% | 0.197 | S | C | . | . | H | α-helix | trans | -62.8 | -43.4 | 176.4 | -66 | 166.5 | 0 | 0 | 0 | 110.5 | C98 A102 L121 S122 L127 T128 N129 | C98-I125 HydrophobicContact CB-CG2 4.23Å; C98-I125 WeakPolarHBondContact O-CG2 3.41Å; A102-I125 HydrophobicContact CB-CB 4.03Å; A102-I125 HydrophobicContact CB-CD1 4.05Å; A102-I125 HydrophobicContact CB-CG2 3.71Å; L121-I125 HydrophobicContact CD1-CD1 4.3Å; L121-I125 HydrophobicContact CD1-CG1 4.47Å; L121-I125 HydrophobicContact CG-CD1 4.14Å; L121-I125 WeakPolarHBondContact O-CG1 3.15Å; L121-I125 PolarHBondContact O-N 2.97Å; S122-I125 PolarHBondContact O-N 2.81Å; I125-L127 PolarHBondContact O-N 3.02Å; I125-T128 PolarHBondContact O-N 3.37Å; I125-N129 PolarHBondContact O-N 3.06Å |
| 126 | Y | 92.1 | Very high | 91.6 | Very high | 15 Ų | 15 | 30 Ų | 30 | 6% | 0.059 | 17% | 0.171 | C | C | . | . | H | α-helix | trans | -58.8 | -47.5 | 178.1 | -176.8 | -89.1 | 0 | 0 | 0 | 112.3 | L99 S122 Q123 G124 R130 F191 S292 D296 | L99-Y126 HydrophobicContact CD1-CD2 3.57Å; L99-Y126 HydrophobicContact CD1-CE2 4.25Å; L99-Y126 HydrophobicContact CD1-CG 4.35Å; S122-Y126 VanDerWaalsContact O-CB 3.29Å; S122-Y126 WeakPolarHBondContact O-CB 3.5Å; S122-Y126 PolarHBondContact O-N 3.11Å; Q123-Y126 WeakPolarHBondContact O-CB 3.4Å; Q123-Y126 PolarHBondContact O-N 3.29Å; G124-Y126 VanDerWaalsContact C-N 3.34Å; Y126-R130 PolarHBondContact O-N 3.2Å; Y126-R130 PolarHBondContact OH-NH2 3.36Å; Y126-F191 HydrophobicContact CG-CE1 4.32Å; Y126-S292 PolarHBondContact OH-O 3.02Å; Y126-S292 PolarHBondContact OH-OG 3.38Å; Y126-D296 WeakPolarHBondContact CE2-OD1 3.32Å; Y126-D296 PolarHBondContact OH-OD1 2.89Å |
| 127 | L | 91.4 | Very high | 92 | Very high | 39 Ų | 39 | 28 Ų | 28 | 20% | 0.204 | 16% | 0.158 | C | C | . | . | H | α-helix | trans | -67.8 | -39 | 176.1 | -68.8 | 174.8 | 0 | 0 | 0 | 112 | Q123 G124 I125 R130 Y131 L178 | Q123-L127 HydrophobicContact CG-CD1 4.16Å; Q123-L127 HydrophobicContact CG-CG 4.49Å; Q123-L127 WeakPolarHBondContact O-CG 3.24Å; Q123-L127 PolarHBondContact O-N 2.92Å; G124-L127 PolarHBondContact O-N 3.23Å; I125-L127 PolarHBondContact O-N 3.02Å; L127-R130 PolarHBondContact O-N 3.03Å; L127-Y131 WeakPolarHBondContact O-CD2 3.29Å; L127-Y131 PolarHBondContact O-N 2.91Å; L127-Y131 VanDerWaalsContact O-N 3.12Å; L127-L178 HydrophobicContact CB-CD1 3.91Å; L127-L178 HydrophobicContact CB-CD2 4.04Å; L127-L178 HydrophobicContact CD1-CD2 4.33Å |
| 128 | T | 94.8 | Very high | 92.5 | Very high | 22 Ų | 22 | 23.6 Ų | 23.6 | 14% | 0.135 | 13% | 0.13 | C | C | . | . | H | α-helix | trans | -59.8 | -49.6 | 177.3 | -60.7 | 0 | 0 | 0 | 0 | 110.5 | G124 I125 R130 Y131 M132 W171 V174 I175 L178 | G124-T128 VanDerWaalsContact O-CB 3.3Å; G124-T128 WeakPolarHBondContact O-CB 3.47Å; G124-T128 PolarHBondContact O-N 2.99Å; G124-T128 PolarHBondContact O-OG1 3.07Å; I125-T128 PolarHBondContact O-N 3.37Å; T128-R130 PolarHBondContact O-N 3.24Å; T128-Y131 PolarHBondContact O-N 3.41Å; T128-M132 WeakPolarHBondContact O-CB 3.48Å; T128-M132 PolarHBondContact O-N 3.15Å; T128-W171 HydrophobicContact CG2-CE3 4.38Å; T128-W171 HydrophobicContact CG2-CZ3 3.78Å; T128-V174 HydrophobicContact CG2-CG1 4.11Å; T128-I175 HydrophobicContact CG2-CG1 3.99Å; T128-L178 WeakPolarHBondContact OG1-CD1 3.44Å |
| 129 | N | 95.3 | Very high | 93 | Very high | 10 Ų | 10 | 20.5 Ų | 20.5 | 5% | 0.053 | 12% | 0.116 | C | C | . | . | H | α-helix | trans | -55.6 | -51.3 | 175.9 | 171.6 | -87.5 | 0 | 0 | 0 | 111 | A95 D96 L99 I125 Y131 M132 S133 | A95-N129 PolarHBondContact O-ND2 3.45Å; D96-N129 WeakPolarHBondContact CA-ND2 3.35Å; D96-N129 PolarHBondContact N-ND2 3.24Å; D96-N129 PolarHBondContact OD1-ND2 3.07Å; L99-N129 HydrophobicContact CB-CB 3.78Å; L99-N129 HydrophobicContact CD2-CB 4.29Å; L99-N129 WeakPolarHBondContact CD2-OD1 3.48Å; L99-N129 HydrophobicContact CG-CB 4.45Å; I125-N129 PolarHBondContact O-N 3.06Å; N129-Y131 PolarHBondContact O-N 3.11Å; N129-M132 PolarHBondContact O-N 3.07Å; N129-S133 WeakPolarHBondContact O-CB 3.39Å; N129-S133 PolarHBondContact O-N 3.16Å; N129-S133 PolarHBondContact O-OG 2.99Å; N129-S133 VanDerWaalsContact O-OG 3.07Å |
| 130 | R | 93.6 | Very high | 93.3 | Very high | 22 Ų | 22 | 20.6 Ų | 20.6 | 8% | 0.083 | 12% | 0.116 | C | C | . | . | H | α-helix | trans | -53.2 | -52.5 | -178.9 | 176.8 | 173.5 | -72.9 | 155.9 | 0.7 | 112.7 | Y126 L127 T128 I134 F260 S292 S295 | Y126-R130 PolarHBondContact O-N 3.2Å; Y126-R130 PolarHBondContact OH-NH2 3.36Å; L127-R130 PolarHBondContact O-N 3.03Å; T128-R130 PolarHBondContact O-N 3.24Å; R130-I134 HydrophobicContact CG-CD1 4.12Å; R130-I134 WeakPolarHBondContact O-CD1 3.37Å; R130-I134 VanDerWaalsContact O-CG1 3.28Å; R130-I134 WeakPolarHBondContact O-CG1 3Å; R130-I134 PolarHBondContact O-N 2.83Å; R130-F260 HydrophobicContact CG-CD1 4.35Å; R130-F260 HydrophobicContact CG-CE1 4.21Å; R130-S292 PolarHBondContact NH2-OG 2.65Å; R130-S295 PolarHBondContact NE-OG 2.83Å; R130-S295 PolarHBondContact NH2-OG 2.62Å |
| 131 | Y | 94.6 | Very high | 93.5 | Very high | 15 Ų | 15 | 18.7 Ų | 18.7 | 6% | 0.059 | 11% | 0.108 | C | C | . | . | H | α-helix | trans | -74.1 | -33.9 | -178.7 | -67.7 | -67.5 | 0 | 0 | 0 | 112.4 | L127 T128 N129 I134 S135 L178 F205 P206 | L127-Y131 WeakPolarHBondContact O-CD2 3.29Å; L127-Y131 PolarHBondContact O-N 2.91Å; L127-Y131 VanDerWaalsContact O-N 3.12Å; T128-Y131 PolarHBondContact O-N 3.41Å; N129-Y131 PolarHBondContact O-N 3.11Å; Y131-I134 HydrophobicContact CD1-CD1 4.49Å; Y131-I134 PolarHBondContact O-N 2.76Å; Y131-S135 WeakPolarHBondContact O-CB 3.2Å; Y131-S135 PolarHBondContact O-N 3.03Å; Y131-S135 PolarHBondContact O-OG 2.88Å; Y131-S135 VanDerWaalsContact O-OG 3.09Å; Y131-L178 HydrophobicContact CD2-CD2 4.21Å; Y131-L178 HydrophobicContact CE2-CD2 4.16Å; Y131-F205 HydrophobicContact CD2-CE1 4.2Å; Y131-F205 HydrophobicContact CE1-CE1 4.17Å; Y131-F205 AromaticContact CE2-CE1 3.76Å; Y131-F205 HydrophobicContact CE2-CE1 3.76Å; Y131-F205 AromaticContact CZ-CE1 3.74Å; Y131-P206 VanDerWaalsContact OH-CA 3.26Å; Y131-P206 WeakPolarHBondContact OH-CA 3.25Å; Y131-P206 WeakPolarHBondContact OH-CB 3.29Å |
| 132 | M | 96.6 | Very high | 93.7 | Very high | 0 Ų | 0 | 16.3 Ų | 16.3 | 0% | 0 | 10% | 0.098 | C | C | . | . | H | α-helix | trans | -63.7 | -44.4 | 176.2 | -167.6 | 65.4 | -170.9 | 0 | 0 | 111.2 | A95 T128 N129 S135 L136 L170 W171 V174 | A95-M132 HydrophobicContact CB-CB 4.31Å; A95-M132 HydrophobicContact CB-CG 4.05Å; T128-M132 WeakPolarHBondContact O-CB 3.48Å; T128-M132 PolarHBondContact O-N 3.15Å; N129-M132 PolarHBondContact O-N 3.07Å; M132-S135 PolarHBondContact O-N 3.41Å; M132-L136 HydrophobicContact CE-CD1 3.74Å; M132-L136 HydrophobicContact CE-CD2 3.86Å; M132-L136 HydrophobicContact CE-CG 3.75Å; M132-L136 HydrophobicContact CG-CD1 3.83Å; M132-L136 HydrophobicContact CG-CG 4.3Å; M132-L136 WeakPolarHBondContact O-CB 3.31Å; M132-L136 VanDerWaalsContact O-CG 3.29Å; M132-L136 WeakPolarHBondContact O-CG 3.17Å; M132-L136 PolarHBondContact O-N 3.25Å; M132-L136 HydrophobicContact SD-CG 4.49Å; M132-L170 HydrophobicContact CE-CB 3.95Å; M132-L170 HydrophobicContact SD-CB 4.12Å; M132-W171 VanDerWaalsContact CE-CD1 3.45Å; M132-W171 HydrophobicContact CE-CD2 3.78Å; M132-W171 HydrophobicContact CE-CG 3.72Å; M132-W171 HydrophobicContact CE-CZ2 4.28Å; M132-W171 VanDerWaalsContact CE-NE1 3.34Å; M132-W171 HydrophobicContact CG-CH2 4.34Å; M132-W171 HydrophobicContact CG-CZ2 4.23Å; M132-W171 HydrophobicContact SD-CD2 3.94Å; M132-W171 HydrophobicContact SD-CE3 4.25Å; M132-W171 HydrophobicContact SD-CG 4.19Å; M132-V174 HydrophobicContact SD-CG2 4.44Å |
| 133 | S | 95.6 | Very high | 93.8 | Very high | 0 Ų | 0 | 16.7 Ų | 16.7 | 0% | 0 | 10% | 0.1 | C | C | . | . | H | α-helix | trans | -62.7 | -45.2 | 176.2 | -58.5 | 0 | 0 | 0 | 0 | 111.5 | L92 N129 S135 L136 V137 N298 | L92-S133 WeakPolarHBondContact CD1-OG 3.34Å; N129-S133 WeakPolarHBondContact O-CB 3.39Å; N129-S133 PolarHBondContact O-N 3.16Å; N129-S133 PolarHBondContact O-OG 2.99Å; N129-S133 VanDerWaalsContact O-OG 3.07Å; S133-S135 PolarHBondContact O-N 2.8Å; S133-L136 PolarHBondContact O-N 3.11Å; S133-V137 WeakPolarHBondContact O-CB 3.41Å; S133-V137 VanDerWaalsContact O-CG2 3.27Å; S133-V137 WeakPolarHBondContact O-CG2 3.28Å; S133-V137 PolarHBondContact O-N 3.22Å; S133-N298 WeakPolarHBondContact CB-ND2 3.4Å |
| 134 | I | 95.6 | Very high | 93.8 | Very high | 0 Ų | 0 | 17.5 Ų | 17.5 | 0% | 0 | 10% | 0.103 | C | C | . | . | H | α-helix | trans | -55.8 | -49.5 | 173.6 | -73 | 167 | 0 | 0 | 0 | 111.1 | R130 Y131 T138 F210 P213 F256 F260 | R130-I134 HydrophobicContact CG-CD1 4.12Å; R130-I134 WeakPolarHBondContact O-CD1 3.37Å; R130-I134 VanDerWaalsContact O-CG1 3.28Å; R130-I134 WeakPolarHBondContact O-CG1 3Å; R130-I134 PolarHBondContact O-N 2.83Å; Y131-I134 HydrophobicContact CD1-CD1 4.49Å; Y131-I134 PolarHBondContact O-N 2.76Å; I134-T138 WeakPolarHBondContact O-CB 3.14Å; I134-T138 PolarHBondContact O-N 2.72Å; I134-T138 VanDerWaalsContact O-N 3.08Å; I134-T138 PolarHBondContact O-OG1 2.91Å; I134-F210 HydrophobicContact CD1-CD2 4.19Å; I134-P213 HydrophobicContact CG2-CB 3.52Å; I134-P213 HydrophobicContact CG2-CG 3.75Å; I134-F256 HydrophobicContact CB-CE2 4.09Å; I134-F256 HydrophobicContact CG1-CE2 3.97Å; I134-F256 HydrophobicContact CG1-CZ 4.47Å; I134-F256 HydrophobicContact CG2-CE2 3.82Å; I134-F256 HydrophobicContact CG2-CZ 4.09Å; I134-F260 HydrophobicContact CD1-CB 4.45Å; I134-F260 HydrophobicContact CD1-CD1 4Å; I134-F260 HydrophobicContact CD1-CE1 4.38Å; I134-F260 HydrophobicContact CD1-CG 4.08Å; I134-F260 HydrophobicContact CG1-CD1 3.99Å; I134-F260 HydrophobicContact CG1-CD2 3.81Å; I134-F260 HydrophobicContact CG1-CE1 4.09Å; I134-F260 HydrophobicContact CG1-CE2 3.93Å; I134-F260 HydrophobicContact CG1-CG 3.85Å; I134-F260 HydrophobicContact CG1-CZ 4.06Å |
| 135 | S | 96.3 | Very high | 93.8 | Very high | 28 Ų | 28 | 18.3 Ų | 18.3 | 20% | 0.196 | 10% | 0.098 | C | C | . | . | H | α-helix | trans | -67 | -40.8 | -178.5 | -67.2 | 0 | 0 | 0 | 0 | 113 | Y131 M132 S133 T138 A139 | Y131-S135 WeakPolarHBondContact O-CB 3.2Å; Y131-S135 PolarHBondContact O-N 3.03Å; Y131-S135 PolarHBondContact O-OG 2.88Å; Y131-S135 VanDerWaalsContact O-OG 3.09Å; M132-S135 PolarHBondContact O-N 3.41Å; S133-S135 PolarHBondContact O-N 2.8Å; S135-T138 WeakPolarHBondContact O-CB 3.25Å; S135-T138 PolarHBondContact O-N 3.38Å; S135-A139 PolarHBondContact O-N 3.47Å |
| 136 | L | 95.8 | Very high | 93.6 | Very high | 0 Ų | 0 | 17.1 Ų | 17.1 | 0% | 0 | 9% | 0.092 | C | C | . | . | H | α-helix | trans | -68.5 | -43.6 | 178.7 | -75.4 | 171.1 | 0 | 0 | 0 | 112 | Y88 N91 L92 M132 S133 T138 A139 I140 L170 | Y88-L136 HydrophobicContact CD1-CD2 4.06Å; N91-L136 HydrophobicContact CB-CD1 3.91Å; N91-L136 HydrophobicContact CB-CD2 4.04Å; L92-L136 HydrophobicContact CB-CD1 3.96Å; L92-L136 HydrophobicContact CD1-CB 4.31Å; L92-L136 HydrophobicContact CD1-CD1 4.07Å; M132-L136 HydrophobicContact CE-CD1 3.74Å; M132-L136 HydrophobicContact CE-CD2 3.86Å; M132-L136 HydrophobicContact CE-CG 3.75Å; M132-L136 HydrophobicContact CG-CD1 3.83Å; M132-L136 HydrophobicContact CG-CG 4.3Å; M132-L136 WeakPolarHBondContact O-CB 3.31Å; M132-L136 VanDerWaalsContact O-CG 3.29Å; M132-L136 WeakPolarHBondContact O-CG 3.17Å; M132-L136 PolarHBondContact O-N 3.25Å; M132-L136 HydrophobicContact SD-CG 4.49Å; S133-L136 PolarHBondContact O-N 3.11Å; L136-T138 PolarHBondContact O-N 3.39Å; L136-A139 PolarHBondContact O-N 3.34Å; L136-A139 VanDerWaalsContact O-N 3.16Å; L136-I140 VanDerWaalsContact O-CG1 3.28Å; L136-I140 WeakPolarHBondContact O-CG1 3.27Å; L136-I140 PolarHBondContact O-N 3.12Å; L136-L170 HydrophobicContact CD2-CD1 4.15Å |
| 137 | V | 93.2 | Very high | 93.4 | Very high | 5 Ų | 5 | 17.7 Ų | 17.7 | 3% | 0.03 | 10% | 0.1 | C | C | . | . | H | α-helix | trans | -59.9 | -39.1 | 174 | 171.6 | 0 | 0 | 0 | 0 | 110.6 | S133 I140 A141 N252 F256 | S133-V137 WeakPolarHBondContact O-CB 3.41Å; S133-V137 VanDerWaalsContact O-CG2 3.27Å; S133-V137 WeakPolarHBondContact O-CG2 3.28Å; S133-V137 PolarHBondContact O-N 3.22Å; V137-I140 PolarHBondContact O-N 2.87Å; V137-A141 PolarHBondContact O-N 2.93Å; V137-N252 HydrophobicContact CG1-CB 4.43Å; V137-F256 HydrophobicContact CB-CD2 4.26Å; V137-F256 HydrophobicContact CG1-CB 4.3Å; V137-F256 HydrophobicContact CG1-CD2 3.89Å; V137-F256 HydrophobicContact CG1-CG 4.49Å |
| 138 | T | 95.4 | Very high | 93.1 | Very high | 17 Ų | 17 | 16.6 Ų | 16.6 | 10% | 0.104 | 10% | 0.095 | C | C | . | . | H | α-helix | trans | -63.5 | -46 | 174.2 | -55.8 | 0 | 0 | 0 | 0 | 111.9 | I134 S135 L136 I140 A141 V142 P213 V216 V217 | I134-T138 WeakPolarHBondContact O-CB 3.14Å; I134-T138 PolarHBondContact O-N 2.72Å; I134-T138 VanDerWaalsContact O-N 3.08Å; I134-T138 PolarHBondContact O-OG1 2.91Å; S135-T138 WeakPolarHBondContact O-CB 3.25Å; S135-T138 PolarHBondContact O-N 3.38Å; L136-T138 PolarHBondContact O-N 3.39Å; T138-I140 VanDerWaalsContact C-N 3.31Å; T138-I140 PolarHBondContact O-N 3.48Å; T138-A141 PolarHBondContact O-N 2.79Å; T138-V142 WeakPolarHBondContact O-CG2 3.26Å; T138-V142 PolarHBondContact O-N 2.99Å; T138-P213 HydrophobicContact CG2-CB 4.5Å; T138-P213 WeakPolarHBondContact OG1-CB 3.22Å; T138-V216 HydrophobicContact CG2-CB 3.94Å; T138-V216 HydrophobicContact CG2-CG1 3.64Å; T138-V217 HydrophobicContact CG2-CG2 4.25Å |
| 139 | A | 95.6 | Very high | 92.8 | Very high | 14 Ų | 14 | 20.2 Ų | 20.2 | 12% | 0.116 | 11% | 0.106 | C | C | . | . | H | α-helix | trans | -60.5 | -40.5 | 176.2 | 0 | 0 | 0 | 0 | 0 | 111.9 | Y88 S135 L136 V142 D143 V166 L170 | Y88-A139 HydrophobicContact CD1-CB 4.11Å; Y88-A139 HydrophobicContact CE1-CB 3.81Å; S135-A139 PolarHBondContact O-N 3.47Å; L136-A139 PolarHBondContact O-N 3.34Å; L136-A139 VanDerWaalsContact O-N 3.16Å; A139-V142 PolarHBondContact O-N 3Å; A139-D143 WeakPolarHBondContact O-CB 3.16Å; A139-D143 PolarHBondContact O-N 3.44Å; A139-V166 HydrophobicContact CB-CG1 4.33Å; A139-L170 HydrophobicContact CB-CD1 4.28Å |
| 140 | I | 92.4 | Very high | 92.3 | Very high | 1 Ų | 1 | 22.6 Ų | 22.6 | 1% | 0.005 | 12% | 0.117 | C | C | . | . | H | α-helix | trans | -62.7 | -43.1 | 174.6 | -66.2 | 162 | 0 | 0 | 0 | 111 | Y88 M89 L136 V137 T138 V142 D143 R144 M248 | Y88-I140 HydrophobicContact CD2-CG1 4.05Å; Y88-I140 HydrophobicContact CG-CG1 3.94Å; M89-I140 HydrophobicContact CE-CD1 3.9Å; M89-I140 HydrophobicContact SD-CD1 3.93Å; L136-I140 VanDerWaalsContact O-CG1 3.28Å; L136-I140 WeakPolarHBondContact O-CG1 3.27Å; L136-I140 PolarHBondContact O-N 3.12Å; V137-I140 PolarHBondContact O-N 2.87Å; T138-I140 VanDerWaalsContact C-N 3.31Å; T138-I140 PolarHBondContact O-N 3.48Å; I140-V142 PolarHBondContact O-N 2.86Å; I140-D143 PolarHBondContact O-N 2.92Å; I140-R144 HydrophobicContact CG2-CG 4.48Å; I140-R144 WeakPolarHBondContact O-CB 3.38Å; I140-R144 VanDerWaalsContact O-CG 3.31Å; I140-R144 WeakPolarHBondContact O-CG 3.36Å; I140-R144 PolarHBondContact O-N 2.88Å; I140-M248 HydrophobicContact CG2-CE 4.43Å |
| 141 | A | 92.3 | Very high | 91.9 | Very high | 9 Ų | 9 | 25.1 Ų | 25.1 | 7% | 0.074 | 14% | 0.136 | C | C | . | . | H | α-helix | trans | -62.8 | -41.9 | 177.3 | 0 | 0 | 0 | 0 | 0 | 111.8 | V137 T138 R144 Y145 V217 C220 | V137-A141 PolarHBondContact O-N 2.93Å; T138-A141 PolarHBondContact O-N 2.79Å; A141-R144 PolarHBondContact O-N 3.4Å; A141-Y145 WeakPolarHBondContact O-CB 3.45Å; A141-Y145 PolarHBondContact O-N 2.82Å; A141-V217 HydrophobicContact CB-CB 4.49Å; A141-V217 HydrophobicContact CB-CG1 4.42Å; A141-V217 HydrophobicContact CB-CG2 4.16Å; A141-C220 HydrophobicContact CB-CB 4.04Å |
| 142 | V | 93.6 | Very high | 91.4 | Very high | 57 Ų | 57 | 32.1 Ų | 32.1 | 35% | 0.345 | 17% | 0.174 | S | C | . | . | H | α-helix | trans | -65.5 | -45.7 | 175.3 | 173.8 | 0 | 0 | 0 | 0 | 111.3 | T138 A139 I140 R144 Y145 V146 V216 | T138-V142 WeakPolarHBondContact O-CG2 3.26Å; T138-V142 PolarHBondContact O-N 2.99Å; A139-V142 PolarHBondContact O-N 3Å; I140-V142 PolarHBondContact O-N 2.86Å; V142-R144 VanDerWaalsContact C-N 3.32Å; V142-R144 PolarHBondContact O-N 3.31Å; V142-Y145 PolarHBondContact O-N 3.48Å; V142-V146 HydrophobicContact CG1-CG2 4.32Å; V142-V146 WeakPolarHBondContact O-CG2 3.28Å; V142-V146 PolarHBondContact O-N 3.34Å; V142-V216 HydrophobicContact CG2-CG1 3.54Å |
| 143 | D | 91.5 | Very high | 90.8 | Very high | 11 Ų | 11 | 40.3 Ų | 40.3 | 6% | 0.059 | 21% | 0.205 | C | C | . | . | H | α-helix | trans | -54.4 | -48.6 | 175.8 | 175.2 | 74.2 | 0 | 0 | 0 | 111.1 | Y88 A139 I140 V146 A147 R158 | Y88-D143 HydrophobicContact CE2-CB 4.06Å; A139-D143 WeakPolarHBondContact O-CB 3.16Å; A139-D143 PolarHBondContact O-N 3.44Å; I140-D143 PolarHBondContact O-N 2.92Å; D143-V146 PolarHBondContact O-N 3.06Å; D143-A147 VanDerWaalsContact O-CB 3.32Å; D143-A147 WeakPolarHBondContact O-CB 3.38Å; D143-A147 PolarHBondContact O-N 2.95Å; D143-R158 VanDerWaalsContact CG-NH2 3.32Å; D143-R158 IonicContact OD1-CZ 2.72Å; D143-R158 IonicContact OD1-NE 2.84Å; D143-R158 PolarHBondContact OD1-NE 2.86Å; D143-R158 IonicContact OD1-NH2 3.77Å; D143-R158 PolarHBondContact OD1-NH2 2.69Å; D143-R158 VanDerWaalsContact OD1-NH2 3.11Å; D143-R158 IonicContact OD2-CZ 2.82Å; D143-R158 IonicContact OD2-NE 3.59Å; D143-R158 IonicContact OD2-NH2 3.28Å; D143-R158 PolarHBondContact OD2-NH2 3.23Å |
| 144 | R | 89 | Confident | 90.2 | Very high | 24 Ų | 24 | 40.8 Ų | 40.8 | 9% | 0.091 | 21% | 0.209 | C | C | . | . | H | α-helix | trans | -64.4 | -42.5 | 177.6 | -71.9 | -70.8 | 178.6 | -100.2 | 13.5 | 112.4 | T85 I140 A141 V142 A147 V148 V249 E312 | T85-R144 VanDerWaalsContact OG1-CZ 3.24Å; T85-R144 PolarHBondContact OG1-NH1 3.41Å; T85-R144 PolarHBondContact OG1-NH2 2.81Å; I140-R144 HydrophobicContact CG2-CG 4.48Å; I140-R144 WeakPolarHBondContact O-CB 3.38Å; I140-R144 VanDerWaalsContact O-CG 3.31Å; I140-R144 WeakPolarHBondContact O-CG 3.36Å; I140-R144 PolarHBondContact O-N 2.88Å; A141-R144 PolarHBondContact O-N 3.4Å; V142-R144 VanDerWaalsContact C-N 3.32Å; V142-R144 PolarHBondContact O-N 3.31Å; R144-A147 PolarHBondContact O-N 2.89Å; R144-V148 WeakPolarHBondContact O-CG2 3.24Å; R144-V148 PolarHBondContact O-N 3.5Å; R144-V249 HydrophobicContact CB-CG2 3.94Å; R144-V249 HydrophobicContact CG-CG2 4.05Å; R144-E312 IonicContact NH2-OE2 2.62Å |
| 145 | Y | 90.9 | Very high | 89.5 | Confident | 45 Ų | 45 | 51.7 Ų | 51.7 | 18% | 0.176 | 25% | 0.25 | C | C | . | . | H | α-helix | trans | -59.2 | -49.3 | 175.5 | 165.6 | -104.5 | 0 | 0 | 0 | 112.2 | A141 V142 A147 V148 R149 H150 F219 C220 K223 | A141-Y145 WeakPolarHBondContact O-CB 3.45Å; A141-Y145 PolarHBondContact O-N 2.82Å; V142-Y145 PolarHBondContact O-N 3.48Å; Y145-A147 VanDerWaalsContact C-N 3.35Å; Y145-A147 PolarHBondContact O-N 2.56Å; Y145-V148 PolarHBondContact O-N 3.41Å; Y145-R149 HydrophobicContact CD2-CB 4.29Å; Y145-R149 HydrophobicContact CD2-CG 3.77Å; Y145-R149 HydrophobicContact CE2-CB 3.99Å; Y145-R149 HydrophobicContact CE2-CG 3.6Å; Y145-R149 WeakPolarHBondContact O-CB 3.29Å; Y145-R149 PolarHBondContact O-N 3.43Å; Y145-H150 AromaticContact CZ-CD2 3.99Å; Y145-H150 AromaticContact CZ-NE2 3.68Å; Y145-H150 PolarHBondContact OH-NE2 2.98Å; Y145-H150 VanDerWaalsContact OH-NE2 3.16Å; Y145-F219 HydrophobicContact CE2-CE1 4.22Å; Y145-C220 HydrophobicContact CG-CB 4.41Å; Y145-K223 HydrophobicContact CD2-CB 3.63Å; Y145-K223 HydrophobicContact CD2-CG 4.44Å; Y145-K223 HydrophobicContact CE2-CB 3.54Å; Y145-K223 HydrophobicContact CE2-CG 3.98Å |
| 146 | V | 90.9 | Very high | 88.8 | Confident | 25 Ų | 25 | 53 Ų | 53 | 15% | 0.152 | 27% | 0.267 | C | S | . | . | H | α-helix | trans | -63.2 | -43.4 | 179.4 | 174.8 | 0 | 0 | 0 | 0 | 110.5 | V142 D143 V148 H150 A154 R158 | V142-V146 HydrophobicContact CG1-CG2 4.32Å; V142-V146 WeakPolarHBondContact O-CG2 3.28Å; V142-V146 PolarHBondContact O-N 3.34Å; D143-V146 PolarHBondContact O-N 3.06Å; V146-V148 PolarHBondContact O-N 2.84Å; V146-H150 CarbonylContact O-C 3.3Å; V146-H150 VanDerWaalsContact O-C 3.3Å; V146-H150 WeakPolarHBondContact O-CA 3.49Å; V146-H150 PolarHBondContact O-N 3.48Å; V146-A154 HydrophobicContact CG1-CB 4.05Å; V146-R158 HydrophobicContact CG1-CG 4.5Å |
| 147 | A | 87.3 | Confident | 88.2 | Confident | 27 Ų | 27 | 58.1 Ų | 58.1 | 22% | 0.223 | 29% | 0.294 | C | S | . | . | H | α-helix | trans | -56.9 | -45.4 | 177.6 | 0 | 0 | 0 | 0 | 0 | 113.1 | D143 R144 Y145 R158 | D143-A147 VanDerWaalsContact O-CB 3.32Å; D143-A147 WeakPolarHBondContact O-CB 3.38Å; D143-A147 PolarHBondContact O-N 2.95Å; R144-A147 PolarHBondContact O-N 2.89Å; Y145-A147 VanDerWaalsContact C-N 3.35Å; Y145-A147 PolarHBondContact O-N 2.56Å; A147-R158 VanDerWaalsContact CB-CZ 3.49Å |
| 148 | V | 85.1 | Confident | 88.1 | Confident | 17 Ų | 17 | 60.9 Ų | 60.9 | 10% | 0.103 | 30% | 0.304 | C | S | . | . | H | α-helix | trans | -82.2 | -47.4 | -173.7 | 173.2 | 0 | 0 | 0 | 0 | 111.7 | R144 Y145 V146 V224 A227 L228 R231 | R144-V148 WeakPolarHBondContact O-CG2 3.24Å; R144-V148 PolarHBondContact O-N 3.5Å; Y145-V148 PolarHBondContact O-N 3.41Å; V146-V148 PolarHBondContact O-N 2.84Å; V148-V224 HydrophobicContact CB-CG2 4.46Å; V148-V224 HydrophobicContact CG2-CG1 4.19Å; V148-A227 HydrophobicContact CG1-CB 4.08Å; V148-L228 HydrophobicContact CG1-CD2 3.8Å; V148-L228 HydrophobicContact CG1-CG 4.07Å; V148-L228 HydrophobicContact CG2-CD2 4.36Å; V148-R231 PolarHBondContact O-NH1 3.12Å; V148-R231 PolarHBondContact O-NH2 3.29Å |
| 149 | R | 87.5 | Confident | 88 | Confident | 97 Ų | 97 | 61.8 Ų | 61.8 | 37% | 0.366 | 31% | 0.311 | S | S | . | . | H | α-helix | trans | -85 | -31.1 | -172.5 | -69.4 | -68.1 | -63.9 | 168.1 | -7 | 113.7 | Y145 P151 A227 | Y145-R149 HydrophobicContact CD2-CB 4.29Å; Y145-R149 HydrophobicContact CD2-CG 3.77Å; Y145-R149 HydrophobicContact CE2-CB 3.99Å; Y145-R149 HydrophobicContact CE2-CG 3.6Å; Y145-R149 WeakPolarHBondContact O-CB 3.29Å; Y145-R149 PolarHBondContact O-N 3.43Å; R149-P151 VanDerWaalsContact C-CD 3.47Å; R149-A227 HydrophobicContact CG-CB 4.31Å |
| 150 | H | 86.5 | Confident | 87.9 | Confident | 61 Ų | 61 | 63.3 Ų | 63.3 | 28% | 0.282 | 32% | 0.32 | S | S | . | . | trans | -130 | 59 | -170.3 | -58.7 | -71.2 | 0 | 0 | 0 | 111.7 | Y145 V146 L152 R153 A154 | Y145-H150 AromaticContact CZ-CD2 3.99Å; Y145-H150 AromaticContact CZ-NE2 3.68Å; Y145-H150 PolarHBondContact OH-NE2 2.98Å; Y145-H150 VanDerWaalsContact OH-NE2 3.16Å; V146-H150 CarbonylContact O-C 3.3Å; V146-H150 VanDerWaalsContact O-C 3.3Å; V146-H150 WeakPolarHBondContact O-CA 3.49Å; V146-H150 PolarHBondContact O-N 3.48Å; H150-L152 VanDerWaalsContact C-N 3.26Å; H150-L152 PolarHBondContact O-N 3.22Å; H150-L152 VanDerWaalsContact O-N 3.16Å; H150-R153 HydrophobicContact CB-CB 4.08Å; H150-R153 HydrophobicContact CB-CG 4.45Å; H150-R153 PolarHBondContact O-N 2.92Å; H150-A154 WeakPolarHBondContact O-CB 3.4Å; H150-A154 PolarHBondContact O-N 3.21Å | ||
| 151 | P | 83.4 | Confident | 88 | Confident | 74 Ų | 74 | 73.7 Ų | 73.7 | 48% | 0.481 | 36% | 0.359 | S | S | . | . | H | α-helix | trans | -58.6 | -33.2 | -172.1 | 23.9 | -34.7 | 0 | 0 | 0 | 113.8 | R149 A154 R155 | R149-P151 VanDerWaalsContact C-CD 3.47Å; P151-A154 WeakPolarHBondContact O-CB 3.32Å; P151-A154 PolarHBondContact O-N 3.41Å; P151-R155 PolarHBondContact O-N 3.24Å |
| 152 | L | 84.5 | Confident | 88.1 | Confident | 162 Ų | 162 | 76.8 Ų | 76.8 | 85% | 0.848 | 37% | 0.372 | S | S | * | . | H | α-helix | trans | -68.4 | -40.9 | 176.1 | -63.9 | 177.2 | 0 | 0 | 0 | 112.3 | H150 | H150-L152 VanDerWaalsContact C-N 3.26Å; H150-L152 PolarHBondContact O-N 3.22Å; H150-L152 VanDerWaalsContact O-N 3.16Å |
| 153 | R | 84.3 | Confident | 88.3 | Confident | 173 Ų | 173 | 74.2 Ų | 74.2 | 65% | 0.653 | 36% | 0.356 | S | S | * | . | H | α-helix | trans | -72.3 | -36.2 | 174.5 | -65.6 | -174.7 | 175.7 | 177.1 | -1.3 | 111.5 | H150 R155 G156 L157 | H150-R153 HydrophobicContact CB-CB 4.08Å; H150-R153 HydrophobicContact CB-CG 4.45Å; H150-R153 PolarHBondContact O-N 2.92Å; R153-R155 PolarHBondContact O-N 3.09Å; R153-G156 PolarHBondContact O-N 3.44Å; R153-L157 HydrophobicContact CB-CD1 4.07Å; R153-L157 WeakPolarHBondContact O-CB 3.35Å; R153-L157 PolarHBondContact O-N 3.3Å |
| 154 | A | 83.6 | Confident | 88.5 | Confident | 9 Ų | 9 | 75.8 Ų | 75.8 | 7% | 0.074 | 37% | 0.371 | C | S | . | . | H | α-helix | trans | -54.4 | -37.6 | 176.4 | 0 | 0 | 0 | 0 | 0 | 111.7 | V146 H150 P151 G156 L157 R158 | V146-A154 HydrophobicContact CG1-CB 4.05Å; H150-A154 WeakPolarHBondContact O-CB 3.4Å; H150-A154 PolarHBondContact O-N 3.21Å; P151-A154 WeakPolarHBondContact O-CB 3.32Å; P151-A154 PolarHBondContact O-N 3.41Å; A154-G156 PolarHBondContact O-N 2.82Å; A154-L157 PolarHBondContact O-N 3.11Å; A154-R158 HydrophobicContact CB-CG 4.36Å; A154-R158 WeakPolarHBondContact O-CB 3.31Å; A154-R158 PolarHBondContact O-N 3.39Å |
| 155 | R | 80.6 | Confident | 88.9 | Confident | 230 Ų | 230 | 77.3 Ų | 77.3 | 87% | 0.868 | 39% | 0.388 | S | S | * | . | H | α-helix | trans | -60.5 | -28.1 | 177.6 | -168.4 | 175.4 | 179.2 | 178.3 | -0.2 | 114.2 | P151 R153 | P151-R155 PolarHBondContact O-N 3.24Å; R153-R155 PolarHBondContact O-N 3.09Å |
| 156 | G | 81.9 | Confident | 89.3 | Confident | 54 Ų | 54 | 77.9 Ų | 77.9 | 56% | 0.557 | 40% | 0.397 | S | S | * | . | H | α-helix | trans | -102.2 | -27.4 | 178.1 | 0 | 0 | 0 | 0 | 0 | 114.6 | R153 A154 Q162 | R153-G156 PolarHBondContact O-N 3.44Å; A154-G156 PolarHBondContact O-N 2.82Å; G156-Q162 PolarHBondContact O-NE2 3.08Å |
| 157 | L | 82.8 | Confident | 89.6 | Confident | 109 Ų | 109 | 76.8 Ų | 76.8 | 57% | 0.571 | 39% | 0.39 | S | S | * | . | H | α-helix | trans | -95.1 | -15.3 | -176.1 | -67.3 | 173.5 | 0 | 0 | 0 | 114 | R153 A154 Q162 | R153-L157 HydrophobicContact CB-CD1 4.07Å; R153-L157 WeakPolarHBondContact O-CB 3.35Å; R153-L157 PolarHBondContact O-N 3.3Å; A154-L157 PolarHBondContact O-N 3.11Å; L157-Q162 PolarHBondContact O-OE1 3.45Å |
| 158 | R | 90.3 | Very high | 90.2 | Very high | 63 Ų | 63 | 78.1 Ų | 78.1 | 24% | 0.238 | 40% | 0.401 | C | S | . | . | trans | -112.1 | 118.2 | -179.2 | -58.7 | 175.8 | 72.2 | -139.3 | 3 | 109.3 | E84 D143 V146 A147 A154 Q162 | E84-R158 HydrophobicContact CG-CB 4.24Å; D143-R158 VanDerWaalsContact CG-NH2 3.32Å; D143-R158 IonicContact OD1-CZ 2.72Å; D143-R158 IonicContact OD1-NE 2.84Å; D143-R158 PolarHBondContact OD1-NE 2.86Å; D143-R158 IonicContact OD1-NH2 3.77Å; D143-R158 PolarHBondContact OD1-NH2 2.69Å; D143-R158 VanDerWaalsContact OD1-NH2 3.11Å; D143-R158 IonicContact OD2-CZ 2.82Å; D143-R158 IonicContact OD2-NE 3.59Å; D143-R158 IonicContact OD2-NH2 3.28Å; D143-R158 PolarHBondContact OD2-NH2 3.23Å; V146-R158 HydrophobicContact CG1-CG 4.5Å; A147-R158 VanDerWaalsContact CB-CZ 3.49Å; A154-R158 HydrophobicContact CB-CG 4.36Å; A154-R158 WeakPolarHBondContact O-CB 3.31Å; A154-R158 PolarHBondContact O-N 3.39Å; R158-Q162 VanDerWaalsContact C-OE1 3.27Å | ||
| 159 | S | 93.6 | Very high | 90.8 | Very high | 35 Ų | 35 | 81.3 Ų | 81.3 | 25% | 0.245 | 42% | 0.42 | C | S | . | . | trans | -154.2 | 155.8 | 167.6 | 62.8 | 0 | 0 | 0 | 0 | 108.6 | E84 R161 Q162 A163 | E84-S159 WeakPolarHBondContact OE1-CA 3.45Å; E84-S159 PolarHBondContact OE1-N 3.47Å; S159-R161 PolarHBondContact O-N 3.27Å; S159-Q162 PolarHBondContact O-N 3.49Å; S159-Q162 WeakPolarHBondContact OG-CB 3.46Å; S159-Q162 VanDerWaalsContact OG-CD 3.28Å; S159-Q162 VanDerWaalsContact OG-CG 3.32Å; S159-Q162 WeakPolarHBondContact OG-CG 3.39Å; S159-Q162 PolarHBondContact OG-N 2.76Å; S159-Q162 PolarHBondContact OG-OE1 2.89Å; S159-A163 PolarHBondContact O-N 3.16Å | ||
| 160 | P | 93.6 | Very high | 91.3 | Very high | 47 Ų | 47 | 78 Ų | 78 | 31% | 0.305 | 41% | 0.41 | S | S | . | . | H | α-helix | trans | -55.2 | -36.1 | 175.7 | -28.5 | 36.5 | 0 | 0 | 0 | 112.9 | W82 I87 A163 A164 | W82-P160 WeakPolarHBondContact O-CG 3.33Å; I87-P160 HydrophobicContact CD1-CB 3.62Å; I87-P160 WeakPolarHBondContact CD1-O 3.4Å; P160-A163 PolarHBondContact O-N 3.41Å; P160-A164 WeakPolarHBondContact O-CB 3.27Å; P160-A164 PolarHBondContact O-N 3.34Å |
| 161 | R | 94.8 | Very high | 91.9 | Very high | 219 Ų | 219 | 77.7 Ų | 77.7 | 83% | 0.826 | 41% | 0.406 | S | S | * | . | H | α-helix | trans | -65.7 | -43.2 | 176.7 | -67.1 | -177.3 | -178.9 | 166.2 | -0.2 | 112.3 | S159 A164 A165 | S159-R161 PolarHBondContact O-N 3.27Å; R161-A164 PolarHBondContact O-N 3.35Å; R161-A165 WeakPolarHBondContact O-CB 3.39Å; R161-A165 PolarHBondContact O-N 3Å |
| 162 | Q | 95.1 | Very high | 92.6 | Very high | 74 Ų | 74 | 79.1 Ų | 79.1 | 35% | 0.346 | 41% | 0.413 | S | S | . | . | H | α-helix | trans | -64.9 | -41.4 | 175.7 | -75.7 | 161 | -39.5 | 0 | 0 | 111.3 | G156 L157 R158 S159 A164 A165 V166 | G156-Q162 PolarHBondContact O-NE2 3.08Å; L157-Q162 PolarHBondContact O-OE1 3.45Å; R158-Q162 VanDerWaalsContact C-OE1 3.27Å; S159-Q162 PolarHBondContact O-N 3.49Å; S159-Q162 WeakPolarHBondContact OG-CB 3.46Å; S159-Q162 VanDerWaalsContact OG-CD 3.28Å; S159-Q162 VanDerWaalsContact OG-CG 3.32Å; S159-Q162 WeakPolarHBondContact OG-CG 3.39Å; S159-Q162 PolarHBondContact OG-N 2.76Å; S159-Q162 PolarHBondContact OG-OE1 2.89Å; Q162-A164 PolarHBondContact O-N 2.72Å; Q162-A165 PolarHBondContact O-N 3.33Å; Q162-V166 WeakPolarHBondContact O-CG2 3.41Å; Q162-V166 PolarHBondContact O-N 2.99Å |
| 163 | A | 96.4 | Very high | 93.1 | Very high | 2 Ų | 2 | 76.5 Ų | 76.5 | 2% | 0.017 | 40% | 0.4 | C | S | . | . | H | α-helix | trans | -61.3 | -43.3 | 175.5 | 0 | 0 | 0 | 0 | 0 | 112 | E84 I87 Y88 S159 P160 A165 V166 C167 | E84-A163 HydrophobicContact CB-CB 3.89Å; E84-A163 HydrophobicContact CG-CB 4.16Å; I87-A163 HydrophobicContact CB-CB 4.23Å; I87-A163 HydrophobicContact CD1-CB 4.28Å; I87-A163 HydrophobicContact CG2-CB 4.2Å; Y88-A163 HydrophobicContact CE1-CB 4.29Å; Y88-A163 HydrophobicContact CE2-CB 4.02Å; S159-A163 PolarHBondContact O-N 3.16Å; P160-A163 PolarHBondContact O-N 3.41Å; A163-A165 PolarHBondContact O-N 2.98Å; A163-V166 PolarHBondContact O-N 3.39Å; A163-C167 PolarHBondContact O-N 3.44Å; A163-C167 PolarHBondContact O-SG 3.35Å; A163-C167 VanDerWaalsContact O-SG 3.41Å |
| 164 | A | 97.3 | Very high | 93.7 | Very high | 44 Ų | 44 | 68.7 Ų | 68.7 | 36% | 0.364 | 37% | 0.371 | S | S | . | . | H | α-helix | trans | -62.5 | -41.8 | 175.2 | 0 | 0 | 0 | 0 | 0 | 112.3 | I87 P160 R161 Q162 C167 A168 | I87-A164 HydrophobicContact CD1-CB 4.41Å; I87-A164 HydrophobicContact CG2-CB 4.3Å; P160-A164 WeakPolarHBondContact O-CB 3.27Å; P160-A164 PolarHBondContact O-N 3.34Å; R161-A164 PolarHBondContact O-N 3.35Å; Q162-A164 PolarHBondContact O-N 2.72Å; A164-C167 PolarHBondContact O-N 3.31Å; A164-A168 PolarHBondContact O-N 2.99Å |
| 165 | A | 97.6 | Very high | 94.2 | Very high | 56 Ų | 56 | 71.9 Ų | 71.9 | 46% | 0.463 | 39% | 0.386 | S | S | . | . | H | α-helix | trans | -62.1 | -42.8 | 175.1 | 0 | 0 | 0 | 0 | 0 | 111.8 | R161 Q162 A163 A168 V169 | R161-A165 WeakPolarHBondContact O-CB 3.39Å; R161-A165 PolarHBondContact O-N 3Å; Q162-A165 PolarHBondContact O-N 3.33Å; A163-A165 PolarHBondContact O-N 2.98Å; A165-A168 PolarHBondContact O-N 3.48Å; A165-V169 WeakPolarHBondContact O-CG2 3.38Å; A165-V169 PolarHBondContact O-N 3.15Å |
| 166 | V | 97.9 | Very high | 94.9 | Very high | 58 Ų | 58 | 62.7 Ų | 62.7 | 35% | 0.352 | 36% | 0.363 | S | S | . | . | H | α-helix | trans | -59.5 | -48.4 | 174 | 171.4 | 0 | 0 | 0 | 0 | 110.6 | Y88 A139 Q162 A163 A168 V169 L170 | Y88-V166 HydrophobicContact CE1-CB 4.22Å; Y88-V166 HydrophobicContact CE1-CG1 3.95Å; A139-V166 HydrophobicContact CB-CG1 4.33Å; Q162-V166 WeakPolarHBondContact O-CG2 3.41Å; Q162-V166 PolarHBondContact O-N 2.99Å; A163-V166 PolarHBondContact O-N 3.39Å; V166-A168 VanDerWaalsContact C-N 3.34Å; V166-A168 PolarHBondContact O-N 2.99Å; V166-V169 PolarHBondContact O-N 3.35Å; V166-L170 HydrophobicContact CG1-CD1 4.16Å; V166-L170 HydrophobicContact CG1-CG 4.35Å; V166-L170 WeakPolarHBondContact O-CG 3.43Å; V166-L170 PolarHBondContact O-N 3.22Å |
| 167 | C | 98.4 | Very high | 95.4 | Very high | 2 Ų | 2 | 61.7 Ų | 61.7 | 1% | 0.014 | 35% | 0.348 | C | S | . | . | H | α-helix | trans | -58 | -44.8 | 176.6 | -70 | 0 | 0 | 0 | 0 | 112.4 | Y88 N91 A163 A164 V169 L170 W171 | Y88-C167 WeakPolarHBondContact CD1-SG 3.3Å; N91-C167 PolarHBondContact ND2-SG 3.4Å; N91-C167 VanDerWaalsContact ND2-SG 3.44Å; A163-C167 PolarHBondContact O-N 3.44Å; A163-C167 PolarHBondContact O-SG 3.35Å; A163-C167 VanDerWaalsContact O-SG 3.41Å; A164-C167 PolarHBondContact O-N 3.31Å; C167-V169 VanDerWaalsContact C-N 3.35Å; C167-V169 PolarHBondContact O-N 3.34Å; C167-L170 PolarHBondContact O-N 3.19Å; C167-W171 PolarHBondContact O-N 2.94Å |
| 168 | A | 98.4 | Very high | 95.8 | Very high | 55 Ų | 55 | 57.5 Ų | 57.5 | 46% | 0.455 | 33% | 0.326 | S | S | . | . | H | α-helix | trans | -61 | -43.9 | 178.2 | 0 | 0 | 0 | 0 | 0 | 111.7 | A164 A165 V166 W171 V172 | A164-A168 PolarHBondContact O-N 2.99Å; A165-A168 PolarHBondContact O-N 3.48Å; V166-A168 VanDerWaalsContact C-N 3.34Å; V166-A168 PolarHBondContact O-N 2.99Å; A168-W171 PolarHBondContact O-N 3.39Å; A168-V172 WeakPolarHBondContact O-CG2 3.41Å; A168-V172 PolarHBondContact O-N 2.76Å |
| 169 | V | 98.4 | Very high | 95.8 | Very high | 83 Ų | 83 | 57.7 Ų | 57.7 | 50% | 0.503 | 33% | 0.334 | S | S | . | . | H | α-helix | trans | -61.2 | -44.4 | 174.6 | 170.1 | 0 | 0 | 0 | 0 | 111 | A165 V166 C167 W171 V172 L173 | A165-V169 WeakPolarHBondContact O-CG2 3.38Å; A165-V169 PolarHBondContact O-N 3.15Å; V166-V169 PolarHBondContact O-N 3.35Å; C167-V169 VanDerWaalsContact C-N 3.35Å; C167-V169 PolarHBondContact O-N 3.34Å; V169-W171 PolarHBondContact O-N 2.88Å; V169-V172 PolarHBondContact O-N 3.23Å; V169-L173 HydrophobicContact CG1-CD1 3.66Å; V169-L173 HydrophobicContact CG1-CG 4.12Å; V169-L173 WeakPolarHBondContact O-CB 3.42Å; V169-L173 VanDerWaalsContact O-CG 3.26Å; V169-L173 WeakPolarHBondContact O-CG 3.44Å; V169-L173 PolarHBondContact O-N 3.41Å |
| 170 | L | 98.1 | Very high | 95.6 | Very high | 29 Ų | 29 | 58.1 Ų | 58.1 | 15% | 0.152 | 34% | 0.34 | C | S | . | . | H | α-helix | trans | -60.5 | -45.1 | 177.5 | -69.7 | 179.6 | 0 | 0 | 0 | 112 | M132 L136 A139 V166 C167 V172 L173 V174 | M132-L170 HydrophobicContact CE-CB 3.95Å; M132-L170 HydrophobicContact SD-CB 4.12Å; L136-L170 HydrophobicContact CD2-CD1 4.15Å; A139-L170 HydrophobicContact CB-CD1 4.28Å; V166-L170 HydrophobicContact CG1-CD1 4.16Å; V166-L170 HydrophobicContact CG1-CG 4.35Å; V166-L170 WeakPolarHBondContact O-CG 3.43Å; V166-L170 PolarHBondContact O-N 3.22Å; C167-L170 PolarHBondContact O-N 3.19Å; L170-V172 PolarHBondContact O-N 3.07Å; L170-L173 PolarHBondContact O-N 3.41Å; L170-V174 WeakPolarHBondContact O-CB 3.21Å; L170-V174 VanDerWaalsContact O-CG2 3.29Å; L170-V174 WeakPolarHBondContact O-CG2 3.36Å; L170-V174 PolarHBondContact O-N 3.17Å |
| 171 | W | 98.2 | Very high | 95.2 | Very high | 54 Ų | 54 | 57.7 Ų | 57.7 | 21% | 0.205 | 33% | 0.332 | C | S | . | . | H | α-helix | trans | -57.7 | -48.5 | 175.3 | -83.7 | 113.3 | 0 | 0 | 0 | 112.1 | N91 V94 A95 T128 M132 C167 A168 V169 L173 I175 | N91-W171 PolarHBondContact OD1-NE1 2.96Å; V94-W171 HydrophobicContact CG1-CZ2 4.38Å; A95-W171 HydrophobicContact CB-CH2 4.05Å; A95-W171 HydrophobicContact CB-CZ2 4.22Å; T128-W171 HydrophobicContact CG2-CE3 4.38Å; T128-W171 HydrophobicContact CG2-CZ3 3.78Å; M132-W171 VanDerWaalsContact CE-CD1 3.45Å; M132-W171 HydrophobicContact CE-CD2 3.78Å; M132-W171 HydrophobicContact CE-CG 3.72Å; M132-W171 HydrophobicContact CE-CZ2 4.28Å; M132-W171 VanDerWaalsContact CE-NE1 3.34Å; M132-W171 HydrophobicContact CG-CH2 4.34Å; M132-W171 HydrophobicContact CG-CZ2 4.23Å; M132-W171 HydrophobicContact SD-CD2 3.94Å; M132-W171 HydrophobicContact SD-CE3 4.25Å; M132-W171 HydrophobicContact SD-CG 4.19Å; C167-W171 PolarHBondContact O-N 2.94Å; A168-W171 PolarHBondContact O-N 3.39Å; V169-W171 PolarHBondContact O-N 2.88Å; W171-L173 PolarHBondContact O-N 2.83Å; W171-I175 HydrophobicContact CE3-CD1 3.69Å; W171-I175 HydrophobicContact CE3-CG1 4.23Å; W171-I175 HydrophobicContact CZ3-CD1 4.19Å; W171-I175 WeakPolarHBondContact O-CB 3.42Å; W171-I175 WeakPolarHBondContact O-CG1 3.37Å; W171-I175 PolarHBondContact O-N 3.4Å |
| 172 | V | 98.1 | Very high | 94.7 | Very high | 104 Ų | 104 | 52.6 Ų | 52.6 | 63% | 0.63 | 31% | 0.313 | S | S | * | . | H | α-helix | trans | -62.1 | -44.8 | 179 | 171 | 0 | 0 | 0 | 0 | 111.1 | A168 V169 L170 G176 | A168-V172 WeakPolarHBondContact O-CG2 3.41Å; A168-V172 PolarHBondContact O-N 2.76Å; V169-V172 PolarHBondContact O-N 3.23Å; L170-V172 PolarHBondContact O-N 3.07Å; V172-G176 VanDerWaalsContact O-CA 3.32Å; V172-G176 WeakPolarHBondContact O-CA 3.36Å; V172-G176 PolarHBondContact O-N 3.11Å |
| 173 | L | 96.2 | Very high | 94.3 | Very high | 106 Ų | 106 | 56.1 Ų | 56.1 | 56% | 0.555 | 33% | 0.327 | S | S | * | . | H | α-helix | trans | -66.7 | -45 | -179.8 | -71 | 176.1 | 0 | 0 | 0 | 112.1 | V169 L170 W171 S177 | V169-L173 HydrophobicContact CG1-CD1 3.66Å; V169-L173 HydrophobicContact CG1-CG 4.12Å; V169-L173 WeakPolarHBondContact O-CB 3.42Å; V169-L173 VanDerWaalsContact O-CG 3.26Å; V169-L173 WeakPolarHBondContact O-CG 3.44Å; V169-L173 PolarHBondContact O-N 3.41Å; L170-L173 PolarHBondContact O-N 3.41Å; W171-L173 PolarHBondContact O-N 2.83Å; L173-S177 WeakPolarHBondContact O-CB 3.37Å; L173-S177 PolarHBondContact O-N 3.26Å; L173-S177 PolarHBondContact O-OG 2.79Å |
| 174 | V | 95.9 | Very high | 93.6 | Very high | 9 Ų | 9 | 62.3 Ų | 62.3 | 6% | 0.055 | 36% | 0.359 | C | S | . | . | H | α-helix | trans | -66.8 | -53.4 | -179.5 | 171.4 | 0 | 0 | 0 | 0 | 110.4 | T128 M132 L170 S177 L178 | T128-V174 HydrophobicContact CG2-CG1 4.11Å; M132-V174 HydrophobicContact SD-CG2 4.44Å; L170-V174 WeakPolarHBondContact O-CB 3.21Å; L170-V174 VanDerWaalsContact O-CG2 3.29Å; L170-V174 WeakPolarHBondContact O-CG2 3.36Å; L170-V174 PolarHBondContact O-N 3.17Å; V174-S177 PolarHBondContact O-N 3.37Å; V174-S177 PolarHBondContact O-OG 2.85Å; V174-L178 HydrophobicContact CG1-CD1 4.16Å; V174-L178 WeakPolarHBondContact O-CG 3.41Å; V174-L178 PolarHBondContact O-N 3.07Å; V174-L178 VanDerWaalsContact O-N 3.13Å |
| 175 | I | 95.7 | Very high | 92.6 | Very high | 76 Ų | 76 | 63 Ų | 63 | 39% | 0.39 | 37% | 0.371 | S | S | . | . | H | α-helix | trans | -63.9 | -48 | -179.9 | -66.3 | 173.7 | 0 | 0 | 0 | 110 | T128 W171 S177 L178 V179 | T128-I175 HydrophobicContact CG2-CG1 3.99Å; W171-I175 HydrophobicContact CE3-CD1 3.69Å; W171-I175 HydrophobicContact CE3-CG1 4.23Å; W171-I175 HydrophobicContact CZ3-CD1 4.19Å; W171-I175 WeakPolarHBondContact O-CB 3.42Å; W171-I175 WeakPolarHBondContact O-CG1 3.37Å; W171-I175 PolarHBondContact O-N 3.4Å; I175-S177 VanDerWaalsContact C-N 3.33Å; I175-S177 PolarHBondContact O-N 3.17Å; I175-L178 PolarHBondContact O-N 2.96Å; I175-V179 HydrophobicContact CG2-CG2 4.06Å; I175-V179 WeakPolarHBondContact O-CB 3.12Å; I175-V179 VanDerWaalsContact O-CG2 3.29Å; I175-V179 WeakPolarHBondContact O-CG2 3.23Å; I175-V179 PolarHBondContact O-N 3.05Å |
| 176 | G | 95 | Very high | 91.5 | Very high | 38 Ų | 38 | 62 Ų | 62 | 39% | 0.392 | 36% | 0.357 | S | S | . | . | H | α-helix | trans | -59.7 | -41.6 | -178.3 | 0 | 0 | 0 | 0 | 0 | 112.7 | V172 A180 | V172-G176 VanDerWaalsContact O-CA 3.32Å; V172-G176 WeakPolarHBondContact O-CA 3.36Å; V172-G176 PolarHBondContact O-N 3.11Å; G176-A180 VanDerWaalsContact O-CB 3.3Å; G176-A180 WeakPolarHBondContact O-CB 3.29Å; G176-A180 PolarHBondContact O-N 3.31Å |
| 177 | S | 91.6 | Very high | 90 | Very high | 33 Ų | 33 | 61.2 Ų | 61.2 | 23% | 0.231 | 35% | 0.349 | C | S | . | . | H | α-helix | trans | -69.1 | -37.4 | 177.2 | 62 | 0 | 0 | 0 | 0 | 113.2 | L173 V174 I175 R181 F205 | L173-S177 WeakPolarHBondContact O-CB 3.37Å; L173-S177 PolarHBondContact O-N 3.26Å; L173-S177 PolarHBondContact O-OG 2.79Å; V174-S177 PolarHBondContact O-N 3.37Å; V174-S177 PolarHBondContact O-OG 2.85Å; I175-S177 VanDerWaalsContact C-N 3.33Å; I175-S177 PolarHBondContact O-N 3.17Å; S177-R181 WeakPolarHBondContact O-CG 3.27Å; S177-R181 PolarHBondContact O-N 3.17Å; S177-F205 VanDerWaalsContact CB-CE2 3.46Å; S177-F205 WeakPolarHBondContact OG-CE2 3.48Å; S177-F205 VanDerWaalsContact OG-CZ 3.24Å; S177-F205 WeakPolarHBondContact OG-CZ 3.44Å |
| 178 | L | 90.3 | Very high | 88.1 | Confident | 20 Ų | 20 | 62.3 Ų | 62.3 | 11% | 0.105 | 35% | 0.354 | C | S | . | . | H | α-helix | trans | -67.9 | -41.9 | 174.7 | -68.6 | 175.2 | 0 | 0 | 0 | 111.9 | L127 T128 Y131 V174 I175 R181 W182 F205 | L127-L178 HydrophobicContact CB-CD1 3.91Å; L127-L178 HydrophobicContact CB-CD2 4.04Å; L127-L178 HydrophobicContact CD1-CD2 4.33Å; T128-L178 WeakPolarHBondContact OG1-CD1 3.44Å; Y131-L178 HydrophobicContact CD2-CD2 4.21Å; Y131-L178 HydrophobicContact CE2-CD2 4.16Å; V174-L178 HydrophobicContact CG1-CD1 4.16Å; V174-L178 WeakPolarHBondContact O-CG 3.41Å; V174-L178 PolarHBondContact O-N 3.07Å; V174-L178 VanDerWaalsContact O-N 3.13Å; I175-L178 PolarHBondContact O-N 2.96Å; L178-R181 WeakPolarHBondContact O-CB 3.43Å; L178-R181 PolarHBondContact O-N 2.85Å; L178-W182 PolarHBondContact O-N 2.9Å; L178-F205 HydrophobicContact CD2-CE1 4.2Å |
| 179 | V | 91 | Very high | 86.3 | Confident | 68 Ų | 68 | 60.8 Ų | 60.8 | 41% | 0.412 | 34% | 0.344 | S | S | . | . | H | α-helix | trans | -62.8 | -45.7 | 174.8 | 169.7 | 0 | 0 | 0 | 0 | 110.7 | I175 R181 W182 F183 | I175-V179 HydrophobicContact CG2-CG2 4.06Å; I175-V179 WeakPolarHBondContact O-CB 3.12Å; I175-V179 VanDerWaalsContact O-CG2 3.29Å; I175-V179 WeakPolarHBondContact O-CG2 3.23Å; I175-V179 PolarHBondContact O-N 3.05Å; V179-R181 VanDerWaalsContact C-N 3.3Å; V179-R181 PolarHBondContact O-N 3.07Å; V179-W182 WeakPolarHBondContact O-CB 3.46Å; V179-W182 PolarHBondContact O-N 3.36Å; V179-W182 VanDerWaalsContact O-N 3.13Å; V179-F183 HydrophobicContact CG1-CD2 3.61Å; V179-F183 HydrophobicContact CG1-CE2 3.46Å; V179-F183 VanDerWaalsContact CG1-CE2 3.46Å; V179-F183 VanDerWaalsContact O-CD2 3.27Å; V179-F183 WeakPolarHBondContact O-CD2 3.49Å; V179-F183 PolarHBondContact O-N 3.47Å |
| 180 | A | 89.7 | Confident | 84.8 | Confident | 44 Ų | 44 | 59.5 Ų | 59.5 | 36% | 0.364 | 35% | 0.347 | S | S | . | . | H | α-helix | trans | -58.6 | -42.4 | 175.5 | 0 | 0 | 0 | 0 | 0 | 111.6 | G176 W182 F183 L184 | G176-A180 VanDerWaalsContact O-CB 3.3Å; G176-A180 WeakPolarHBondContact O-CB 3.29Å; G176-A180 PolarHBondContact O-N 3.31Å; A180-W182 VanDerWaalsContact C-N 3.34Å; A180-W182 PolarHBondContact O-N 3.39Å; A180-F183 PolarHBondContact O-N 3.26Å; A180-L184 WeakPolarHBondContact O-CB 3.34Å; A180-L184 WeakPolarHBondContact O-CG 3.15Å; A180-L184 PolarHBondContact O-N 3.5Å |
| 181 | R | 85.9 | Confident | 83.4 | Confident | 37 Ų | 37 | 59.7 Ų | 59.7 | 14% | 0.14 | 35% | 0.347 | C | S | . | . | H | α-helix | trans | -62.9 | -39.6 | 175.2 | -77.3 | -176.2 | 63.2 | 179.1 | 1.7 | 113.1 | S177 L178 V179 L184 G185 M186 | S177-R181 WeakPolarHBondContact O-CG 3.27Å; S177-R181 PolarHBondContact O-N 3.17Å; L178-R181 WeakPolarHBondContact O-CB 3.43Å; L178-R181 PolarHBondContact O-N 2.85Å; V179-R181 VanDerWaalsContact C-N 3.3Å; V179-R181 PolarHBondContact O-N 3.07Å; R181-L184 PolarHBondContact O-N 3.45Å; R181-G185 PolarHBondContact O-N 2.95Å; R181-M186 HydrophobicContact CB-CB 4.48Å; R181-M186 PolarHBondContact NE-O 3.01Å; R181-M186 PolarHBondContact NH2-O 3.16Å; R181-M186 PolarHBondContact O-N 2.96Å |
| 182 | W | 84.1 | Confident | 82.3 | Confident | 112 Ų | 112 | 57.6 Ų | 57.6 | 42% | 0.424 | 34% | 0.341 | S | S | . | . | H | α-helix | trans | -61.2 | -49.3 | 175.8 | -177.7 | 92.4 | 0 | 0 | 0 | 110.4 | L178 V179 A180 L184 G185 Q187 F193 | L178-W182 PolarHBondContact O-N 2.9Å; V179-W182 WeakPolarHBondContact O-CB 3.46Å; V179-W182 PolarHBondContact O-N 3.36Å; V179-W182 VanDerWaalsContact O-N 3.13Å; A180-W182 VanDerWaalsContact C-N 3.34Å; A180-W182 PolarHBondContact O-N 3.39Å; W182-L184 PolarHBondContact O-N 3Å; W182-G185 PolarHBondContact O-N 3.36Å; W182-Q187 VanDerWaalsContact CD1-CD 3.48Å; W182-F193 AromaticContact NE1-CZ 3.87Å |
| 183 | F | 85.5 | Confident | 80.7 | Confident | 149 Ų | 149 | 53.9 Ų | 53.9 | 65% | 0.654 | 32% | 0.316 | S | S | * | . | H | α-helix | trans | -63 | -38 | 176.4 | -81.6 | -68.1 | 0 | 0 | 0 | 113.9 | V179 A180 G185 | V179-F183 HydrophobicContact CG1-CD2 3.61Å; V179-F183 HydrophobicContact CG1-CE2 3.46Å; V179-F183 VanDerWaalsContact CG1-CE2 3.46Å; V179-F183 VanDerWaalsContact O-CD2 3.27Å; V179-F183 WeakPolarHBondContact O-CD2 3.49Å; V179-F183 PolarHBondContact O-N 3.47Å; A180-F183 PolarHBondContact O-N 3.26Å; F183-G185 PolarHBondContact O-N 3.19Å |
| 184 | L | 83.4 | Confident | 79 | Confident | 131 Ų | 131 | 55.1 Ų | 55.1 | 69% | 0.686 | 31% | 0.313 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -76.9 | -0.1 | 179.3 | -68.2 | 171 | 0 | 0 | 0 | 113.3 | A180 R181 W182 M186 | A180-L184 WeakPolarHBondContact O-CB 3.34Å; A180-L184 WeakPolarHBondContact O-CG 3.15Å; A180-L184 PolarHBondContact O-N 3.5Å; R181-L184 PolarHBondContact O-N 3.45Å; W182-L184 PolarHBondContact O-N 3Å; L184-M186 HydrophobicContact CB-CG 3.84Å; L184-M186 PolarHBondContact O-N 3.45Å |
| 185 | G | 75.6 | Confident | 77 | Confident | 59 Ų | 59 | 56.5 Ų | 56.5 | 61% | 0.608 | 32% | 0.323 | S | S | * | . | T | Hydrogen-bonded Turn | trans | 65.4 | 18.7 | -176.9 | 0 | 0 | 0 | 0 | 0 | 113.7 | R181 W182 F183 Q187 | R181-G185 PolarHBondContact O-N 2.95Å; W182-G185 PolarHBondContact O-N 3.36Å; F183-G185 PolarHBondContact O-N 3.19Å; G185-Q187 PolarHBondContact O-N 2.99Å; G185-Q187 VanDerWaalsContact O-N 3.12Å |
| 186 | M | 73.6 | Confident | 74.7 | Confident | 36 Ų | 36 | 58.7 Ų | 58.7 | 18% | 0.177 | 34% | 0.341 | C | S | . | . | trans | -87.8 | 35.4 | -177.4 | -65.2 | -64.9 | -68.1 | 0 | 0 | 111.7 | R181 L184 E188 S201 S202 | R181-M186 HydrophobicContact CB-CB 4.48Å; R181-M186 PolarHBondContact NE-O 3.01Å; R181-M186 PolarHBondContact NH2-O 3.16Å; R181-M186 PolarHBondContact O-N 2.96Å; L184-M186 HydrophobicContact CB-CG 3.84Å; L184-M186 PolarHBondContact O-N 3.45Å; M186-E188 PolarHBondContact O-N 3.09Å; M186-S201 WeakPolarHBondContact CE-OG 3.32Å; M186-S202 VanDerWaalsContact CE-N 3.3Å; M186-S202 VanDerWaalsContact CE-OG 3.22Å; M186-S202 WeakPolarHBondContact CE-OG 3.43Å | ||
| 187 | Q | 67.7 | Low | 72.5 | Confident | 40 Ų | 40 | 66 Ų | 66 | 19% | 0.187 | 36% | 0.356 | C | S | . | . | trans | -86.6 | 107 | -178.8 | -57.7 | -157.6 | 78.2 | 0 | 0 | 108.1 | W182 G185 F193 S195 | W182-Q187 VanDerWaalsContact CD1-CD 3.48Å; G185-Q187 PolarHBondContact O-N 2.99Å; G185-Q187 VanDerWaalsContact O-N 3.12Å; Q187-F193 HydrophobicContact CB-CB 4.19Å; Q187-F193 HydrophobicContact CB-CD2 4.45Å; Q187-F193 HydrophobicContact CB-CG 4.13Å; Q187-F193 VanDerWaalsContact OE1-CZ 3.28Å; Q187-S195 VanDerWaalsContact O-CB 3.26Å; Q187-S195 WeakPolarHBondContact O-CB 3.5Å; Q187-S195 PolarHBondContact O-OG 3.48Å | ||
| 188 | E | 58 | Low | 70.8 | Confident | 25 Ų | 25 | 68 Ų | 68 | 12% | 0.117 | 36% | 0.362 | C | S | . | . | trans | -114.1 | 112.4 | 175.1 | -80.6 | -150.3 | -140.6 | 0 | 0 | 111.2 | M186 H198 N199 S202 M203 | M186-E188 PolarHBondContact O-N 3.09Å; E188-H198 WeakPolarHBondContact OE1-CA 3.48Å; E188-H198 IonicContact OE2-ND1 3.11Å; E188-H198 PolarHBondContact OE2-ND1 2.95Å; E188-N199 PolarHBondContact OE1-N 2.84Å; E188-S202 VanDerWaalsContact CD-CB 3.49Å; E188-S202 WeakPolarHBondContact OE1-CB 3Å; E188-S202 PolarHBondContact OE1-OG 2.98Å; E188-M203 HydrophobicContact CB-CE 3.66Å; E188-M203 HydrophobicContact CG-CE 4.2Å; E188-M203 WeakPolarHBondContact OE2-CE 3.27Å | ||
| 189 | G | 60.2 | Low | 69.4 | Low | 24 Ų | 24 | 71.1 Ų | 71.1 | 25% | 0.247 | 38% | 0.379 | C | S | . | . | trans | 69.2 | 176.2 | 175.4 | 0 | 0 | 0 | 0 | 0 | 113.9 | Q123 F193 | Q123-G189 PolarHBondContact NE2-O 3.44Å; G189-F193 CarbonylContact C-O 3.31Å; G189-F193 VanDerWaalsContact C-O 3.31Å; G189-F193 WeakPolarHBondContact CA-O 3.5Å | ||
| 190 | G | 66.9 | Low | 68.2 | Low | 55 Ų | 55 | 75.4 Ų | 75.4 | 57% | 0.567 | 39% | 0.392 | S | S | * | . | S | Bend | trans | 128.2 | 177.9 | -169.1 | 0 | 0 | 0 | 0 | 0 | 109.9 | ||
| 191 | F | 69.8 | Low | 67 | Low | 34 Ų | 34 | 77.1 Ų | 77.1 | 15% | 0.149 | 40% | 0.402 | C | S | . | . | S | Bend | trans | -83.4 | -17.8 | 172.5 | 56.7 | -92.8 | 0 | 0 | 0 | 111.8 | V106 L110 S122 Q123 Y126 | V106-F191 HydrophobicContact CB-CE1 4.44Å; V106-F191 HydrophobicContact CB-CE2 4.46Å; V106-F191 HydrophobicContact CB-CZ 4.15Å; V106-F191 HydrophobicContact CG1-CD1 3.96Å; V106-F191 HydrophobicContact CG1-CD2 4.46Å; V106-F191 HydrophobicContact CG1-CE1 3.74Å; V106-F191 HydrophobicContact CG1-CE2 4.27Å; V106-F191 HydrophobicContact CG1-CG 4.31Å; V106-F191 HydrophobicContact CG1-CZ 3.9Å; V106-F191 HydrophobicContact CG2-CE1 4.02Å; V106-F191 HydrophobicContact CG2-CE2 4.27Å; V106-F191 HydrophobicContact CG2-CZ 3.61Å; L110-F191 HydrophobicContact CD2-CB 3.68Å; L110-F191 HydrophobicContact CG-CB 4.41Å; S122-F191 WeakPolarHBondContact OG-CE2 3.26Å; Q123-F191 VanDerWaalsContact CA-CZ 3.44Å; Q123-F191 HydrophobicContact CB-CE1 4.11Å; Q123-F191 HydrophobicContact CB-CE2 4.13Å; Q123-F191 HydrophobicContact CB-CZ 3.69Å; Y126-F191 HydrophobicContact CG-CE1 4.32Å |
| 192 | C | 74.3 | Confident | 66.3 | Low | 10 Ų | 10 | 75.6 Ų | 75.6 | 7% | 0.068 | 40% | 0.396 | C | S | . | . | S | Bend | trans | -97.3 | -53.6 | 177 | -150.5 | 0 | 0 | 0 | 0 | 112.8 | C119 Q120 Q123 R194 | C119-C192 HydrophobicContact CB-CB 4.21Å; C119-C192 WeakPolarHBondContact CB-SG 3.3Å; C119-C192 WeakPolarHBondContact SG-CA 3.5Å; C119-C192 WeakPolarHBondContact SG-CB 3.34Å; C119-C192 CovalentContact SG-SG 2.03Å; C119-C192 PolarHBondContact SG-SG 2.96Å; Q120-C192 PolarHBondContact N-SG 2.9Å; Q120-C192 VanDerWaalsContact N-SG 3.38Å; Q123-C192 HydrophobicContact CB-CB 4.14Å; C192-R194 PolarHBondContact O-N 3.28Å |
| 193 | F | 64.9 | Low | 66 | Low | 26 Ų | 26 | 71 Ų | 71 | 11% | 0.114 | 38% | 0.38 | C | S | . | . | trans | -92.8 | 105.8 | -175.6 | -63.1 | -77.1 | 0 | 0 | 0 | 111.9 | Q120 W182 Q187 G189 S195 | Q120-F193 HydrophobicContact CB-CE2 4.09Å; Q120-F193 HydrophobicContact CB-CZ 3.89Å; Q120-F193 HydrophobicContact CG-CE1 4.07Å; Q120-F193 HydrophobicContact CG-CE2 3.89Å; Q120-F193 HydrophobicContact CG-CZ 3.32Å; W182-F193 AromaticContact NE1-CZ 3.87Å; Q187-F193 HydrophobicContact CB-CB 4.19Å; Q187-F193 HydrophobicContact CB-CD2 4.45Å; Q187-F193 HydrophobicContact CB-CG 4.13Å; Q187-F193 VanDerWaalsContact OE1-CZ 3.28Å; G189-F193 CarbonylContact C-O 3.31Å; G189-F193 VanDerWaalsContact C-O 3.31Å; G189-F193 WeakPolarHBondContact CA-O 3.5Å; F193-S195 PolarHBondContact O-N 3.49Å | ||
| 194 | R | 59 | Low | 65.8 | Low | 131 Ų | 131 | 66.2 Ų | 66.2 | 49% | 0.494 | 37% | 0.368 | S | S | . | . | trans | -87.7 | 79.7 | 174.3 | -153.8 | 164.7 | -168.2 | 150.1 | -2.1 | 110.2 | D42 C192 T196 | D42-R194 IonicContact OD1-CZ 3.28Å; D42-R194 IonicContact OD1-NH1 3.04Å; D42-R194 PolarHBondContact OD1-NH1 2.98Å; D42-R194 IonicContact OD1-NH2 2.8Å; D42-R194 PolarHBondContact OD1-NH2 3.46Å; C192-R194 PolarHBondContact O-N 3.28Å; R194-T196 PolarHBondContact O-N 3.49Å | ||
| 195 | S | 54.4 | Low | 65.9 | Low | 38 Ų | 38 | 62.9 Ų | 62.9 | 27% | 0.266 | 35% | 0.348 | S | S | . | . | trans | -68 | 129.2 | 179.9 | -172.3 | 0 | 0 | 0 | 0 | 111.9 | Q187 F193 R197 | Q187-S195 VanDerWaalsContact O-CB 3.26Å; Q187-S195 WeakPolarHBondContact O-CB 3.5Å; Q187-S195 PolarHBondContact O-OG 3.48Å; F193-S195 PolarHBondContact O-N 3.49Å; S195-R197 PolarHBondContact OG-N 3.35Å; S195-R197 PolarHBondContact OG-O 3.45Å; S195-R197 VanDerWaalsContact OG-O 3.12Å | ||
| 196 | T | 48 | Very low | 66.3 | Low | 123 Ų | 123 | 60.4 Ų | 60.4 | 76% | 0.755 | 32% | 0.321 | S | S | * | . | trans | -98.4 | -3.7 | 173 | 52.6 | 0 | 0 | 0 | 0 | 112.7 | R194 | R194-T196 PolarHBondContact O-N 3.49Š| ||
| 197 | R | 49.4 | Very low | 67 | Low | 191 Ų | 191 | 59.7 Ų | 59.7 | 72% | 0.721 | 32% | 0.318 | S | S | * | . | trans | -117.1 | 119.8 | -178.2 | -59 | -168.1 | -160 | -161.6 | 6.7 | 110.1 | S195 | S195-R197 PolarHBondContact OG-N 3.35Å; S195-R197 PolarHBondContact OG-O 3.45Å; S195-R197 VanDerWaalsContact OG-O 3.12Å | ||
| 198 | H | 56 | Low | 68.1 | Low | 76 Ų | 76 | 63.3 Ų | 63.3 | 35% | 0.352 | 34% | 0.338 | S | S | . | . | trans | -97.3 | 107.5 | 178.5 | -60.8 | -50.3 | 0 | 0 | 0 | 109.5 | E188 R270 W275 | E188-H198 WeakPolarHBondContact OE1-CA 3.48Å; E188-H198 IonicContact OE2-ND1 3.11Å; E188-H198 PolarHBondContact OE2-ND1 2.95Å; H198-R270 PolarHBondContact CE1-NH2 3.22Å; H198-R270 VanDerWaalsContact CE1-NH2 3.31Å; H198-W275 AromaticContact CD2-CE2 3.46Å; H198-W275 VanDerWaalsContact CD2-CE2 3.46Å; H198-W275 AromaticContact CD2-CZ2 3.53Å; H198-W275 AromaticContact CD2-NE1 3.49Å; H198-W275 PolarHBondContact CD2-NE1 3.37Å; H198-W275 AromaticContact CE1-CE2 3.94Å; H198-W275 AromaticContact CE1-CH2 3.62Å; H198-W275 AromaticContact CE1-CZ2 3.18Å; H198-W275 WeakPolarHBondContact CE1-CZ2 3.18Å; H198-W275 AromaticContact CG-CE2 3.94Å; H198-W275 AromaticContact CG-CZ2 3.88Å; H198-W275 AromaticContact CG-NE1 3.71Å; H198-W275 AromaticContact ND1-CZ2 3.65Å; H198-W275 AromaticContact NE2-CE2 3.46Å; H198-W275 AromaticContact NE2-CH2 3.4Å; H198-W275 WeakPolarHBondContact NE2-CH2 3.38Å; H198-W275 AromaticContact NE2-CZ2 3.05Å; H198-W275 WeakPolarHBondContact NE2-CZ2 3.29Å; H198-W275 AromaticContact NE2-NE1 3.99Å | ||
| 199 | N | 60.8 | Low | 69.5 | Low | 84 Ų | 84 | 63.1 Ų | 63.1 | 45% | 0.449 | 34% | 0.343 | S | S | . | . | trans | -111.9 | 128 | 173.1 | -67.7 | -33.2 | 0 | 0 | 0 | 108.6 | E188 S201 S202 | E188-N199 PolarHBondContact OE1-N 2.84Å; N199-S201 PolarHBondContact O-N 3.09Å; N199-S201 VanDerWaalsContact O-N 3.1Å; N199-S202 VanDerWaalsContact O-CB 3.31Å; N199-S202 WeakPolarHBondContact O-CB 3.47Å; N199-S202 PolarHBondContact O-N 3.3Å; N199-S202 PolarHBondContact O-OG 3Å | ||
| 200 | F | 64.7 | Low | 71.1 | Confident | 158 Ų | 158 | 62 Ų | 62 | 69% | 0.693 | 33% | 0.331 | S | S | * | . | H | α-helix | trans | -50.8 | -36.9 | 174.6 | -175.3 | -90.9 | 0 | 0 | 0 | 112 | S202 M203 A204 L271 | F200-S202 VanDerWaalsContact C-N 3.28Å; F200-S202 PolarHBondContact O-N 2.91Å; F200-M203 PolarHBondContact O-N 3.44Å; F200-M203 VanDerWaalsContact O-N 3.16Å; F200-A204 PolarHBondContact O-N 2.92Å; F200-L271 HydrophobicContact CD2-CD1 3.49Å; F200-L271 VanDerWaalsContact CD2-CD1 3.49Å; F200-L271 HydrophobicContact CD2-CD2 4.24Å; F200-L271 HydrophobicContact CD2-CG 4.12Å; F200-L271 HydrophobicContact CE2-CD1 3.85Å; F200-L271 HydrophobicContact CE2-CD2 3.75Å; F200-L271 HydrophobicContact CE2-CG 3.95Å; F200-L271 HydrophobicContact CG-CD1 4.35Å; F200-L271 HydrophobicContact CZ-CD2 4.33Å |
| 201 | S | 65.4 | Low | 72.4 | Confident | 81 Ų | 81 | 63.4 Ų | 63.4 | 57% | 0.566 | 32% | 0.32 | S | S | * | . | H | α-helix | trans | -59.6 | -32.5 | 176.1 | -176.8 | 0 | 0 | 0 | 0 | 113.5 | M186 N199 M203 A204 | M186-S201 WeakPolarHBondContact CE-OG 3.32Å; N199-S201 PolarHBondContact O-N 3.09Å; N199-S201 VanDerWaalsContact O-N 3.1Å; S201-M203 VanDerWaalsContact C-N 3.26Å; S201-M203 PolarHBondContact O-N 3.44Å; S201-A204 PolarHBondContact O-N 2.88Å |
| 202 | S | 71.1 | Confident | 73.7 | Confident | 4 Ų | 4 | 66.7 Ų | 66.7 | 3% | 0.028 | 34% | 0.339 | C | S | . | . | H | α-helix | trans | -69.6 | -24 | 178.7 | -48.2 | 0 | 0 | 0 | 0 | 113.4 | M186 E188 N199 F200 P206 | M186-S202 VanDerWaalsContact CE-N 3.3Å; M186-S202 VanDerWaalsContact CE-OG 3.22Å; M186-S202 WeakPolarHBondContact CE-OG 3.43Å; E188-S202 VanDerWaalsContact CD-CB 3.49Å; E188-S202 WeakPolarHBondContact OE1-CB 3Å; E188-S202 PolarHBondContact OE1-OG 2.98Å; N199-S202 VanDerWaalsContact O-CB 3.31Å; N199-S202 WeakPolarHBondContact O-CB 3.47Å; N199-S202 PolarHBondContact O-N 3.3Å; N199-S202 PolarHBondContact O-OG 3Å; F200-S202 VanDerWaalsContact C-N 3.28Å; F200-S202 PolarHBondContact O-N 2.91Å; S202-P206 VanDerWaalsContact O-CD 3.23Å; S202-P206 WeakPolarHBondContact O-CD 3.45Å |
| 203 | M | 77 | Confident | 74.7 | Confident | 15 Ų | 15 | 66.8 Ų | 66.8 | 7% | 0.074 | 34% | 0.339 | C | S | . | . | H | α-helix | trans | -92.9 | -17.5 | -179.7 | -63.9 | -63.6 | 150.1 | 0 | 0 | 112.4 | E188 F200 S201 F205 P206 L207 L271 | E188-M203 HydrophobicContact CB-CE 3.66Å; E188-M203 HydrophobicContact CG-CE 4.2Å; E188-M203 WeakPolarHBondContact OE2-CE 3.27Å; F200-M203 PolarHBondContact O-N 3.44Å; F200-M203 VanDerWaalsContact O-N 3.16Å; S201-M203 VanDerWaalsContact C-N 3.26Å; S201-M203 PolarHBondContact O-N 3.44Å; M203-F205 PolarHBondContact O-N 2.93Å; M203-P206 VanDerWaalsContact O-CD 3.27Å; M203-P206 WeakPolarHBondContact O-CD 3.46Å; M203-P206 VanDerWaalsContact O-CG 3.28Å; M203-P206 WeakPolarHBondContact O-CG 3.07Å; M203-P206 HydrophobicContact SD-CG 4.44Å; M203-L207 HydrophobicContact CB-CD1 4.37Å; M203-L207 WeakPolarHBondContact O-CB 3.4Å; M203-L207 WeakPolarHBondContact O-CD1 3.18Å; M203-L207 WeakPolarHBondContact O-CG 3.29Å; M203-L207 PolarHBondContact O-N 2.86Å; M203-L271 HydrophobicContact CB-CD1 4.01Å; M203-L271 HydrophobicContact CB-CD2 4.29Å; M203-L271 HydrophobicContact CG-CD1 4.19Å |
| 204 | A | 82.1 | Confident | 76.1 | Confident | 49 Ų | 49 | 66.8 Ų | 66.8 | 41% | 0.405 | 34% | 0.34 | S | S | . | . | H | α-helix | trans | -60.5 | -44.2 | 177.1 | 0 | 0 | 0 | 0 | 0 | 112 | F200 S201 L207 L208 | F200-A204 PolarHBondContact O-N 2.92Å; S201-A204 PolarHBondContact O-N 2.88Å; A204-L207 PolarHBondContact O-N 3.34Å; A204-L208 WeakPolarHBondContact O-CB 3.31Å; A204-L208 PolarHBondContact O-N 2.98Å |
| 205 | F | 84.4 | Confident | 77.9 | Confident | 61 Ų | 61 | 63.5 Ų | 63.5 | 27% | 0.268 | 34% | 0.341 | S | S | . | . | H | α-helix | trans | -59.9 | -56.6 | 179.1 | 180 | -87.6 | 0 | 0 | 0 | 114 | Y131 S177 L178 M203 L207 L208 G209 | Y131-F205 HydrophobicContact CD2-CE1 4.2Å; Y131-F205 HydrophobicContact CE1-CE1 4.17Å; Y131-F205 AromaticContact CE2-CE1 3.76Å; Y131-F205 HydrophobicContact CE2-CE1 3.76Å; Y131-F205 AromaticContact CZ-CE1 3.74Å; S177-F205 VanDerWaalsContact CB-CE2 3.46Å; S177-F205 WeakPolarHBondContact OG-CE2 3.48Å; S177-F205 VanDerWaalsContact OG-CZ 3.24Å; S177-F205 WeakPolarHBondContact OG-CZ 3.44Å; L178-F205 HydrophobicContact CD2-CE1 4.2Å; M203-F205 PolarHBondContact O-N 2.93Å; F205-L207 VanDerWaalsContact C-N 3.27Å; F205-L207 PolarHBondContact O-N 2.87Å; F205-L208 PolarHBondContact O-N 2.67Å; F205-G209 WeakPolarHBondContact O-CA 3.31Å; F205-G209 PolarHBondContact O-N 3.46Å |
| 206 | P | 85.1 | Confident | 79.9 | Confident | 8 Ų | 8 | 63.9 Ų | 63.9 | 5% | 0.052 | 34% | 0.342 | C | S | . | . | H | α-helix | trans | -61.5 | -36.2 | -179.7 | 21.3 | -32.1 | 0 | 0 | 0 | 112.5 | Y131 S202 M203 F210 H264 L267 | Y131-P206 VanDerWaalsContact OH-CA 3.26Å; Y131-P206 WeakPolarHBondContact OH-CA 3.25Å; Y131-P206 WeakPolarHBondContact OH-CB 3.29Å; S202-P206 VanDerWaalsContact O-CD 3.23Å; S202-P206 WeakPolarHBondContact O-CD 3.45Å; M203-P206 VanDerWaalsContact O-CD 3.27Å; M203-P206 WeakPolarHBondContact O-CD 3.46Å; M203-P206 VanDerWaalsContact O-CG 3.28Å; M203-P206 WeakPolarHBondContact O-CG 3.07Å; M203-P206 HydrophobicContact SD-CG 4.44Å; P206-F210 WeakPolarHBondContact O-CB 3.07Å; P206-F210 PolarHBondContact O-N 3.03Å; P206-H264 PolarHBondContact O-CD2 3.05Å; P206-L267 HydrophobicContact CB-CD1 4.28Å |
| 207 | L | 88.6 | Confident | 82.1 | Confident | 21 Ų | 21 | 58.1 Ų | 58.1 | 11% | 0.11 | 31% | 0.306 | C | S | . | . | H | α-helix | trans | -73.4 | -46.9 | -179.3 | -61.4 | 177.4 | 0 | 0 | 0 | 111.6 | M203 A204 F205 G209 F210 Y211 L267 T268 L271 | M203-L207 HydrophobicContact CB-CD1 4.37Å; M203-L207 WeakPolarHBondContact O-CB 3.4Å; M203-L207 WeakPolarHBondContact O-CD1 3.18Å; M203-L207 WeakPolarHBondContact O-CG 3.29Å; M203-L207 PolarHBondContact O-N 2.86Å; A204-L207 PolarHBondContact O-N 3.34Å; F205-L207 VanDerWaalsContact C-N 3.27Å; F205-L207 PolarHBondContact O-N 2.87Å; L207-G209 VanDerWaalsContact C-N 3.34Å; L207-F210 PolarHBondContact O-N 3.24Å; L207-Y211 HydrophobicContact CB-CD2 4.19Å; L207-Y211 HydrophobicContact CB-CE2 4.4Å; L207-Y211 HydrophobicContact CD2-CE2 3.97Å; L207-Y211 VanDerWaalsContact O-CD2 3.28Å; L207-Y211 WeakPolarHBondContact O-CD2 3.41Å; L207-Y211 PolarHBondContact O-N 2.88Å; L207-L267 HydrophobicContact CD2-CB 4.03Å; L207-T268 WeakPolarHBondContact CD2-OG1 3.21Å; L207-L271 HydrophobicContact CD1-CD2 3.57Å |
| 208 | L | 89.5 | Confident | 84.2 | Confident | 115 Ų | 115 | 51.6 Ų | 51.6 | 60% | 0.602 | 29% | 0.288 | S | S | * | . | H | α-helix | trans | -65.1 | -41.7 | 176.7 | -175.6 | 63.7 | 0 | 0 | 0 | 111.2 | A204 F205 F210 L212 | A204-L208 WeakPolarHBondContact O-CB 3.31Å; A204-L208 PolarHBondContact O-N 2.98Å; F205-L208 PolarHBondContact O-N 2.67Å; L208-F210 PolarHBondContact O-N 3.38Å; L208-F210 VanDerWaalsContact O-N 3.08Å; L208-L212 HydrophobicContact CD1-CB 4.23Å; L208-L212 HydrophobicContact CD1-CD1 4.28Å; L208-L212 WeakPolarHBondContact O-CB 3.28Å; L208-L212 PolarHBondContact O-N 3.4Å |
| 209 | G | 88.8 | Confident | 86.1 | Confident | 22 Ų | 22 | 52.6 Ų | 52.6 | 23% | 0.227 | 29% | 0.291 | C | S | . | . | H | α-helix | trans | -63.8 | -7.3 | 175.6 | 0 | 0 | 0 | 0 | 0 | 114.5 | F205 L207 P213 | F205-G209 WeakPolarHBondContact O-CA 3.31Å; F205-G209 PolarHBondContact O-N 3.46Å; L207-G209 VanDerWaalsContact C-N 3.34Å; G209-P213 WeakPolarHBondContact O-CG 3.47Å |
| 210 | F | 93.2 | Very high | 87.6 | Confident | 0 Ų | 0 | 48.9 Ų | 48.9 | 0% | 0 | 27% | 0.271 | C | S | . | . | H | α-helix | trans | -116.9 | -50.6 | 174.6 | 172.2 | -101.1 | 0 | 0 | 0 | 113.6 | I134 P206 L207 L208 L212 P213 L214 F256 F260 L261 H264 | I134-F210 HydrophobicContact CD1-CD2 4.19Å; P206-F210 WeakPolarHBondContact O-CB 3.07Å; P206-F210 PolarHBondContact O-N 3.03Å; L207-F210 PolarHBondContact O-N 3.24Å; L208-F210 PolarHBondContact O-N 3.38Å; L208-F210 VanDerWaalsContact O-N 3.08Å; F210-L212 PolarHBondContact O-N 3.4Å; F210-P213 WeakPolarHBondContact O-CD 3.42Å; F210-L214 HydrophobicContact CE1-CB 4.39Å; F210-L214 HydrophobicContact CE1-CD2 3.88Å; F210-L214 HydrophobicContact CZ-CB 4.3Å; F210-L214 HydrophobicContact CZ-CD1 4.4Å; F210-L214 HydrophobicContact CZ-CD2 4.03Å; F210-L214 HydrophobicContact CZ-CG 4.48Å; F210-L214 WeakPolarHBondContact O-CB 3.45Å; F210-L214 PolarHBondContact O-N 2.8Å; F210-F256 HydrophobicContact CD2-CE1 4.23Å; F210-F256 HydrophobicContact CD2-CZ 4.03Å; F210-F256 HydrophobicContact CE2-CD1 4.39Å; F210-F256 AromaticContact CE2-CE1 3.49Å; F210-F256 HydrophobicContact CE2-CE1 3.49Å; F210-F256 VanDerWaalsContact CE2-CE1 3.49Å; F210-F256 AromaticContact CE2-CZ 3.74Å; F210-F256 HydrophobicContact CE2-CZ 3.74Å; F210-F256 HydrophobicContact CZ-CE1 4.08Å; F210-F260 HydrophobicContact CD2-CB 3.98Å; F210-F260 HydrophobicContact CE2-CB 3.5Å; F210-F260 VanDerWaalsContact CE2-CB 3.5Å; F210-F260 HydrophobicContact CZ-CB 4.46Å; F210-L261 HydrophobicContact CE1-CD1 3.6Å; F210-L261 HydrophobicContact CZ-CB 3.93Å; F210-L261 HydrophobicContact CZ-CD1 3.67Å; F210-L261 HydrophobicContact CZ-CG 4.42Å; F210-H264 HydrophobicContact CB-CB 4.3Å; F210-H264 WeakPolarHBondContact CB-CD2 3.37Å; F210-H264 WeakPolarHBondContact CB-NE2 3.47Å; F210-H264 HydrophobicContact CD1-CB 3.31Å; F210-H264 AromaticContact CD1-CD2 4Å; F210-H264 AromaticContact CD1-CG 3.47Å; F210-H264 VanDerWaalsContact CD1-CG 3.47Å; F210-H264 AromaticContact CD1-ND1 3.95Å; F210-H264 HydrophobicContact CD2-CB 4.41Å; F210-H264 AromaticContact CD2-CE1 3.65Å; F210-H264 AromaticContact CD2-CG 3.77Å; F210-H264 AromaticContact CD2-ND1 3.41Å; F210-H264 WeakPolarHBondContact CD2-ND1 3.39Å; F210-H264 HydrophobicContact CE1-CB 3.67Å; F210-H264 AromaticContact CE2-ND1 3.88Å; F210-H264 HydrophobicContact CG-CB 3.73Å; F210-H264 AromaticContact CG-CD2 3.53Å; F210-H264 AromaticContact CG-CE1 3.78Å; F210-H264 AromaticContact CG-CG 3.27Å; F210-H264 AromaticContact CG-ND1 3.45Å; F210-H264 WeakPolarHBondContact CG-ND1 3.45Å; F210-H264 AromaticContact CG-NE2 3.87Å; F210-H264 HydrophobicContact CZ-CB 4.36Å |
| 211 | Y | 94.9 | Very high | 88.9 | Confident | 84 Ų | 84 | 41.6 Ų | 41.6 | 33% | 0.329 | 24% | 0.24 | S | C | . | . | H | α-helix | trans | -69.3 | -32.9 | -173.8 | -76 | -67.7 | 0 | 0 | 0 | 113.1 | L207 L214 A215 T268 | L207-Y211 HydrophobicContact CB-CD2 4.19Å; L207-Y211 HydrophobicContact CB-CE2 4.4Å; L207-Y211 HydrophobicContact CD2-CE2 3.97Å; L207-Y211 VanDerWaalsContact O-CD2 3.28Å; L207-Y211 WeakPolarHBondContact O-CD2 3.41Å; L207-Y211 PolarHBondContact O-N 2.88Å; Y211-L214 HydrophobicContact CD1-CD2 4.06Å; Y211-L214 HydrophobicContact CE1-CD2 4.42Å; Y211-L214 PolarHBondContact O-N 2.94Å; Y211-A215 WeakPolarHBondContact O-CB 3.36Å; Y211-A215 PolarHBondContact O-N 3.11Å; Y211-T268 WeakPolarHBondContact CE2-OG1 3.26Å; Y211-T268 PolarHBondContact OH-OG1 3.34Å |
| 212 | L | 95.1 | Very high | 90.1 | Very high | 103 Ų | 103 | 42.5 Ų | 42.5 | 54% | 0.539 | 24% | 0.238 | S | C | . | . | H | α-helix | trans | -66.6 | -51.2 | 173.6 | -180 | 155.2 | 0 | 0 | 0 | 110.7 | L208 F210 L214 A215 V216 | L208-L212 HydrophobicContact CD1-CB 4.23Å; L208-L212 HydrophobicContact CD1-CD1 4.28Å; L208-L212 WeakPolarHBondContact O-CB 3.28Å; L208-L212 PolarHBondContact O-N 3.4Å; F210-L212 PolarHBondContact O-N 3.4Å; L212-L214 PolarHBondContact O-N 2.98Å; L212-A215 PolarHBondContact O-N 3.05Å; L212-V216 WeakPolarHBondContact O-CG2 3.41Å; L212-V216 PolarHBondContact O-N 3.47Å; L212-V216 VanDerWaalsContact O-N 3.09Å |
| 213 | P | 95.4 | Very high | 91 | Very high | 12 Ų | 12 | 46.4 Ų | 46.4 | 8% | 0.078 | 26% | 0.255 | C | S | . | . | H | α-helix | trans | -52.3 | -45.9 | 168.7 | -35.8 | 42.4 | 0 | 0 | 0 | 114.6 | I134 T138 G209 F210 A215 V216 V217 F256 | I134-P213 HydrophobicContact CG2-CB 3.52Å; I134-P213 HydrophobicContact CG2-CG 3.75Å; T138-P213 HydrophobicContact CG2-CB 4.5Å; T138-P213 WeakPolarHBondContact OG1-CB 3.22Å; G209-P213 WeakPolarHBondContact O-CG 3.47Å; F210-P213 WeakPolarHBondContact O-CD 3.42Å; P213-A215 PolarHBondContact O-N 3.02Å; P213-V216 PolarHBondContact O-N 2.89Å; P213-V217 VanDerWaalsContact O-CG2 3.31Å; P213-V217 WeakPolarHBondContact O-CG2 3.39Å; P213-V217 PolarHBondContact O-N 3.42Å; P213-F256 HydrophobicContact CB-CZ 4.22Å |
| 214 | L | 95.5 | Very high | 91.6 | Very high | 27 Ų | 27 | 45.7 Ų | 45.7 | 14% | 0.141 | 25% | 0.251 | C | S | . | . | H | α-helix | trans | -57.9 | -48.7 | 178.1 | 177.4 | 67.7 | 0 | 0 | 0 | 111.4 | F210 Y211 L212 V216 V217 V218 F256 V257 L261 | F210-L214 HydrophobicContact CE1-CB 4.39Å; F210-L214 HydrophobicContact CE1-CD2 3.88Å; F210-L214 HydrophobicContact CZ-CB 4.3Å; F210-L214 HydrophobicContact CZ-CD1 4.4Å; F210-L214 HydrophobicContact CZ-CD2 4.03Å; F210-L214 HydrophobicContact CZ-CG 4.48Å; F210-L214 WeakPolarHBondContact O-CB 3.45Å; F210-L214 PolarHBondContact O-N 2.8Å; Y211-L214 HydrophobicContact CD1-CD2 4.06Å; Y211-L214 HydrophobicContact CE1-CD2 4.42Å; Y211-L214 PolarHBondContact O-N 2.94Å; L212-L214 PolarHBondContact O-N 2.98Å; L214-V216 VanDerWaalsContact C-N 3.3Å; L214-V216 PolarHBondContact O-N 3.4Å; L214-V217 PolarHBondContact O-N 3.15Å; L214-V218 HydrophobicContact CD1-CG2 4.02Å; L214-V218 HydrophobicContact CG-CG2 4.4Å; L214-V218 WeakPolarHBondContact O-CB 3.47Å; L214-V218 VanDerWaalsContact O-CG2 3.29Å; L214-V218 WeakPolarHBondContact O-CG2 3.24Å; L214-V218 PolarHBondContact O-N 3.37Å; L214-F256 HydrophobicContact CB-CE1 3.92Å; L214-F256 HydrophobicContact CB-CZ 4.44Å; L214-F256 HydrophobicContact CD1-CD1 3.97Å; L214-F256 HydrophobicContact CD1-CE1 3.64Å; L214-F256 HydrophobicContact CG-CE1 4.38Å; L214-V257 HydrophobicContact CD1-CG2 4.35Å; L214-L261 HydrophobicContact CD2-CD1 4.06Å |
| 215 | A | 96.1 | Very high | 91.8 | Very high | 62 Ų | 62 | 45.5 Ų | 45.5 | 51% | 0.512 | 25% | 0.245 | S | C | . | . | H | α-helix | trans | -59.7 | -42.6 | 178.9 | 0 | 0 | 0 | 0 | 0 | 111.5 | Y211 L212 P213 F219 | Y211-A215 WeakPolarHBondContact O-CB 3.36Å; Y211-A215 PolarHBondContact O-N 3.11Å; L212-A215 PolarHBondContact O-N 3.05Å; P213-A215 PolarHBondContact O-N 3.02Å; A215-F219 VanDerWaalsContact O-CB 3.22Å; A215-F219 WeakPolarHBondContact O-CB 3.47Å; A215-F219 PolarHBondContact O-N 3.14Å |
| 216 | V | 96.2 | Very high | 91.9 | Very high | 46 Ų | 46 | 45.6 Ų | 45.6 | 28% | 0.279 | 25% | 0.25 | S | S | . | . | H | α-helix | trans | -64.1 | -49.6 | 176.6 | 174.4 | 0 | 0 | 0 | 0 | 111.1 | T138 V142 L212 P213 L214 V218 F219 C220 | T138-V216 HydrophobicContact CG2-CB 3.94Å; T138-V216 HydrophobicContact CG2-CG1 3.64Å; V142-V216 HydrophobicContact CG2-CG1 3.54Å; L212-V216 WeakPolarHBondContact O-CG2 3.41Å; L212-V216 PolarHBondContact O-N 3.47Å; L212-V216 VanDerWaalsContact O-N 3.09Å; P213-V216 PolarHBondContact O-N 2.89Å; L214-V216 VanDerWaalsContact C-N 3.3Å; L214-V216 PolarHBondContact O-N 3.4Å; V216-V218 PolarHBondContact O-N 2.94Å; V216-F219 PolarHBondContact O-N 3.09Å; V216-C220 VanDerWaalsContact O-CB 3.27Å; V216-C220 WeakPolarHBondContact O-CB 3.4Å; V216-C220 PolarHBondContact O-N 3.19Å; V216-C220 PolarHBondContact O-SG 3.32Å; V216-C220 VanDerWaalsContact O-SG 3.33Å |
| 217 | V | 94.1 | Very high | 91.8 | Very high | 1 Ų | 1 | 45.3 Ų | 45.3 | 1% | 0.006 | 25% | 0.249 | C | C | . | . | H | α-helix | trans | -60.3 | -47.5 | -179.8 | 172.8 | 0 | 0 | 0 | 0 | 110.6 | T138 A141 P213 L214 C220 S221 L253 | T138-V217 HydrophobicContact CG2-CG2 4.25Å; A141-V217 HydrophobicContact CB-CB 4.49Å; A141-V217 HydrophobicContact CB-CG1 4.42Å; A141-V217 HydrophobicContact CB-CG2 4.16Å; P213-V217 VanDerWaalsContact O-CG2 3.31Å; P213-V217 WeakPolarHBondContact O-CG2 3.39Å; P213-V217 PolarHBondContact O-N 3.42Å; L214-V217 PolarHBondContact O-N 3.15Å; V217-C220 PolarHBondContact O-N 2.86Å; V217-S221 VanDerWaalsContact O-CB 3.24Å; V217-S221 WeakPolarHBondContact O-CB 3.44Å; V217-S221 PolarHBondContact O-N 3.08Å; V217-S221 PolarHBondContact O-OG 3.32Å; V217-L253 HydrophobicContact CG1-CD1 3.86Å |
| 218 | V | 94.4 | Very high | 91.5 | Very high | 54 Ų | 54 | 45.3 Ų | 45.3 | 33% | 0.327 | 25% | 0.249 | S | C | . | . | H | α-helix | trans | -61 | -48.5 | 178.1 | 170.6 | 0 | 0 | 0 | 0 | 110.7 | L214 V216 S221 L222 L253 | L214-V218 HydrophobicContact CD1-CG2 4.02Å; L214-V218 HydrophobicContact CG-CG2 4.4Å; L214-V218 WeakPolarHBondContact O-CB 3.47Å; L214-V218 VanDerWaalsContact O-CG2 3.29Å; L214-V218 WeakPolarHBondContact O-CG2 3.24Å; L214-V218 PolarHBondContact O-N 3.37Å; V216-V218 PolarHBondContact O-N 2.94Å; V218-S221 PolarHBondContact O-N 3.23Å; V218-L222 HydrophobicContact CG1-CD1 3.85Å; V218-L222 HydrophobicContact CG1-CG 4.38Å; V218-L222 WeakPolarHBondContact O-CB 3.41Å; V218-L222 VanDerWaalsContact O-CG 3.26Å; V218-L222 WeakPolarHBondContact O-CG 3.48Å; V218-L222 PolarHBondContact O-N 2.97Å; V218-L253 HydrophobicContact CG2-CD1 4Å |
| 219 | F | 94.8 | Very high | 91.1 | Very high | 98 Ų | 98 | 43.8 Ų | 43.8 | 43% | 0.43 | 25% | 0.253 | S | S | . | . | H | α-helix | trans | -58.8 | -50.8 | 178.1 | 173.7 | -94.6 | 0 | 0 | 0 | 111.9 | Y145 A215 V216 S221 L222 K223 | Y145-F219 HydrophobicContact CE2-CE1 4.22Å; A215-F219 VanDerWaalsContact O-CB 3.22Å; A215-F219 WeakPolarHBondContact O-CB 3.47Å; A215-F219 PolarHBondContact O-N 3.14Å; V216-F219 PolarHBondContact O-N 3.09Å; F219-S221 PolarHBondContact O-N 2.84Å; F219-L222 PolarHBondContact O-N 3.44Å; F219-K223 HydrophobicContact CD1-CG 4.45Å; F219-K223 HydrophobicContact CD2-CG 4.37Å; F219-K223 HydrophobicContact CE1-CG 4.08Å; F219-K223 HydrophobicContact CE2-CD 4.44Å; F219-K223 HydrophobicContact CE2-CG 4.01Å; F219-K223 HydrophobicContact CZ-CD 4.46Å; F219-K223 HydrophobicContact CZ-CG 3.86Å; F219-K223 WeakPolarHBondContact O-CB 3.36Å; F219-K223 VanDerWaalsContact O-CG 3.3Å; F219-K223 WeakPolarHBondContact O-CG 3.45Å; F219-K223 PolarHBondContact O-N 3.18Å |
| 220 | C | 93.4 | Very high | 90.7 | Very high | 5 Ų | 5 | 49.3 Ų | 49.3 | 3% | 0.034 | 27% | 0.273 | C | S | . | . | H | α-helix | trans | -59.6 | -47.1 | 179.6 | -75.9 | 0 | 0 | 0 | 0 | 111.1 | A141 Y145 V216 V217 K223 V224 | A141-C220 HydrophobicContact CB-CB 4.04Å; Y145-C220 HydrophobicContact CG-CB 4.41Å; V216-C220 VanDerWaalsContact O-CB 3.27Å; V216-C220 WeakPolarHBondContact O-CB 3.4Å; V216-C220 PolarHBondContact O-N 3.19Å; V216-C220 PolarHBondContact O-SG 3.32Å; V216-C220 VanDerWaalsContact O-SG 3.33Å; V217-C220 PolarHBondContact O-N 2.86Å; C220-K223 PolarHBondContact O-N 3.05Å; C220-V224 VanDerWaalsContact O-CG2 3.32Å; C220-V224 WeakPolarHBondContact O-CG2 3.43Å; C220-V224 PolarHBondContact O-N 3.44Å |
| 221 | S | 90.9 | Very high | 89.8 | Confident | 5 Ų | 5 | 55.4 Ų | 55.4 | 4% | 0.035 | 30% | 0.296 | C | S | . | . | H | α-helix | trans | -61.2 | -47.5 | 179.5 | -66.5 | 0 | 0 | 0 | 0 | 112.3 | V217 V218 F219 K223 V224 V225 V249 | V217-S221 VanDerWaalsContact O-CB 3.24Å; V217-S221 WeakPolarHBondContact O-CB 3.44Å; V217-S221 PolarHBondContact O-N 3.08Å; V217-S221 PolarHBondContact O-OG 3.32Å; V218-S221 PolarHBondContact O-N 3.23Å; F219-S221 PolarHBondContact O-N 2.84Å; S221-K223 VanDerWaalsContact C-N 3.33Å; S221-K223 PolarHBondContact O-N 3.49Å; S221-V224 PolarHBondContact O-N 3.29Å; S221-V225 VanDerWaalsContact O-CG2 3.29Å; S221-V225 WeakPolarHBondContact O-CG2 3.28Å; S221-V225 PolarHBondContact O-N 2.94Å; S221-V249 VanDerWaalsContact OG-CG1 3.3Å; S221-V249 WeakPolarHBondContact OG-CG1 3.28Å |
| 222 | L | 91.2 | Very high | 88.5 | Confident | 100 Ų | 100 | 56.8 Ų | 56.8 | 52% | 0.524 | 32% | 0.315 | S | S | . | . | H | α-helix | trans | -60.3 | -42.8 | 176.8 | -70.7 | 173.2 | 0 | 0 | 0 | 111.8 | V218 F219 T226 | V218-L222 HydrophobicContact CG1-CD1 3.85Å; V218-L222 HydrophobicContact CG1-CG 4.38Å; V218-L222 WeakPolarHBondContact O-CB 3.41Å; V218-L222 VanDerWaalsContact O-CG 3.26Å; V218-L222 WeakPolarHBondContact O-CG 3.48Å; V218-L222 PolarHBondContact O-N 2.97Å; F219-L222 PolarHBondContact O-N 3.44Å; L222-T226 WeakPolarHBondContact O-CB 3.48Å; L222-T226 VanDerWaalsContact O-CG2 3.3Å; L222-T226 WeakPolarHBondContact O-CG2 3.47Å; L222-T226 PolarHBondContact O-N 3.42Å; L222-T226 PolarHBondContact O-OG1 3.47Å |
| 223 | K | 91.2 | Very high | 87 | Confident | 86 Ų | 86 | 56 Ų | 56 | 37% | 0.374 | 32% | 0.316 | S | S | . | . | H | α-helix | trans | -69.7 | -34.1 | 179.6 | -68.9 | -62 | -177.7 | -173.8 | 0 | 113 | Y145 F219 C220 S221 T226 A227 | Y145-K223 HydrophobicContact CD2-CB 3.63Å; Y145-K223 HydrophobicContact CD2-CG 4.44Å; Y145-K223 HydrophobicContact CE2-CB 3.54Å; Y145-K223 HydrophobicContact CE2-CG 3.98Å; F219-K223 HydrophobicContact CD1-CG 4.45Å; F219-K223 HydrophobicContact CD2-CG 4.37Å; F219-K223 HydrophobicContact CE1-CG 4.08Å; F219-K223 HydrophobicContact CE2-CD 4.44Å; F219-K223 HydrophobicContact CE2-CG 4.01Å; F219-K223 HydrophobicContact CZ-CD 4.46Å; F219-K223 HydrophobicContact CZ-CG 3.86Å; F219-K223 WeakPolarHBondContact O-CB 3.36Å; F219-K223 VanDerWaalsContact O-CG 3.3Å; F219-K223 WeakPolarHBondContact O-CG 3.45Å; F219-K223 PolarHBondContact O-N 3.18Å; C220-K223 PolarHBondContact O-N 3.05Å; S221-K223 VanDerWaalsContact C-N 3.33Å; S221-K223 PolarHBondContact O-N 3.49Å; K223-T226 WeakPolarHBondContact CA-OG1 3.49Å; K223-T226 PolarHBondContact O-OG1 3.49Å; K223-A227 VanDerWaalsContact O-CB 3.25Å; K223-A227 WeakPolarHBondContact O-CB 3.21Å; K223-A227 PolarHBondContact O-N 3.33Å |
| 224 | V | 88.1 | Confident | 85.5 | Confident | 1 Ų | 1 | 62.6 Ų | 62.6 | 1% | 0.006 | 35% | 0.349 | C | S | . | . | H | α-helix | trans | -65.5 | -53.8 | 173 | 170.2 | 0 | 0 | 0 | 0 | 109.7 | V148 C220 S221 T226 A227 L228 V249 | V148-V224 HydrophobicContact CB-CG2 4.46Å; V148-V224 HydrophobicContact CG2-CG1 4.19Å; C220-V224 VanDerWaalsContact O-CG2 3.32Å; C220-V224 WeakPolarHBondContact O-CG2 3.43Å; C220-V224 PolarHBondContact O-N 3.44Å; S221-V224 PolarHBondContact O-N 3.29Å; V224-T226 PolarHBondContact O-N 2.88Å; V224-A227 PolarHBondContact O-N 3.09Å; V224-L228 HydrophobicContact CG1-CD1 3.56Å; V224-L228 HydrophobicContact CG1-CG 4.2Å; V224-L228 WeakPolarHBondContact O-CB 3.33Å; V224-L228 VanDerWaalsContact O-CG 3.25Å; V224-L228 WeakPolarHBondContact O-CG 3.5Å; V224-L228 PolarHBondContact O-N 3.13Å; V224-V249 HydrophobicContact CB-CG1 4.44Å; V224-V249 HydrophobicContact CG1-CG2 4.12Å |
| 225 | V | 86 | Confident | 84.5 | Confident | 45 Ų | 45 | 66.5 Ų | 66.5 | 27% | 0.273 | 37% | 0.37 | S | S | . | . | H | α-helix | trans | -59.1 | -47 | -177.7 | 173.1 | 0 | 0 | 0 | 0 | 111.5 | S221 A227 L228 A229 | S221-V225 VanDerWaalsContact O-CG2 3.29Å; S221-V225 WeakPolarHBondContact O-CG2 3.28Å; S221-V225 PolarHBondContact O-N 2.94Å; V225-A227 VanDerWaalsContact C-N 3.34Å; V225-A227 PolarHBondContact O-N 2.8Å; V225-L228 PolarHBondContact O-N 3.41Å; V225-A229 WeakPolarHBondContact O-CB 3.2Å; V225-A229 PolarHBondContact O-N 3.17Å |
| 226 | T | 87.3 | Confident | 83.3 | Confident | 62 Ų | 62 | 68.9 Ų | 68.9 | 38% | 0.38 | 38% | 0.378 | S | S | . | . | H | α-helix | trans | -62.9 | -39.1 | 178.8 | 48.3 | 0 | 0 | 0 | 0 | 112.6 | L222 K223 V224 A229 Q230 | L222-T226 WeakPolarHBondContact O-CB 3.48Å; L222-T226 VanDerWaalsContact O-CG2 3.3Å; L222-T226 WeakPolarHBondContact O-CG2 3.47Å; L222-T226 PolarHBondContact O-N 3.42Å; L222-T226 PolarHBondContact O-OG1 3.47Å; K223-T226 WeakPolarHBondContact CA-OG1 3.49Å; K223-T226 PolarHBondContact O-OG1 3.49Å; V224-T226 PolarHBondContact O-N 2.88Å; T226-A229 PolarHBondContact O-N 2.86Å; T226-Q230 WeakPolarHBondContact O-CB 3.05Å; T226-Q230 WeakPolarHBondContact O-CG 3.35Å; T226-Q230 PolarHBondContact O-N 3.04Å |
| 227 | A | 83.6 | Confident | 81.9 | Confident | 2 Ų | 2 | 68.7 Ų | 68.7 | 2% | 0.017 | 39% | 0.385 | C | S | . | . | H | α-helix | trans | -73.5 | -31.5 | 178.6 | 0 | 0 | 0 | 0 | 0 | 113.9 | V148 R149 K223 V224 V225 R231 | V148-A227 HydrophobicContact CG1-CB 4.08Å; R149-A227 HydrophobicContact CG-CB 4.31Å; K223-A227 VanDerWaalsContact O-CB 3.25Å; K223-A227 WeakPolarHBondContact O-CB 3.21Å; K223-A227 PolarHBondContact O-N 3.33Å; V224-A227 PolarHBondContact O-N 3.09Å; V225-A227 VanDerWaalsContact C-N 3.34Å; V225-A227 PolarHBondContact O-N 2.8Å; A227-R231 WeakPolarHBondContact O-CG 3.38Å; A227-R231 PolarHBondContact O-N 2.94Å |
| 228 | L | 81 | Confident | 80.6 | Confident | 21 Ų | 21 | 74.3 Ų | 74.3 | 11% | 0.11 | 41% | 0.412 | C | S | . | . | H | α-helix | trans | -70.1 | -36.4 | 173 | -67.7 | 175.6 | 0 | 0 | 0 | 111 | V148 V224 V225 S242 A245 A246 | V148-L228 HydrophobicContact CG1-CD2 3.8Å; V148-L228 HydrophobicContact CG1-CG 4.07Å; V148-L228 HydrophobicContact CG2-CD2 4.36Å; V224-L228 HydrophobicContact CG1-CD1 3.56Å; V224-L228 HydrophobicContact CG1-CG 4.2Å; V224-L228 WeakPolarHBondContact O-CB 3.33Å; V224-L228 VanDerWaalsContact O-CG 3.25Å; V224-L228 WeakPolarHBondContact O-CG 3.5Å; V224-L228 PolarHBondContact O-N 3.13Å; V225-L228 PolarHBondContact O-N 3.41Å; L228-S242 WeakPolarHBondContact CB-OG 3.35Å; L228-S242 WeakPolarHBondContact CD2-OG 3.43Å; L228-A245 HydrophobicContact CD1-CB 4.33Å; L228-A246 HydrophobicContact CD1-CB 3.8Å |
| 229 | A | 80.8 | Confident | 79.3 | Confident | 84 Ų | 84 | 72.9 Ų | 72.9 | 69% | 0.694 | 41% | 0.406 | S | S | * | . | H | α-helix | trans | -70.1 | -31.6 | 175.1 | 0 | 0 | 0 | 0 | 0 | 113.5 | V225 T226 | V225-A229 WeakPolarHBondContact O-CB 3.2Å; V225-A229 PolarHBondContact O-N 3.17Å; T226-A229 PolarHBondContact O-N 2.86Å |
| 230 | Q | 81.6 | Confident | 78 | Confident | 137 Ų | 137 | 74.1 Ų | 74.1 | 64% | 0.64 | 41% | 0.412 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -80.8 | -11.6 | -179 | -75.1 | 172.5 | -7.8 | 0 | 0 | 114.3 | T226 P232 | T226-Q230 WeakPolarHBondContact O-CB 3.05Å; T226-Q230 WeakPolarHBondContact O-CG 3.35Å; T226-Q230 PolarHBondContact O-N 3.04Å; Q230-P232 VanDerWaalsContact O-CD 3.29Å; Q230-P232 WeakPolarHBondContact O-CD 3.38Å |
| 231 | R | 74.9 | Confident | 76.8 | Confident | 129 Ų | 129 | 76.7 Ų | 76.7 | 49% | 0.487 | 43% | 0.434 | S | S | . | . | S | Bend | trans | -92.7 | 107.9 | 179.1 | -75.9 | 179.6 | 179.3 | 166.7 | 6.3 | 109.4 | V148 A227 | V148-R231 PolarHBondContact O-NH1 3.12Å; V148-R231 PolarHBondContact O-NH2 3.29Å; A227-R231 WeakPolarHBondContact O-CG 3.38Å; A227-R231 PolarHBondContact O-N 2.94Å |
| 232 | P | 66.1 | Low | 75.8 | Confident | 112 Ų | 112 | 77.8 Ų | 77.8 | 73% | 0.727 | 44% | 0.442 | S | S | * | . | trans | -61 | 129.1 | 173 | 23.7 | -30.4 | 0 | 0 | 0 | 108.8 | Q230 I234 | Q230-P232 VanDerWaalsContact O-CD 3.29Å; Q230-P232 WeakPolarHBondContact O-CD 3.38Å; P232-I234 PolarHBondContact O-N 3.23Å | ||
| 233 | P | 63.7 | Low | 74.9 | Confident | 86 Ų | 86 | 79.3 Ų | 79.3 | 56% | 0.558 | 45% | 0.446 | S | S | * | . | trans | -67.6 | 127.6 | -179.8 | 25.7 | -31.2 | 0 | 0 | 0 | 110 | A239 | P233-A239 HydrophobicContact CB-CB 3.6Å; P233-A239 HydrophobicContact CG-CB 4.16Å | ||
| 234 | I | 65.4 | Low | 74 | Confident | 151 Ų | 151 | 76.1 Ų | 76.1 | 77% | 0.774 | 43% | 0.432 | S | S | * | . | S | Bend | trans | -78.5 | -27.5 | 177.2 | -59.2 | 174.4 | 0 | 0 | 0 | 110.5 | P232 | P232-I234 PolarHBondContact O-N 3.23Š|
| 235 | D | 74 | Confident | 73.3 | Confident | 109 Ų | 109 | 76.9 Ų | 76.9 | 58% | 0.583 | 44% | 0.439 | S | S | * | . | S | Bend | trans | -150.5 | 159.2 | 176.9 | -177 | 23.2 | 0 | 0 | 0 | 110.4 | G237 Q238 A239 | D235-G237 VanDerWaalsContact C-N 3.26Å; D235-G237 PolarHBondContact O-N 3Å; D235-Q238 PolarHBondContact O-N 2.8Å; D235-Q238 VanDerWaalsContact O-N 3.11Å; D235-A239 PolarHBondContact O-N 2.97Å; D235-A239 VanDerWaalsContact O-N 3.12Å |
| 236 | V | 70.1 | Confident | 72.9 | Confident | 112 Ų | 112 | 75.6 Ų | 75.6 | 68% | 0.679 | 43% | 0.433 | S | S | * | . | H | α-helix | trans | -55.7 | -40.5 | 178.7 | -177.6 | 0 | 0 | 0 | 0 | 111.1 | Q238 A239 E240 | V236-Q238 VanDerWaalsContact C-N 3.33Å; V236-Q238 PolarHBondContact O-N 2.92Å; V236-A239 WeakPolarHBondContact O-CB 3.09Å; V236-A239 PolarHBondContact O-N 3.12Å; V236-E240 PolarHBondContact O-N 2.89Å |
| 237 | G | 66.9 | Low | 72.5 | Confident | 42 Ų | 42 | 79.3 Ų | 79.3 | 43% | 0.433 | 44% | 0.44 | S | S | . | . | H | α-helix | trans | -65 | -33.6 | 178.5 | 0 | 0 | 0 | 0 | 0 | 113.7 | D235 A241 | D235-G237 VanDerWaalsContact C-N 3.26Å; D235-G237 PolarHBondContact O-N 3Å; G237-A241 PolarHBondContact O-N 2.95Å; G237-A241 VanDerWaalsContact O-N 3.14Å |
| 238 | Q | 67.9 | Low | 72.4 | Confident | 120 Ų | 120 | 79.3 Ų | 79.3 | 56% | 0.561 | 44% | 0.439 | S | S | * | . | H | α-helix | trans | -78.3 | -32 | 178.6 | -157.7 | 168.4 | 10.7 | 0 | 0 | 111.9 | D235 V236 S242 | D235-Q238 PolarHBondContact O-N 2.8Å; D235-Q238 VanDerWaalsContact O-N 3.11Å; V236-Q238 VanDerWaalsContact C-N 3.33Å; V236-Q238 PolarHBondContact O-N 2.92Å; Q238-S242 WeakPolarHBondContact O-CB 3.26Å; Q238-S242 PolarHBondContact O-N 2.83Å; Q238-S242 VanDerWaalsContact O-N 3.15Å |
| 239 | A | 65.8 | Low | 72.5 | Confident | 24 Ų | 24 | 78.5 Ų | 78.5 | 20% | 0.198 | 44% | 0.436 | C | S | . | . | H | α-helix | trans | -61.5 | -47.1 | 168.8 | 0 | 0 | 0 | 0 | 0 | 111 | P233 D235 V236 A241 S242 H243 | P233-A239 HydrophobicContact CB-CB 3.6Å; P233-A239 HydrophobicContact CG-CB 4.16Å; D235-A239 PolarHBondContact O-N 2.97Å; D235-A239 VanDerWaalsContact O-N 3.12Å; V236-A239 WeakPolarHBondContact O-CB 3.09Å; V236-A239 PolarHBondContact O-N 3.12Å; A239-A241 PolarHBondContact O-N 3.33Å; A239-S242 WeakPolarHBondContact O-CB 3.49Å; A239-S242 PolarHBondContact O-N 3.44Å; A239-H243 PolarHBondContact O-CD2 3.4Å; A239-H243 PolarHBondContact O-N 3.29Å |
| 240 | E | 68.4 | Low | 72.6 | Confident | 123 Ų | 123 | 80.7 Ų | 80.7 | 58% | 0.575 | 43% | 0.426 | S | S | * | . | H | α-helix | trans | -65.1 | -42.3 | -177.4 | -167 | 169.7 | -172.6 | 0 | 0 | 112.4 | V236 S242 H243 K244 | V236-E240 PolarHBondContact O-N 2.89Å; E240-S242 VanDerWaalsContact C-N 3.33Å; E240-S242 PolarHBondContact O-N 3.2Å; E240-H243 PolarHBondContact O-N 3.25Å; E240-K244 WeakPolarHBondContact O-CB 3.45Å; E240-K244 PolarHBondContact O-N 3.28Å |
| 241 | A | 67.2 | Low | 72.7 | Confident | 60 Ų | 60 | 75 Ų | 75 | 50% | 0.496 | 40% | 0.402 | S | S | . | . | H | α-helix | trans | -61.5 | -39.8 | 173.7 | 0 | 0 | 0 | 0 | 0 | 112.6 | G237 A239 K244 A245 | G237-A241 PolarHBondContact O-N 2.95Å; G237-A241 VanDerWaalsContact O-N 3.14Å; A239-A241 PolarHBondContact O-N 3.33Å; A241-K244 PolarHBondContact O-N 2.9Å; A241-A245 PolarHBondContact O-N 2.82Å |
| 242 | S | 70.8 | Confident | 73.1 | Confident | 28 Ų | 28 | 69.3 Ų | 69.3 | 20% | 0.196 | 38% | 0.382 | C | S | . | . | H | α-helix | trans | -63.3 | -50 | 175.1 | 178.1 | 0 | 0 | 0 | 0 | 111.8 | L228 Q238 A239 E240 K244 A245 A246 | L228-S242 WeakPolarHBondContact CB-OG 3.35Å; L228-S242 WeakPolarHBondContact CD2-OG 3.43Å; Q238-S242 WeakPolarHBondContact O-CB 3.26Å; Q238-S242 PolarHBondContact O-N 2.83Å; Q238-S242 VanDerWaalsContact O-N 3.15Å; A239-S242 WeakPolarHBondContact O-CB 3.49Å; A239-S242 PolarHBondContact O-N 3.44Å; E240-S242 VanDerWaalsContact C-N 3.33Å; E240-S242 PolarHBondContact O-N 3.2Å; S242-K244 VanDerWaalsContact C-N 3.27Å; S242-K244 PolarHBondContact O-N 3.3Å; S242-A245 PolarHBondContact O-N 2.95Å; S242-A246 WeakPolarHBondContact O-CB 3.46Å; S242-A246 PolarHBondContact O-N 2.9Å |
| 243 | H | 72.7 | Confident | 74.2 | Confident | 131 Ų | 131 | 65 Ų | 65 | 61% | 0.606 | 35% | 0.352 | S | S | * | . | H | α-helix | trans | -60.2 | -37.1 | 176.5 | -84.9 | -80.1 | 0 | 0 | 0 | 112.5 | A239 E240 A246 R247 | A239-H243 PolarHBondContact O-CD2 3.4Å; A239-H243 PolarHBondContact O-N 3.29Å; E240-H243 PolarHBondContact O-N 3.25Å; H243-A246 PolarHBondContact O-N 3.41Å; H243-R247 WeakPolarHBondContact O-CB 3.43Å; H243-R247 WeakPolarHBondContact O-CG 3.19Å; H243-R247 PolarHBondContact O-N 3.37Å |
| 244 | K | 72.1 | Confident | 75.5 | Confident | 19 Ų | 19 | 64.5 Ų | 64.5 | 8% | 0.083 | 35% | 0.348 | C | S | . | . | H | α-helix | trans | -67.3 | -46.6 | 177.5 | -171.2 | 175 | -177.1 | 177 | 0 | 112.2 | E240 A241 S242 A246 R247 M248 K311 E312 E315 | E240-K244 WeakPolarHBondContact O-CB 3.45Å; E240-K244 PolarHBondContact O-N 3.28Å; A241-K244 PolarHBondContact O-N 2.9Å; S242-K244 VanDerWaalsContact C-N 3.27Å; S242-K244 PolarHBondContact O-N 3.3Å; K244-A246 VanDerWaalsContact C-N 3.29Å; K244-A246 PolarHBondContact O-N 3.47Å; K244-R247 PolarHBondContact O-N 2.49Å; K244-M248 PolarHBondContact O-N 2.92Å; K244-K311 PolarHBondContact NZ-O 3.49Å; K244-E312 HydrophobicContact CD-CG 4.08Å; K244-E312 VanDerWaalsContact CE-CG 3.42Å; K244-E312 VanDerWaalsContact NZ-CA 3.29Å; K244-E312 VanDerWaalsContact NZ-N 3.13Å; K244-E315 IonicContact NZ-OE1 3.85Å; K244-E315 PolarHBondContact NZ-OE1 2.74Å; K244-E315 IonicContact NZ-OE2 3.17Å; K244-E315 PolarHBondContact NZ-OE2 3.48Å |
| 245 | A | 72.8 | Confident | 76.6 | Confident | 17 Ų | 17 | 57.8 Ų | 57.8 | 14% | 0.14 | 31% | 0.313 | C | S | . | . | H | α-helix | trans | -60.1 | -41 | 174.5 | 0 | 0 | 0 | 0 | 0 | 111.5 | L228 A241 S242 M248 V249 | L228-A245 HydrophobicContact CD1-CB 4.33Å; A241-A245 PolarHBondContact O-N 2.82Å; S242-A245 PolarHBondContact O-N 2.95Å; A245-M248 PolarHBondContact O-N 3.25Å; A245-V249 WeakPolarHBondContact O-CG2 3.48Å; A245-V249 PolarHBondContact O-N 2.96Å; A245-V249 VanDerWaalsContact O-N 3.09Å |
| 246 | A | 77.4 | Confident | 77.4 | Confident | 18 Ų | 18 | 52.6 Ų | 52.6 | 15% | 0.149 | 29% | 0.286 | C | S | . | . | H | α-helix | trans | -63.6 | -43.4 | 174.6 | 0 | 0 | 0 | 0 | 0 | 112.4 | L228 S242 H243 K244 V249 W250 | L228-A246 HydrophobicContact CD1-CB 3.8Å; S242-A246 WeakPolarHBondContact O-CB 3.46Å; S242-A246 PolarHBondContact O-N 2.9Å; H243-A246 PolarHBondContact O-N 3.41Å; K244-A246 VanDerWaalsContact C-N 3.29Å; K244-A246 PolarHBondContact O-N 3.47Å; A246-V249 PolarHBondContact O-N 3.17Å; A246-W250 WeakPolarHBondContact O-CB 3.39Å; A246-W250 PolarHBondContact O-N 3.43Å |
| 247 | R | 80.2 | Confident | 78.4 | Confident | 141 Ų | 141 | 49.5 Ų | 49.5 | 53% | 0.532 | 27% | 0.267 | S | S | . | . | H | α-helix | trans | -62.4 | -42.3 | 177.1 | -79.9 | 177.3 | 68.5 | 177.4 | 4.8 | 112.2 | H243 K244 W250 A251 Y308 | H243-R247 WeakPolarHBondContact O-CB 3.43Å; H243-R247 WeakPolarHBondContact O-CG 3.19Å; H243-R247 PolarHBondContact O-N 3.37Å; K244-R247 PolarHBondContact O-N 2.49Å; R247-W250 PolarHBondContact O-N 2.97Å; R247-A251 VanDerWaalsContact O-CB 3.28Å; R247-A251 WeakPolarHBondContact O-CB 3.39Å; R247-A251 PolarHBondContact O-N 3.21Å; R247-Y308 HydrophobicContact CB-CE1 4.1Å; R247-Y308 PolarHBondContact NE-OH 3.44Å; R247-Y308 VanDerWaalsContact NE-OH 3.13Å; R247-Y308 PolarHBondContact NH2-OH 3.36Å |
| 248 | M | 80.8 | Confident | 79.6 | Confident | 1 Ų | 1 | 51.1 Ų | 51.1 | 1% | 0.005 | 27% | 0.268 | C | S | . | . | H | α-helix | trans | -61.1 | -47.3 | 175.5 | -178.2 | -175.1 | -177.8 | 0 | 0 | 111.3 | T85 M89 I140 K244 A245 W250 A251 N252 Y308 | T85-M248 HydrophobicContact CG2-CE 3.73Å; M89-M248 HydrophobicContact CE-CE 3.3Å; I140-M248 HydrophobicContact CG2-CE 4.43Å; K244-M248 PolarHBondContact O-N 2.92Å; A245-M248 PolarHBondContact O-N 3.25Å; M248-W250 PolarHBondContact O-N 3.44Å; M248-A251 PolarHBondContact O-N 3.39Å; M248-N252 VanDerWaalsContact O-CG 3.27Å; M248-N252 PolarHBondContact O-N 2.87Å; M248-N252 PolarHBondContact O-OD1 3.31Å; M248-N252 VanDerWaalsContact O-OD1 3.06Å; M248-Y308 HydrophobicContact CB-CG 4.35Å |
| 249 | V | 82.4 | Confident | 80.8 | Confident | 5 Ų | 5 | 45.4 Ų | 45.4 | 3% | 0.03 | 24% | 0.241 | C | C | . | . | H | α-helix | trans | -64 | -42 | 179.3 | 169.4 | 0 | 0 | 0 | 0 | 111.8 | R144 S221 V224 A245 A246 N252 L253 | R144-V249 HydrophobicContact CB-CG2 3.94Å; R144-V249 HydrophobicContact CG-CG2 4.05Å; S221-V249 VanDerWaalsContact OG-CG1 3.3Å; S221-V249 WeakPolarHBondContact OG-CG1 3.28Å; V224-V249 HydrophobicContact CB-CG1 4.44Å; V224-V249 HydrophobicContact CG1-CG2 4.12Å; A245-V249 WeakPolarHBondContact O-CG2 3.48Å; A245-V249 PolarHBondContact O-N 2.96Å; A245-V249 VanDerWaalsContact O-N 3.09Å; A246-V249 PolarHBondContact O-N 3.17Å; V249-N252 PolarHBondContact O-N 2.94Å; V249-L253 PolarHBondContact O-N 3.43Å |
| 250 | W | 83.4 | Confident | 82.2 | Confident | 130 Ų | 130 | 44.3 Ų | 44.3 | 49% | 0.492 | 23% | 0.232 | S | C | . | . | H | α-helix | trans | -64.6 | -43.8 | 174.8 | -98.3 | 112.1 | 0 | 0 | 0 | 112.8 | A246 R247 M248 N252 L253 V254 | A246-W250 WeakPolarHBondContact O-CB 3.39Å; A246-W250 PolarHBondContact O-N 3.43Å; R247-W250 PolarHBondContact O-N 2.97Å; M248-W250 PolarHBondContact O-N 3.44Å; W250-N252 VanDerWaalsContact C-N 3.34Å; W250-N252 PolarHBondContact O-N 2.93Å; W250-L253 HydrophobicContact CE3-CD2 4.03Å; W250-L253 HydrophobicContact CH2-CD2 4.38Å; W250-L253 HydrophobicContact CZ3-CD2 3.83Å; W250-L253 PolarHBondContact O-N 2.92Å; W250-V254 HydrophobicContact CE3-CG2 4.21Å; W250-V254 WeakPolarHBondContact O-CG2 3.39Å; W250-V254 PolarHBondContact O-N 3.14Å |
| 251 | A | 84.6 | Confident | 83.4 | Confident | 17 Ų | 17 | 40.8 Ų | 40.8 | 14% | 0.14 | 22% | 0.217 | C | C | . | . | H | α-helix | trans | -58.2 | -47.6 | 176.7 | 0 | 0 | 0 | 0 | 0 | 110.9 | R247 M248 L253 V254 V255 I304 Y308 | R247-A251 VanDerWaalsContact O-CB 3.28Å; R247-A251 WeakPolarHBondContact O-CB 3.39Å; R247-A251 PolarHBondContact O-N 3.21Å; M248-A251 PolarHBondContact O-N 3.39Å; A251-L253 VanDerWaalsContact C-N 3.33Å; A251-L253 PolarHBondContact O-N 3.17Å; A251-V254 PolarHBondContact O-N 3.41Å; A251-V255 WeakPolarHBondContact O-CG2 3.47Å; A251-V255 PolarHBondContact O-N 3.4Å; A251-I304 HydrophobicContact CB-CG2 3.91Å; A251-Y308 HydrophobicContact CB-CD2 4.43Å; A251-Y308 HydrophobicContact CB-CE2 3.99Å |
| 252 | N | 82.9 | Confident | 84.7 | Confident | 10 Ų | 10 | 40 Ų | 40 | 5% | 0.053 | 21% | 0.207 | C | C | . | . | H | α-helix | trans | -60.3 | -41.7 | 177.6 | -68 | 14.6 | 0 | 0 | 0 | 112.2 | V137 M248 V249 W250 F256 C305 | V137-N252 HydrophobicContact CG1-CB 4.43Å; M248-N252 VanDerWaalsContact O-CG 3.27Å; M248-N252 PolarHBondContact O-N 2.87Å; M248-N252 PolarHBondContact O-OD1 3.31Å; M248-N252 VanDerWaalsContact O-OD1 3.06Å; V249-N252 PolarHBondContact O-N 2.94Å; W250-N252 VanDerWaalsContact C-N 3.34Å; W250-N252 PolarHBondContact O-N 2.93Å; N252-F256 VanDerWaalsContact O-CB 3.27Å; N252-F256 WeakPolarHBondContact O-CB 3.4Å; N252-F256 PolarHBondContact O-N 3.27Å; N252-C305 PolarHBondContact OD1-SG 3Å |
| 253 | L | 89.6 | Confident | 85.7 | Confident | 20 Ų | 20 | 39.1 Ų | 39.1 | 11% | 0.105 | 20% | 0.2 | C | C | . | . | H | α-helix | trans | -63.8 | -44.8 | 176.5 | 174.4 | 63.4 | 0 | 0 | 0 | 111.7 | V217 V218 V249 W250 A251 F256 V257 | V217-L253 HydrophobicContact CG1-CD1 3.86Å; V218-L253 HydrophobicContact CG2-CD1 4Å; V249-L253 PolarHBondContact O-N 3.43Å; W250-L253 HydrophobicContact CE3-CD2 4.03Å; W250-L253 HydrophobicContact CH2-CD2 4.38Å; W250-L253 HydrophobicContact CZ3-CD2 3.83Å; W250-L253 PolarHBondContact O-N 2.92Å; A251-L253 VanDerWaalsContact C-N 3.33Å; A251-L253 PolarHBondContact O-N 3.17Å; L253-F256 PolarHBondContact O-N 3.48Å; L253-V257 HydrophobicContact CD1-CG2 3.95Å; L253-V257 WeakPolarHBondContact O-CB 3.46Å; L253-V257 VanDerWaalsContact O-CG2 3.32Å; L253-V257 WeakPolarHBondContact O-CG2 3.22Å; L253-V257 PolarHBondContact O-N 3.2Å |
| 254 | V | 89.6 | Confident | 86.7 | Confident | 77 Ų | 77 | 32.9 Ų | 32.9 | 47% | 0.467 | 17% | 0.171 | S | C | . | . | H | α-helix | trans | -63 | -47.7 | 179.5 | 170.4 | 0 | 0 | 0 | 0 | 110.6 | W250 A251 F256 V257 V258 | W250-V254 HydrophobicContact CE3-CG2 4.21Å; W250-V254 WeakPolarHBondContact O-CG2 3.39Å; W250-V254 PolarHBondContact O-N 3.14Å; A251-V254 PolarHBondContact O-N 3.41Å; V254-F256 VanDerWaalsContact C-N 3.34Å; V254-F256 PolarHBondContact O-N 3.48Å; V254-V257 PolarHBondContact O-N 2.98Å; V254-V258 HydrophobicContact CG1-CG2 4.2Å; V254-V258 WeakPolarHBondContact O-CB 3.48Å; V254-V258 VanDerWaalsContact O-CG2 3.3Å; V254-V258 WeakPolarHBondContact O-CG2 3.47Å; V254-V258 PolarHBondContact O-N 3.35Å |
| 255 | V | 89.4 | Confident | 87.6 | Confident | 9 Ų | 9 | 35.1 Ų | 35.1 | 6% | 0.055 | 19% | 0.186 | C | C | . | . | H | α-helix | trans | -59.4 | -47.1 | 177.2 | 173.7 | 0 | 0 | 0 | 0 | 110.4 | A251 V257 V258 C259 L301 I304 | A251-V255 WeakPolarHBondContact O-CG2 3.47Å; A251-V255 PolarHBondContact O-N 3.4Å; V255-V257 PolarHBondContact O-N 3.35Å; V255-V258 PolarHBondContact O-N 3.3Å; V255-C259 VanDerWaalsContact O-CB 3.23Å; V255-C259 WeakPolarHBondContact O-CB 3.39Å; V255-C259 PolarHBondContact O-N 2.93Å; V255-C259 PolarHBondContact O-SG 3.42Å; V255-L301 HydrophobicContact CG1-CB 3.75Å; V255-L301 HydrophobicContact CG1-CD1 4.5Å; V255-L301 HydrophobicContact CG2-CB 4.06Å; V255-I304 HydrophobicContact CG2-CD1 4.32Å |
| 256 | F | 90 | Very high | 88.4 | Confident | 1 Ų | 1 | 34.5 Ų | 34.5 | 0% | 0.004 | 18% | 0.182 | C | C | . | . | H | α-helix | trans | -57.2 | -48 | 178 | -174.9 | -86.3 | 0 | 0 | 0 | 112.6 | I134 V137 F210 P213 L214 N252 L253 V254 F260 | I134-F256 HydrophobicContact CB-CE2 4.09Å; I134-F256 HydrophobicContact CG1-CE2 3.97Å; I134-F256 HydrophobicContact CG1-CZ 4.47Å; I134-F256 HydrophobicContact CG2-CE2 3.82Å; I134-F256 HydrophobicContact CG2-CZ 4.09Å; V137-F256 HydrophobicContact CB-CD2 4.26Å; V137-F256 HydrophobicContact CG1-CB 4.3Å; V137-F256 HydrophobicContact CG1-CD2 3.89Å; V137-F256 HydrophobicContact CG1-CG 4.49Å; F210-F256 HydrophobicContact CD2-CE1 4.23Å; F210-F256 HydrophobicContact CD2-CZ 4.03Å; F210-F256 HydrophobicContact CE2-CD1 4.39Å; F210-F256 AromaticContact CE2-CE1 3.49Å; F210-F256 HydrophobicContact CE2-CE1 3.49Å; F210-F256 VanDerWaalsContact CE2-CE1 3.49Å; F210-F256 AromaticContact CE2-CZ 3.74Å; F210-F256 HydrophobicContact CE2-CZ 3.74Å; F210-F256 HydrophobicContact CZ-CE1 4.08Å; P213-F256 HydrophobicContact CB-CZ 4.22Å; L214-F256 HydrophobicContact CB-CE1 3.92Å; L214-F256 HydrophobicContact CB-CZ 4.44Å; L214-F256 HydrophobicContact CD1-CD1 3.97Å; L214-F256 HydrophobicContact CD1-CE1 3.64Å; L214-F256 HydrophobicContact CG-CE1 4.38Å; N252-F256 VanDerWaalsContact O-CB 3.27Å; N252-F256 WeakPolarHBondContact O-CB 3.4Å; N252-F256 PolarHBondContact O-N 3.27Å; L253-F256 PolarHBondContact O-N 3.48Å; V254-F256 VanDerWaalsContact C-N 3.34Å; V254-F256 PolarHBondContact O-N 3.48Å; F256-F260 AromaticContact CD2-CD2 3.79Å; F256-F260 HydrophobicContact CD2-CD2 3.79Å; F256-F260 HydrophobicContact CD2-CE2 4.19Å; F256-F260 HydrophobicContact CE2-CD2 4.14Å; F256-F260 HydrophobicContact CG-CD2 4.12Å; F256-F260 WeakPolarHBondContact O-CB 3.14Å; F256-F260 WeakPolarHBondContact O-CD2 3.44Å; F256-F260 PolarHBondContact O-N 2.89Å |
| 257 | V | 92.3 | Very high | 88.9 | Confident | 47 Ų | 47 | 34.9 Ų | 34.9 | 29% | 0.285 | 18% | 0.181 | S | C | . | . | H | α-helix | trans | -66.6 | -48.9 | -179.1 | 169.4 | 0 | 0 | 0 | 0 | 110.7 | L214 L253 V254 V255 C259 L261 P262 | L214-V257 HydrophobicContact CD1-CG2 4.35Å; L253-V257 HydrophobicContact CD1-CG2 3.95Å; L253-V257 WeakPolarHBondContact O-CB 3.46Å; L253-V257 VanDerWaalsContact O-CG2 3.32Å; L253-V257 WeakPolarHBondContact O-CG2 3.22Å; L253-V257 PolarHBondContact O-N 3.2Å; V254-V257 PolarHBondContact O-N 2.98Å; V255-V257 PolarHBondContact O-N 3.35Å; V257-C259 PolarHBondContact O-N 3.25Å; V257-L261 HydrophobicContact CG1-CB 4.26Å; V257-L261 HydrophobicContact CG1-CD2 3.86Å; V257-L261 WeakPolarHBondContact O-CB 3.13Å; V257-L261 PolarHBondContact O-N 3.42Å; V257-L261 VanDerWaalsContact O-N 3.08Å; V257-P262 VanDerWaalsContact O-CD 3.29Å; V257-P262 WeakPolarHBondContact O-CD 3.01Å |
| 258 | V | 92.1 | Very high | 89.3 | Confident | 75 Ų | 75 | 30.3 Ų | 30.3 | 46% | 0.455 | 17% | 0.169 | S | C | . | . | H | α-helix | trans | -63.9 | -44 | -177.5 | 170.9 | 0 | 0 | 0 | 0 | 111.5 | V254 V255 P262 I294 | V254-V258 HydrophobicContact CG1-CG2 4.2Å; V254-V258 WeakPolarHBondContact O-CB 3.48Å; V254-V258 VanDerWaalsContact O-CG2 3.3Å; V254-V258 WeakPolarHBondContact O-CG2 3.47Å; V254-V258 PolarHBondContact O-N 3.35Å; V255-V258 PolarHBondContact O-N 3.3Å; V258-P262 WeakPolarHBondContact O-CD 3.27Å; V258-P262 WeakPolarHBondContact O-CG 3.4Å; V258-I294 HydrophobicContact CG1-CG2 4.48Å; V258-I294 VanDerWaalsContact O-CG2 3.28Å; V258-I294 WeakPolarHBondContact O-CG2 3.33Å |
| 259 | C | 93.3 | Very high | 89.5 | Confident | 0 Ų | 0 | 32.8 Ų | 32.8 | 0% | 0 | 18% | 0.184 | C | C | . | . | H | α-helix | trans | -74.5 | -44.3 | -176.8 | -66.3 | 0 | 0 | 0 | 0 | 112.6 | V255 V257 S295 N298 L301 | V255-C259 VanDerWaalsContact O-CB 3.23Å; V255-C259 WeakPolarHBondContact O-CB 3.39Å; V255-C259 PolarHBondContact O-N 2.93Å; V255-C259 PolarHBondContact O-SG 3.42Å; V257-C259 PolarHBondContact O-N 3.25Å; C259-S295 WeakPolarHBondContact O-CA 3.36Å; C259-S295 WeakPolarHBondContact O-CB 3.32Å; C259-S295 PolarHBondContact O-N 3.49Å; C259-N298 HydrophobicContact CB-CB 4.05Å; C259-L301 VanDerWaalsContact SG-CD1 3.57Å |
| 260 | F | 93.9 | Very high | 89.5 | Confident | 1 Ų | 1 | 35 Ų | 35 | 0% | 0.004 | 19% | 0.192 | C | C | . | . | H | α-helix | trans | -107.5 | -33.1 | -165.3 | -57 | -61.7 | 0 | 0 | 0 | 114.3 | R130 I134 F210 F256 L263 H264 N298 | R130-F260 HydrophobicContact CG-CD1 4.35Å; R130-F260 HydrophobicContact CG-CE1 4.21Å; I134-F260 HydrophobicContact CD1-CB 4.45Å; I134-F260 HydrophobicContact CD1-CD1 4Å; I134-F260 HydrophobicContact CD1-CE1 4.38Å; I134-F260 HydrophobicContact CD1-CG 4.08Å; I134-F260 HydrophobicContact CG1-CD1 3.99Å; I134-F260 HydrophobicContact CG1-CD2 3.81Å; I134-F260 HydrophobicContact CG1-CE1 4.09Å; I134-F260 HydrophobicContact CG1-CE2 3.93Å; I134-F260 HydrophobicContact CG1-CG 3.85Å; I134-F260 HydrophobicContact CG1-CZ 4.06Å; F210-F260 HydrophobicContact CD2-CB 3.98Å; F210-F260 HydrophobicContact CE2-CB 3.5Å; F210-F260 VanDerWaalsContact CE2-CB 3.5Å; F210-F260 HydrophobicContact CZ-CB 4.46Å; F256-F260 AromaticContact CD2-CD2 3.79Å; F256-F260 HydrophobicContact CD2-CD2 3.79Å; F256-F260 HydrophobicContact CD2-CE2 4.19Å; F256-F260 HydrophobicContact CE2-CD2 4.14Å; F256-F260 HydrophobicContact CG-CD2 4.12Å; F256-F260 WeakPolarHBondContact O-CB 3.14Å; F256-F260 WeakPolarHBondContact O-CD2 3.44Å; F256-F260 PolarHBondContact O-N 2.89Å; F260-L263 PolarHBondContact O-N 3Å; F260-H264 PolarHBondContact O-N 3.09Å; F260-H264 PolarHBondContact O-ND1 3.33Å; F260-N298 HydrophobicContact CE1-CB 4.34Å; F260-N298 WeakPolarHBondContact CE2-OD1 3.3Å; F260-N298 HydrophobicContact CZ-CB 3.87Å; F260-N298 VanDerWaalsContact CZ-CG 3.4Å; F260-N298 WeakPolarHBondContact CZ-OD1 3.41Å |
| 261 | L | 94.1 | Very high | 89.4 | Confident | 49 Ų | 49 | 31.5 Ų | 31.5 | 26% | 0.257 | 18% | 0.182 | S | C | . | . | H | α-helix | trans | -61.7 | -45.5 | -175.7 | -175.7 | 63.6 | 0 | 0 | 0 | 113.5 | F210 L214 V257 L263 H264 V265 | F210-L261 HydrophobicContact CE1-CD1 3.6Å; F210-L261 HydrophobicContact CZ-CB 3.93Å; F210-L261 HydrophobicContact CZ-CD1 3.67Å; F210-L261 HydrophobicContact CZ-CG 4.42Å; L214-L261 HydrophobicContact CD2-CD1 4.06Å; V257-L261 HydrophobicContact CG1-CB 4.26Å; V257-L261 HydrophobicContact CG1-CD2 3.86Å; V257-L261 WeakPolarHBondContact O-CB 3.13Å; V257-L261 PolarHBondContact O-N 3.42Å; V257-L261 VanDerWaalsContact O-N 3.08Å; L261-L263 VanDerWaalsContact C-N 3.27Å; L261-L263 PolarHBondContact O-N 3.01Å; L261-H264 PolarHBondContact O-N 3.31Å; L261-V265 HydrophobicContact CD1-CG2 3.76Å; L261-V265 HydrophobicContact CG-CG2 3.96Å; L261-V265 WeakPolarHBondContact O-CG2 3.28Å; L261-V265 PolarHBondContact O-N 3.37Å |
| 262 | P | 94.9 | Very high | 89.2 | Confident | 45 Ų | 45 | 34.6 Ų | 34.6 | 29% | 0.292 | 21% | 0.208 | S | C | . | . | H | α-helix | trans | -57.8 | -40.6 | -176.6 | -26.5 | 35.4 | 0 | 0 | 0 | 113 | V257 V258 G266 T291 | V257-P262 VanDerWaalsContact O-CD 3.29Å; V257-P262 WeakPolarHBondContact O-CD 3.01Å; V258-P262 WeakPolarHBondContact O-CD 3.27Å; V258-P262 WeakPolarHBondContact O-CG 3.4Å; P262-G266 PolarHBondContact O-N 3.43Å; P262-G266 VanDerWaalsContact O-N 3.09Å; P262-T291 HydrophobicContact CB-CG2 3.49Å; P262-T291 VanDerWaalsContact CB-CG2 3.49Å |
| 263 | L | 91.8 | Very high | 88.9 | Confident | 8 Ų | 8 | 37.4 Ų | 37.4 | 4% | 0.042 | 23% | 0.225 | C | C | . | . | H | α-helix | trans | -65.7 | -48.5 | 179.1 | 174.2 | 66.6 | 0 | 0 | 0 | 111.5 | F260 L261 V265 G266 L267 L288 T291 | F260-L263 PolarHBondContact O-N 3Å; L261-L263 VanDerWaalsContact C-N 3.27Å; L261-L263 PolarHBondContact O-N 3.01Å; L263-V265 VanDerWaalsContact C-N 3.35Å; L263-G266 WeakPolarHBondContact O-CA 3.19Å; L263-G266 PolarHBondContact O-N 3.24Å; L263-G266 VanDerWaalsContact O-N 3.14Å; L263-L267 HydrophobicContact CG-CD1 4.42Å; L263-L267 WeakPolarHBondContact O-CG 3.23Å; L263-L267 PolarHBondContact O-N 3.48Å; L263-L288 HydrophobicContact CD1-CD2 3.95Å; L263-T291 WeakPolarHBondContact CA-OG1 3.31Å |
| 264 | H | 92.4 | Very high | 87.7 | Confident | 1 Ų | 1 | 37.8 Ų | 37.8 | 1% | 0.005 | 23% | 0.234 | C | C | . | . | H | α-helix | trans | -71.1 | -32.3 | -176.1 | -66.7 | 88.6 | 0 | 0 | 0 | 112.1 | P206 F210 F260 L261 G266 L267 T268 | P206-H264 PolarHBondContact O-CD2 3.05Å; F210-H264 HydrophobicContact CB-CB 4.3Å; F210-H264 WeakPolarHBondContact CB-CD2 3.37Å; F210-H264 WeakPolarHBondContact CB-NE2 3.47Å; F210-H264 HydrophobicContact CD1-CB 3.31Å; F210-H264 AromaticContact CD1-CD2 4Å; F210-H264 AromaticContact CD1-CG 3.47Å; F210-H264 VanDerWaalsContact CD1-CG 3.47Å; F210-H264 AromaticContact CD1-ND1 3.95Å; F210-H264 HydrophobicContact CD2-CB 4.41Å; F210-H264 AromaticContact CD2-CE1 3.65Å; F210-H264 AromaticContact CD2-CG 3.77Å; F210-H264 AromaticContact CD2-ND1 3.41Å; F210-H264 WeakPolarHBondContact CD2-ND1 3.39Å; F210-H264 HydrophobicContact CE1-CB 3.67Å; F210-H264 AromaticContact CE2-ND1 3.88Å; F210-H264 HydrophobicContact CG-CB 3.73Å; F210-H264 AromaticContact CG-CD2 3.53Å; F210-H264 AromaticContact CG-CE1 3.78Å; F210-H264 AromaticContact CG-CG 3.27Å; F210-H264 AromaticContact CG-ND1 3.45Å; F210-H264 WeakPolarHBondContact CG-ND1 3.45Å; F210-H264 AromaticContact CG-NE2 3.87Å; F210-H264 HydrophobicContact CZ-CB 4.36Å; F260-H264 PolarHBondContact O-N 3.09Å; F260-H264 PolarHBondContact O-ND1 3.33Å; L261-H264 PolarHBondContact O-N 3.31Å; H264-G266 VanDerWaalsContact C-N 3.34Å; H264-L267 PolarHBondContact O-N 2.86Å; H264-T268 PolarHBondContact O-N 3.5Å; H264-T268 PolarHBondContact O-OG1 2.87Å |
| 265 | V | 92.5 | Very high | 86.7 | Confident | 66 Ų | 66 | 38.5 Ų | 38.5 | 40% | 0.4 | 23% | 0.228 | S | C | . | . | H | α-helix | trans | -59.9 | -46.2 | 167.8 | 170.4 | 0 | 0 | 0 | 0 | 110.3 | L261 L263 L267 T268 V269 | L261-V265 HydrophobicContact CD1-CG2 3.76Å; L261-V265 HydrophobicContact CG-CG2 3.96Å; L261-V265 WeakPolarHBondContact O-CG2 3.28Å; L261-V265 PolarHBondContact O-N 3.37Å; L263-V265 VanDerWaalsContact C-N 3.35Å; V265-L267 VanDerWaalsContact C-N 3.3Å; V265-L267 PolarHBondContact O-N 3.34Å; V265-T268 WeakPolarHBondContact O-CB 3.46Å; V265-T268 PolarHBondContact O-N 3.42Å; V265-T268 VanDerWaalsContact O-N 3.15Å; V265-V269 HydrophobicContact CG1-CG2 4.46Å; V265-V269 WeakPolarHBondContact O-CG2 3.26Å; V265-V269 PolarHBondContact O-N 3.47Å |
| 266 | G | 89 | Confident | 85.6 | Confident | 4 Ų | 4 | 45.4 Ų | 45.4 | 4% | 0.041 | 27% | 0.265 | C | S | . | . | H | α-helix | trans | -57.3 | -42.1 | 174 | 0 | 0 | 0 | 0 | 0 | 112.8 | P262 L263 H264 V269 R270 | P262-G266 PolarHBondContact O-N 3.43Å; P262-G266 VanDerWaalsContact O-N 3.09Å; L263-G266 WeakPolarHBondContact O-CA 3.19Å; L263-G266 PolarHBondContact O-N 3.24Å; L263-G266 VanDerWaalsContact O-N 3.14Å; H264-G266 VanDerWaalsContact C-N 3.34Å; G266-V269 PolarHBondContact O-N 3.31Å; G266-R270 PolarHBondContact O-N 2.83Å |
| 267 | L | 86.9 | Confident | 84.8 | Confident | 25 Ų | 25 | 47.9 Ų | 47.9 | 13% | 0.131 | 29% | 0.285 | C | S | . | . | H | α-helix | trans | -66 | -38.1 | 176 | -67.6 | 173.5 | 0 | 0 | 0 | 112.2 | P206 L207 L263 H264 V265 R270 L271 L288 | P206-L267 HydrophobicContact CB-CD1 4.28Å; L207-L267 HydrophobicContact CD2-CB 4.03Å; L263-L267 HydrophobicContact CG-CD1 4.42Å; L263-L267 WeakPolarHBondContact O-CG 3.23Å; L263-L267 PolarHBondContact O-N 3.48Å; H264-L267 PolarHBondContact O-N 2.86Å; V265-L267 VanDerWaalsContact C-N 3.3Å; V265-L267 PolarHBondContact O-N 3.34Å; L267-R270 WeakPolarHBondContact O-CB 3.41Å; L267-R270 PolarHBondContact O-N 2.93Å; L267-L271 PolarHBondContact O-N 3.48Å; L267-L271 VanDerWaalsContact O-N 3.09Å; L267-L288 HydrophobicContact CD2-CD1 4.35Å; L267-L288 HydrophobicContact CD2-CD2 3.8Å; L267-L288 HydrophobicContact CG-CD2 3.92Å |
| 268 | T | 88.8 | Confident | 83.9 | Confident | 46 Ų | 46 | 48.2 Ų | 48.2 | 28% | 0.282 | 29% | 0.289 | S | S | . | . | H | α-helix | trans | -63.7 | -45.3 | 174 | -57.5 | 0 | 0 | 0 | 0 | 111.6 | L207 Y211 H264 V265 R270 L271 A272 | L207-T268 WeakPolarHBondContact CD2-OG1 3.21Å; Y211-T268 WeakPolarHBondContact CE2-OG1 3.26Å; Y211-T268 PolarHBondContact OH-OG1 3.34Å; H264-T268 PolarHBondContact O-N 3.5Å; H264-T268 PolarHBondContact O-OG1 2.87Å; V265-T268 WeakPolarHBondContact O-CB 3.46Å; V265-T268 PolarHBondContact O-N 3.42Å; V265-T268 VanDerWaalsContact O-N 3.15Å; T268-R270 VanDerWaalsContact C-N 3.28Å; T268-R270 PolarHBondContact O-N 2.82Å; T268-L271 WeakPolarHBondContact O-CB 3.47Å; T268-L271 PolarHBondContact O-N 3.27Å; T268-L271 VanDerWaalsContact O-N 3.11Å; T268-A272 WeakPolarHBondContact O-CB 3.2Å; T268-A272 PolarHBondContact O-N 2.82Å |
| 269 | V | 86.6 | Confident | 83.2 | Confident | 53 Ų | 53 | 48.6 Ų | 48.6 | 32% | 0.321 | 30% | 0.3 | S | S | . | . | H | α-helix | trans | -61 | -40.5 | 176.6 | 172 | 0 | 0 | 0 | 0 | 110.7 | V265 G266 L271 A272 V273 F280 L284 | V265-V269 HydrophobicContact CG1-CG2 4.46Å; V265-V269 WeakPolarHBondContact O-CG2 3.26Å; V265-V269 PolarHBondContact O-N 3.47Å; G266-V269 PolarHBondContact O-N 3.31Å; V269-L271 VanDerWaalsContact C-N 3.28Å; V269-L271 PolarHBondContact O-N 3.05Å; V269-A272 PolarHBondContact O-N 3.5Å; V269-V273 HydrophobicContact CG1-CG2 4.09Å; V269-V273 PolarHBondContact O-N 2.94Å; V269-F280 HydrophobicContact CG1-CE1 4.26Å; V269-F280 HydrophobicContact CG1-CZ 3.7Å; V269-L284 HydrophobicContact CB-CD1 4.43Å; V269-L284 HydrophobicContact CG1-CD1 4.19Å |
| 270 | R | 81.4 | Confident | 82.5 | Confident | 51 Ų | 51 | 52.2 Ų | 52.2 | 19% | 0.192 | 32% | 0.316 | C | S | . | . | H | α-helix | trans | -57.7 | -40.9 | 173.8 | -167.5 | 176.1 | 179.1 | -170.1 | -3.4 | 112.8 | H198 G266 L267 T268 L284 | H198-R270 PolarHBondContact CE1-NH2 3.22Å; H198-R270 VanDerWaalsContact CE1-NH2 3.31Å; G266-R270 PolarHBondContact O-N 2.83Å; L267-R270 WeakPolarHBondContact O-CB 3.41Å; L267-R270 PolarHBondContact O-N 2.93Å; T268-R270 VanDerWaalsContact C-N 3.28Å; T268-R270 PolarHBondContact O-N 2.82Å; R270-L284 HydrophobicContact CB-CD2 3.61Å; R270-L284 HydrophobicContact CB-CG 4.43Å; R270-L284 HydrophobicContact CG-CD2 3.8Å |
| 271 | L | 80.5 | Confident | 81.8 | Confident | 57 Ų | 57 | 52.7 Ų | 52.7 | 30% | 0.298 | 32% | 0.319 | S | S | . | . | H | α-helix | trans | -70.2 | -40.8 | 178.1 | -171.4 | 63.3 | 0 | 0 | 0 | 111.9 | F200 M203 L207 L267 T268 V269 | F200-L271 HydrophobicContact CD2-CD1 3.49Å; F200-L271 VanDerWaalsContact CD2-CD1 3.49Å; F200-L271 HydrophobicContact CD2-CD2 4.24Å; F200-L271 HydrophobicContact CD2-CG 4.12Å; F200-L271 HydrophobicContact CE2-CD1 3.85Å; F200-L271 HydrophobicContact CE2-CD2 3.75Å; F200-L271 HydrophobicContact CE2-CG 3.95Å; F200-L271 HydrophobicContact CG-CD1 4.35Å; F200-L271 HydrophobicContact CZ-CD2 4.33Å; M203-L271 HydrophobicContact CB-CD1 4.01Å; M203-L271 HydrophobicContact CB-CD2 4.29Å; M203-L271 HydrophobicContact CG-CD1 4.19Å; L207-L271 HydrophobicContact CD1-CD2 3.57Å; L267-L271 PolarHBondContact O-N 3.48Å; L267-L271 VanDerWaalsContact O-N 3.09Å; T268-L271 WeakPolarHBondContact O-CB 3.47Å; T268-L271 PolarHBondContact O-N 3.27Å; T268-L271 VanDerWaalsContact O-N 3.11Å; V269-L271 VanDerWaalsContact C-N 3.28Å; V269-L271 PolarHBondContact O-N 3.05Å |
| 272 | A | 81.8 | Confident | 81.2 | Confident | 82 Ų | 82 | 52.5 Ų | 52.5 | 68% | 0.678 | 32% | 0.317 | S | S | * | . | H | α-helix | trans | -77 | -40.2 | -172.1 | 0 | 0 | 0 | 0 | 0 | 114.2 | T268 V269 | T268-A272 WeakPolarHBondContact O-CB 3.2Å; T268-A272 PolarHBondContact O-N 2.82Å; V269-A272 PolarHBondContact O-N 3.5Å |
| 273 | V | 75.5 | Confident | 80.6 | Confident | 69 Ų | 69 | 56.1 Ų | 56.1 | 42% | 0.418 | 33% | 0.331 | S | S | . | . | H | α-helix | trans | -89.2 | -15.4 | -169.7 | -178.5 | 0 | 0 | 0 | 0 | 112.9 | V269 F280 | V269-V273 HydrophobicContact CG1-CG2 4.09Å; V269-V273 PolarHBondContact O-N 2.94Å; V273-F280 HydrophobicContact CB-CD1 4.45Å; V273-F280 HydrophobicContact CB-CE1 3.62Å; V273-F280 HydrophobicContact CB-CZ 4.09Å; V273-F280 HydrophobicContact CG1-CD1 3.8Å; V273-F280 HydrophobicContact CG1-CE1 3.37Å; V273-F280 HydrophobicContact CG1-CZ 3.88Å; V273-F280 HydrophobicContact CG2-CE1 4.01Å; V273-F280 HydrophobicContact CG2-CZ 3.96Å |
| 274 | G | 65.4 | Low | 80.2 | Confident | 27 Ų | 27 | 56.6 Ų | 56.6 | 28% | 0.278 | 33% | 0.334 | S | S | . | . | T | Hydrogen-bonded Turn | trans | 63.2 | -160 | -174.5 | 0 | 0 | 0 | 0 | 0 | 112.6 | ||
| 275 | W | 68.8 | Low | 79.8 | Confident | 92 Ų | 92 | 60.1 Ų | 60.1 | 35% | 0.348 | 35% | 0.347 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -113.4 | 30.6 | -168.2 | -66.9 | 78.1 | 0 | 0 | 0 | 113.6 | H198 A277 V281 | H198-W275 AromaticContact CD2-CE2 3.46Å; H198-W275 VanDerWaalsContact CD2-CE2 3.46Å; H198-W275 AromaticContact CD2-CZ2 3.53Å; H198-W275 AromaticContact CD2-NE1 3.49Å; H198-W275 PolarHBondContact CD2-NE1 3.37Å; H198-W275 AromaticContact CE1-CE2 3.94Å; H198-W275 AromaticContact CE1-CH2 3.62Å; H198-W275 AromaticContact CE1-CZ2 3.18Å; H198-W275 WeakPolarHBondContact CE1-CZ2 3.18Å; H198-W275 AromaticContact CG-CE2 3.94Å; H198-W275 AromaticContact CG-CZ2 3.88Å; H198-W275 AromaticContact CG-NE1 3.71Å; H198-W275 AromaticContact ND1-CZ2 3.65Å; H198-W275 AromaticContact NE2-CE2 3.46Å; H198-W275 AromaticContact NE2-CH2 3.4Å; H198-W275 WeakPolarHBondContact NE2-CH2 3.38Å; H198-W275 AromaticContact NE2-CZ2 3.05Å; H198-W275 WeakPolarHBondContact NE2-CZ2 3.29Å; H198-W275 AromaticContact NE2-NE1 3.99Å; W275-A277 PolarHBondContact O-N 3.33Å; W275-V281 HydrophobicContact CB-CG2 4.5Å; W275-V281 HydrophobicContact CD2-CG2 4.28Å; W275-V281 HydrophobicContact CE3-CB 4.32Å; W275-V281 HydrophobicContact CE3-CG1 3.61Å; W275-V281 HydrophobicContact CE3-CG2 3.67Å; W275-V281 HydrophobicContact CH2-CG1 4.33Å; W275-V281 HydrophobicContact CZ3-CB 4.48Å; W275-V281 HydrophobicContact CZ3-CG1 3.35Å; W275-V281 HydrophobicContact CZ3-CG2 4.28Å |
| 276 | N | 64.7 | Low | 79.6 | Confident | 155 Ų | 155 | 59.9 Ų | 59.9 | 83% | 0.829 | 34% | 0.339 | S | S | * | . | trans | -81.5 | -14.5 | -163.5 | -60.3 | -27.9 | 0 | 0 | 0 | 114.5 | ||||
| 277 | A | 74.5 | Confident | 79.5 | Confident | 52 Ų | 52 | 62.3 Ų | 62.3 | 43% | 0.43 | 35% | 0.353 | S | S | . | . | trans | -136.5 | 119.5 | 179.2 | 0 | 0 | 0 | 0 | 0 | 112.1 | W275 A279 F280 V281 | W275-A277 PolarHBondContact O-N 3.33Å; A277-A279 VanDerWaalsContact C-N 3.35Å; A277-A279 PolarHBondContact O-N 3.31Å; A277-F280 HydrophobicContact CB-CB 4Å; A277-F280 WeakPolarHBondContact O-CB 3.29Å; A277-F280 PolarHBondContact O-N 3.24Å; A277-V281 WeakPolarHBondContact O-CG2 3.38Å; A277-V281 PolarHBondContact O-N 3.22Å | ||
| 278 | C | 73.8 | Confident | 79.6 | Confident | 54 Ų | 54 | 62.2 Ų | 62.2 | 37% | 0.365 | 35% | 0.353 | S | S | . | . | H | α-helix | trans | -61.5 | -38.3 | -175.8 | -60 | 0 | 0 | 0 | 0 | 114 | C38 F280 V281 E282 | C38-C278 WeakPolarHBondContact CA-SG 3.36Å; C38-C278 HydrophobicContact CB-CB 3.79Å; C38-C278 WeakPolarHBondContact CB-SG 3.38Å; C38-C278 WeakPolarHBondContact SG-CA 3.39Å; C38-C278 WeakPolarHBondContact SG-CB 3.33Å; C38-C278 CovalentContact SG-SG 2.03Å; C38-C278 PolarHBondContact SG-SG 2.96Å; C278-F280 VanDerWaalsContact C-N 3.27Å; C278-F280 PolarHBondContact O-N 2.86Å; C278-V281 PolarHBondContact O-N 2.88Å; C278-E282 PolarHBondContact O-N 3.47Å |
| 279 | A | 75.7 | Confident | 79.5 | Confident | 84 Ų | 84 | 62.5 Ų | 62.5 | 69% | 0.694 | 35% | 0.35 | S | S | * | . | H | α-helix | trans | -61.7 | -38.2 | 175.4 | 0 | 0 | 0 | 0 | 0 | 111.8 | A277 M283 | A277-A279 VanDerWaalsContact C-N 3.35Å; A277-A279 PolarHBondContact O-N 3.31Å; A279-M283 WeakPolarHBondContact O-CB 3.49Å; A279-M283 PolarHBondContact O-N 2.87Å |
| 280 | F | 80.1 | Confident | 79.7 | Confident | 76 Ų | 76 | 63.3 Ų | 63.3 | 33% | 0.333 | 35% | 0.352 | S | S | . | . | H | α-helix | trans | -70.2 | -40.9 | 177.4 | -174.2 | -98.6 | 0 | 0 | 0 | 111.8 | V269 V273 A277 C278 E282 M283 L284 | V269-F280 HydrophobicContact CG1-CE1 4.26Å; V269-F280 HydrophobicContact CG1-CZ 3.7Å; V273-F280 HydrophobicContact CB-CD1 4.45Å; V273-F280 HydrophobicContact CB-CE1 3.62Å; V273-F280 HydrophobicContact CB-CZ 4.09Å; V273-F280 HydrophobicContact CG1-CD1 3.8Å; V273-F280 HydrophobicContact CG1-CE1 3.37Å; V273-F280 HydrophobicContact CG1-CZ 3.88Å; V273-F280 HydrophobicContact CG2-CE1 4.01Å; V273-F280 HydrophobicContact CG2-CZ 3.96Å; A277-F280 HydrophobicContact CB-CB 4Å; A277-F280 WeakPolarHBondContact O-CB 3.29Å; A277-F280 PolarHBondContact O-N 3.24Å; C278-F280 VanDerWaalsContact C-N 3.27Å; C278-F280 PolarHBondContact O-N 2.86Å; F280-E282 VanDerWaalsContact C-N 3.34Å; F280-E282 PolarHBondContact O-N 3.47Å; F280-M283 PolarHBondContact O-N 3.42Å; F280-L284 HydrophobicContact CE1-CD2 4.26Å; F280-L284 VanDerWaalsContact O-CB 3.22Å; F280-L284 WeakPolarHBondContact O-CB 3.49Å; F280-L284 PolarHBondContact O-N 2.97Å |
| 281 | V | 78.8 | Confident | 80.2 | Confident | 11 Ų | 11 | 61.4 Ų | 61.4 | 7% | 0.067 | 35% | 0.346 | C | S | . | . | H | α-helix | trans | -60.4 | -43.4 | 175.6 | 170.4 | 0 | 0 | 0 | 0 | 111.5 | W275 A277 C278 L284 R285 | W275-V281 HydrophobicContact CB-CG2 4.5Å; W275-V281 HydrophobicContact CD2-CG2 4.28Å; W275-V281 HydrophobicContact CE3-CB 4.32Å; W275-V281 HydrophobicContact CE3-CG1 3.61Å; W275-V281 HydrophobicContact CE3-CG2 3.67Å; W275-V281 HydrophobicContact CH2-CG1 4.33Å; W275-V281 HydrophobicContact CZ3-CB 4.48Å; W275-V281 HydrophobicContact CZ3-CG1 3.35Å; W275-V281 HydrophobicContact CZ3-CG2 4.28Å; A277-V281 WeakPolarHBondContact O-CG2 3.38Å; A277-V281 PolarHBondContact O-N 3.22Å; C278-V281 PolarHBondContact O-N 2.88Å; V281-L284 PolarHBondContact O-N 2.72Å; V281-R285 WeakPolarHBondContact O-CB 3.44Å; V281-R285 PolarHBondContact O-N 3.22Å |
| 282 | E | 80.3 | Confident | 80.7 | Confident | 45 Ų | 45 | 59.7 Ų | 59.7 | 21% | 0.21 | 34% | 0.339 | C | S | . | . | H | α-helix | trans | -69.8 | -42.5 | 178.9 | -179.8 | 58.2 | -165 | 0 | 0 | 112.1 | L43 C278 F280 L284 R285 R286 | L43-E282 WeakPolarHBondContact CD1-OE1 3.25Å; C278-E282 PolarHBondContact O-N 3.47Å; F280-E282 VanDerWaalsContact C-N 3.34Å; F280-E282 PolarHBondContact O-N 3.47Å; E282-L284 VanDerWaalsContact C-N 3.29Å; E282-L284 PolarHBondContact O-N 2.95Å; E282-R285 PolarHBondContact O-N 3.48Å; E282-R285 IonicContact OE2-CZ 2.65Å; E282-R285 IonicContact OE2-NH1 2.62Å; E282-R285 PolarHBondContact OE2-NH1 3.36Å; E282-R286 WeakPolarHBondContact O-CG 3.3Å; E282-R286 PolarHBondContact O-N 3.44Å; E282-R286 IonicContact OE1-CZ 3.69Å; E282-R286 VanDerWaalsContact OE1-CZ 3.28Å; E282-R286 IonicContact OE1-NE 3.34Å; E282-R286 PolarHBondContact OE1-NE 3.07Å; E282-R286 IonicContact OE1-NH2 2.81Å; E282-R286 PolarHBondContact OE1-NH2 3.08Å |
| 283 | M | 83.5 | Confident | 81.1 | Confident | 121 Ų | 121 | 56.6 Ų | 56.6 | 60% | 0.596 | 31% | 0.31 | S | S | * | . | H | α-helix | trans | -55.4 | -48 | 171.7 | -178.6 | 66.3 | 78 | 0 | 0 | 110.7 | A279 F280 R285 R286 T287 | A279-M283 WeakPolarHBondContact O-CB 3.49Å; A279-M283 PolarHBondContact O-N 2.87Å; F280-M283 PolarHBondContact O-N 3.42Å; M283-R285 PolarHBondContact O-N 2.97Å; M283-R286 WeakPolarHBondContact O-CB 3.41Å; M283-R286 PolarHBondContact O-N 3.09Å; M283-T287 PolarHBondContact O-N 2.93Å; M283-T287 PolarHBondContact O-OG1 2.03Å; M283-T287 VanDerWaalsContact O-OG1 3.11Å |
| 284 | L | 84.3 | Confident | 81.9 | Confident | 18 Ų | 18 | 56.3 Ų | 56.3 | 9% | 0.094 | 31% | 0.306 | C | S | . | . | H | α-helix | trans | -65 | -38.5 | -178.9 | -174.8 | 60.9 | 0 | 0 | 0 | 112.6 | V269 R270 F280 V281 E282 R286 T287 L288 | V269-L284 HydrophobicContact CB-CD1 4.43Å; V269-L284 HydrophobicContact CG1-CD1 4.19Å; R270-L284 HydrophobicContact CB-CD2 3.61Å; R270-L284 HydrophobicContact CB-CG 4.43Å; R270-L284 HydrophobicContact CG-CD2 3.8Å; F280-L284 HydrophobicContact CE1-CD2 4.26Å; F280-L284 VanDerWaalsContact O-CB 3.22Å; F280-L284 WeakPolarHBondContact O-CB 3.49Å; F280-L284 PolarHBondContact O-N 2.97Å; V281-L284 PolarHBondContact O-N 2.72Å; E282-L284 VanDerWaalsContact C-N 3.29Å; E282-L284 PolarHBondContact O-N 2.95Å; L284-R286 VanDerWaalsContact C-N 3.33Å; L284-R286 PolarHBondContact O-N 3.24Å; L284-T287 PolarHBondContact O-N 2.88Å; L284-L288 HydrophobicContact CG-CD1 4.29Å; L284-L288 WeakPolarHBondContact O-CB 3.44Å; L284-L288 VanDerWaalsContact O-CG 3.28Å; L284-L288 WeakPolarHBondContact O-CG 3.41Å; L284-L288 PolarHBondContact O-N 3.06Å |
| 285 | R | 83.6 | Confident | 83.3 | Confident | 74 Ų | 74 | 55.3 Ų | 55.3 | 28% | 0.279 | 29% | 0.294 | S | S | . | . | H | α-helix | trans | -60.8 | -42.7 | 173.4 | -173 | -175.9 | -71 | 144.4 | -10.5 | 111.3 | S41 L43 V281 E282 M283 L288 F289 | S41-R285 PolarHBondContact O-NH1 3.31Å; L43-R285 HydrophobicContact CD1-CB 4.47Å; L43-R285 HydrophobicContact CD1-CG 4.09Å; L43-R285 HydrophobicContact CD2-CG 4.45Å; V281-R285 WeakPolarHBondContact O-CB 3.44Å; V281-R285 PolarHBondContact O-N 3.22Å; E282-R285 PolarHBondContact O-N 3.48Å; E282-R285 IonicContact OE2-CZ 2.65Å; E282-R285 IonicContact OE2-NH1 2.62Å; E282-R285 PolarHBondContact OE2-NH1 3.36Å; M283-R285 PolarHBondContact O-N 2.97Å; R285-L288 PolarHBondContact O-N 3.49Å; R285-F289 WeakPolarHBondContact O-CB 3.06Å; R285-F289 PolarHBondContact O-N 3.28Å |
| 286 | R | 86.6 | Confident | 84.4 | Confident | 62 Ų | 62 | 51.2 Ų | 51.2 | 23% | 0.234 | 28% | 0.279 | C | S | . | . | H | α-helix | trans | -63.7 | -46.2 | 174.8 | -69.4 | 178.1 | -172.2 | -91.4 | -7.9 | 111.6 | L43 T44 W45 E282 M283 L284 L288 F289 I290 | L43-R286 HydrophobicContact CD1-CB 4.46Å; L43-R286 HydrophobicContact CD1-CG 3.37Å; L43-R286 HydrophobicContact CG-CG 4.42Å; T44-R286 PolarHBondContact O-NH1 3.42Å; T44-R286 VanDerWaalsContact O-NH1 3.17Å; T44-R286 PolarHBondContact O-NH2 3.37Å; T44-R286 VanDerWaalsContact O-NH2 3.13Å; W45-R286 HydrophobicContact CH2-CB 3.86Å; W45-R286 HydrophobicContact CH2-CG 3.76Å; W45-R286 HydrophobicContact CZ2-CB 3.91Å; W45-R286 HydrophobicContact CZ2-CG 3.72Å; E282-R286 WeakPolarHBondContact O-CG 3.3Å; E282-R286 PolarHBondContact O-N 3.44Å; E282-R286 IonicContact OE1-CZ 3.69Å; E282-R286 VanDerWaalsContact OE1-CZ 3.28Å; E282-R286 IonicContact OE1-NE 3.34Å; E282-R286 PolarHBondContact OE1-NE 3.07Å; E282-R286 IonicContact OE1-NH2 2.81Å; E282-R286 PolarHBondContact OE1-NH2 3.08Å; M283-R286 WeakPolarHBondContact O-CB 3.41Å; M283-R286 PolarHBondContact O-N 3.09Å; L284-R286 VanDerWaalsContact C-N 3.33Å; L284-R286 PolarHBondContact O-N 3.24Å; R286-L288 PolarHBondContact O-N 3.31Å; R286-F289 PolarHBondContact O-N 3.38Å; R286-I290 WeakPolarHBondContact O-CG1 3.06Å; R286-I290 PolarHBondContact O-N 2.76Å |
| 287 | T | 88.5 | Confident | 85.8 | Confident | 55 Ų | 55 | 44.7 Ų | 44.7 | 34% | 0.337 | 25% | 0.246 | S | C | . | . | H | α-helix | trans | -59.5 | -45.9 | 177 | -60 | 0 | 0 | 0 | 0 | 111.4 | M283 L284 F289 I290 T291 | M283-T287 PolarHBondContact O-N 2.93Å; M283-T287 PolarHBondContact O-OG1 2.03Å; M283-T287 VanDerWaalsContact O-OG1 3.11Å; L284-T287 PolarHBondContact O-N 2.88Å; T287-F289 VanDerWaalsContact C-N 3.33Å; T287-F289 PolarHBondContact O-N 3.04Å; T287-I290 PolarHBondContact O-N 3.36Å; T287-T291 HydrophobicContact CG2-CG2 4.15Å; T287-T291 WeakPolarHBondContact O-CB 3.42Å; T287-T291 VanDerWaalsContact O-CG2 3.27Å; T287-T291 WeakPolarHBondContact O-CG2 3.2Å; T287-T291 PolarHBondContact O-N 3.16Å; T287-T291 PolarHBondContact O-OG1 3.31Å |
| 288 | L | 87.7 | Confident | 86.7 | Confident | 23 Ų | 23 | 42.2 Ų | 42.2 | 12% | 0.12 | 23% | 0.226 | C | C | . | . | H | α-helix | trans | -63.1 | -38.9 | 177.1 | -73.1 | 173.2 | 0 | 0 | 0 | 112.1 | L263 L267 L284 R285 R286 T291 S292 | L263-L288 HydrophobicContact CD1-CD2 3.95Å; L267-L288 HydrophobicContact CD2-CD1 4.35Å; L267-L288 HydrophobicContact CD2-CD2 3.8Å; L267-L288 HydrophobicContact CG-CD2 3.92Å; L284-L288 HydrophobicContact CG-CD1 4.29Å; L284-L288 WeakPolarHBondContact O-CB 3.44Å; L284-L288 VanDerWaalsContact O-CG 3.28Å; L284-L288 WeakPolarHBondContact O-CG 3.41Å; L284-L288 PolarHBondContact O-N 3.06Å; R285-L288 PolarHBondContact O-N 3.49Å; R286-L288 PolarHBondContact O-N 3.31Å; L288-T291 WeakPolarHBondContact CA-OG1 3.04Å; L288-T291 PolarHBondContact O-OG1 2.98Å; L288-S292 WeakPolarHBondContact O-CB 3.24Å; L288-S292 PolarHBondContact O-N 2.76Å |
| 289 | F | 87.4 | Confident | 87.7 | Confident | 51 Ų | 51 | 39.8 Ų | 39.8 | 22% | 0.224 | 21% | 0.209 | C | C | . | . | H | α-helix | trans | -62.8 | -52.2 | 175.1 | -176.1 | -87.1 | 0 | 0 | 0 | 111.3 | L43 W45 F53 R285 R286 T287 S292 K293 | L43-F289 HydrophobicContact CD2-CB 3.74Å; L43-F289 HydrophobicContact CD2-CD2 4.04Å; L43-F289 HydrophobicContact CD2-CG 3.85Å; W45-F289 HydrophobicContact CZ2-CD1 4.36Å; W45-F289 AromaticContact NE1-CD1 4Å; F53-F289 HydrophobicContact CD1-CE1 4.04Å; F53-F289 AromaticContact CD2-CE1 3.7Å; F53-F289 HydrophobicContact CD2-CE1 3.7Å; F53-F289 HydrophobicContact CD2-CZ 4.3Å; F53-F289 HydrophobicContact CE1-CD1 4.36Å; F53-F289 AromaticContact CE1-CE1 3.87Å; F53-F289 HydrophobicContact CE1-CE1 3.87Å; F53-F289 HydrophobicContact CE2-CD1 4.11Å; F53-F289 AromaticContact CE2-CE1 3.49Å; F53-F289 HydrophobicContact CE2-CE1 3.49Å; F53-F289 VanDerWaalsContact CE2-CE1 3.49Å; F53-F289 HydrophobicContact CE2-CZ 4.45Å; F53-F289 AromaticContact CG-CE1 3.98Å; F53-F289 HydrophobicContact CG-CE1 3.98Å; F53-F289 AromaticContact CZ-CD1 3.93Å; F53-F289 HydrophobicContact CZ-CD1 3.93Å; F53-F289 AromaticContact CZ-CE1 3.6Å; F53-F289 HydrophobicContact CZ-CE1 3.6Å; R285-F289 WeakPolarHBondContact O-CB 3.06Å; R285-F289 PolarHBondContact O-N 3.28Å; R286-F289 PolarHBondContact O-N 3.38Å; T287-F289 VanDerWaalsContact C-N 3.33Å; T287-F289 PolarHBondContact O-N 3.04Å; F289-S292 WeakPolarHBondContact O-CB 3.4Å; F289-S292 PolarHBondContact O-N 3.34Å; F289-K293 HydrophobicContact CD1-CG 4.44Å; F289-K293 HydrophobicContact CE1-CG 4.1Å; F289-K293 WeakPolarHBondContact O-CG 3.05Å; F289-K293 PolarHBondContact O-N 2.88Å; F289-K293 VanDerWaalsContact O-N 3.12Å |
| 290 | I | 90.4 | Very high | 88.6 | Confident | 70 Ų | 70 | 36.5 Ų | 36.5 | 36% | 0.359 | 18% | 0.181 | S | C | . | . | H | α-helix | trans | -61.8 | -48.2 | -179 | -67.2 | 166 | 0 | 0 | 0 | 110.8 | W45 F53 R286 T287 S292 K293 I294 | W45-I290 HydrophobicContact CH2-CD1 3.98Å; W45-I290 HydrophobicContact CH2-CG1 4.37Å; W45-I290 HydrophobicContact CZ2-CG1 4.47Å; F53-I290 HydrophobicContact CZ-CG1 4.32Å; R286-I290 WeakPolarHBondContact O-CG1 3.06Å; R286-I290 PolarHBondContact O-N 2.76Å; T287-I290 PolarHBondContact O-N 3.36Å; I290-S292 VanDerWaalsContact C-N 3.29Å; I290-S292 PolarHBondContact O-N 3.39Å; I290-K293 WeakPolarHBondContact O-CA 3.18Å; I290-K293 WeakPolarHBondContact O-CB 3.4Å; I290-K293 PolarHBondContact O-N 3.42Å; I290-I294 HydrophobicContact CG2-CD1 4.3Å; I290-I294 PolarHBondContact O-N 2.99Å |
| 291 | T | 92.8 | Very high | 89.2 | Confident | 11 Ų | 11 | 35.6 Ų | 35.6 | 7% | 0.067 | 18% | 0.18 | C | C | . | . | H | α-helix | trans | -66.4 | -31.1 | -179.7 | 53.4 | 0 | 0 | 0 | 0 | 112.3 | P262 L263 T287 L288 K293 I294 S295 | P262-T291 HydrophobicContact CB-CG2 3.49Å; P262-T291 VanDerWaalsContact CB-CG2 3.49Å; L263-T291 WeakPolarHBondContact CA-OG1 3.31Å; T287-T291 HydrophobicContact CG2-CG2 4.15Å; T287-T291 WeakPolarHBondContact O-CB 3.42Å; T287-T291 VanDerWaalsContact O-CG2 3.27Å; T287-T291 WeakPolarHBondContact O-CG2 3.2Å; T287-T291 PolarHBondContact O-N 3.16Å; T287-T291 PolarHBondContact O-OG1 3.31Å; L288-T291 WeakPolarHBondContact CA-OG1 3.04Å; L288-T291 PolarHBondContact O-OG1 2.98Å; T291-K293 VanDerWaalsContact C-N 3.3Å; T291-K293 PolarHBondContact O-N 2.9Å; T291-I294 PolarHBondContact O-N 3.22Å; T291-S295 PolarHBondContact O-N 3.35Å |
| 292 | S | 89.7 | Confident | 89.7 | Confident | 22 Ų | 22 | 35.1 Ų | 35.1 | 15% | 0.154 | 18% | 0.177 | C | C | . | . | H | α-helix | trans | -63.9 | -35.6 | 169.4 | -164.4 | 0 | 0 | 0 | 0 | 112 | Y126 R130 L288 F289 I290 S295 D296 | Y126-S292 PolarHBondContact OH-O 3.02Å; Y126-S292 PolarHBondContact OH-OG 3.38Å; R130-S292 PolarHBondContact NH2-OG 2.65Å; L288-S292 WeakPolarHBondContact O-CB 3.24Å; L288-S292 PolarHBondContact O-N 2.76Å; F289-S292 WeakPolarHBondContact O-CB 3.4Å; F289-S292 PolarHBondContact O-N 3.34Å; I290-S292 VanDerWaalsContact C-N 3.29Å; I290-S292 PolarHBondContact O-N 3.39Å; S292-S295 WeakPolarHBondContact O-CB 3.42Å; S292-S295 PolarHBondContact O-N 2.96Å; S292-D296 PolarHBondContact O-N 3.36Å; S292-D296 VanDerWaalsContact O-N 3.17Å |
| 293 | K | 90.4 | Very high | 90 | Very high | 16 Ų | 16 | 34 Ų | 34 | 7% | 0.07 | 18% | 0.175 | C | C | . | . | H | α-helix | trans | -70 | -37.3 | 173.9 | -61.2 | -47.7 | 176.1 | -174.5 | 0 | 112.7 | F53 Y56 L57 F289 I290 T291 S295 D296 | F53-K293 HydrophobicContact CD1-CG 4.22Å; F53-K293 HydrophobicContact CE1-CG 4.35Å; Y56-K293 HydrophobicContact CE1-CB 4.07Å; Y56-K293 WeakPolarHBondContact CE1-O 3.4Å; Y56-K293 PolarHBondContact OH-O 3.4Å; L57-K293 HydrophobicContact CD2-CD 4.25Å; F289-K293 HydrophobicContact CD1-CG 4.44Å; F289-K293 HydrophobicContact CE1-CG 4.1Å; F289-K293 WeakPolarHBondContact O-CG 3.05Å; F289-K293 PolarHBondContact O-N 2.88Å; F289-K293 VanDerWaalsContact O-N 3.12Å; I290-K293 WeakPolarHBondContact O-CA 3.18Å; I290-K293 WeakPolarHBondContact O-CB 3.4Å; I290-K293 PolarHBondContact O-N 3.42Å; T291-K293 VanDerWaalsContact C-N 3.3Å; T291-K293 PolarHBondContact O-N 2.9Å; K293-S295 VanDerWaalsContact C-N 3.26Å; K293-S295 PolarHBondContact O-N 2.87Å; K293-D296 WeakPolarHBondContact CD-OD2 2.86Å; K293-D296 IonicContact NZ-OD2 3.06Å; K293-D296 PolarHBondContact NZ-OD2 3.43Å; K293-D296 WeakPolarHBondContact O-CB 3.34Å; K293-D296 PolarHBondContact O-N 3.18Å |
| 294 | I | 93.6 | Very high | 90.2 | Very high | 64 Ų | 64 | 31.5 Ų | 31.5 | 33% | 0.328 | 16% | 0.164 | S | C | . | . | H | α-helix | trans | -59.9 | -40.6 | 170.6 | -63 | 171 | 0 | 0 | 0 | 110.6 | V258 I290 T291 D296 A297 | V258-I294 HydrophobicContact CG1-CG2 4.48Å; V258-I294 VanDerWaalsContact O-CG2 3.28Å; V258-I294 WeakPolarHBondContact O-CG2 3.33Å; I290-I294 HydrophobicContact CG2-CD1 4.3Å; I290-I294 PolarHBondContact O-N 2.99Å; T291-I294 PolarHBondContact O-N 3.22Å; I294-D296 PolarHBondContact O-N 3.13Å; I294-A297 VanDerWaalsContact O-CB 3.23Å; I294-A297 WeakPolarHBondContact O-CB 3.18Å; I294-A297 PolarHBondContact O-N 3.36Å; I294-A297 VanDerWaalsContact O-N 3.15Å |
| 295 | S | 93.4 | Very high | 90.2 | Very high | 5 Ų | 5 | 30.8 Ų | 30.8 | 4% | 0.035 | 16% | 0.16 | C | C | . | . | H | α-helix | trans | -61.8 | -30.1 | 174.2 | 175.2 | 0 | 0 | 0 | 0 | 113.2 | R130 C259 T291 S292 K293 A297 N298 | R130-S295 PolarHBondContact NE-OG 2.83Å; R130-S295 PolarHBondContact NH2-OG 2.62Å; C259-S295 WeakPolarHBondContact O-CA 3.36Å; C259-S295 WeakPolarHBondContact O-CB 3.32Å; C259-S295 PolarHBondContact O-N 3.49Å; T291-S295 PolarHBondContact O-N 3.35Å; S292-S295 WeakPolarHBondContact O-CB 3.42Å; S292-S295 PolarHBondContact O-N 2.96Å; K293-S295 VanDerWaalsContact C-N 3.26Å; K293-S295 PolarHBondContact O-N 2.87Å; S295-A297 PolarHBondContact O-N 3.11Å; S295-N298 VanDerWaalsContact O-CB 3.3Å; S295-N298 WeakPolarHBondContact O-CB 3.29Å; S295-N298 PolarHBondContact O-N 2.97Å |
| 296 | D | 91.7 | Very high | 90.4 | Very high | 7 Ų | 7 | 27.8 Ų | 27.8 | 4% | 0.037 | 15% | 0.149 | C | C | . | . | H | α-helix | trans | -66.5 | -25.6 | 177.6 | -62 | -16.8 | 0 | 0 | 0 | 111.5 | L60 Y126 S292 K293 I294 N298 C299 | L60-D296 HydrophobicContact CD1-CB 3.68Å; Y126-D296 WeakPolarHBondContact CE2-OD1 3.32Å; Y126-D296 PolarHBondContact OH-OD1 2.89Å; S292-D296 PolarHBondContact O-N 3.36Å; S292-D296 VanDerWaalsContact O-N 3.17Å; K293-D296 WeakPolarHBondContact CD-OD2 2.86Å; K293-D296 IonicContact NZ-OD2 3.06Å; K293-D296 PolarHBondContact NZ-OD2 3.43Å; K293-D296 WeakPolarHBondContact O-CB 3.34Å; K293-D296 PolarHBondContact O-N 3.18Å; I294-D296 PolarHBondContact O-N 3.13Å; D296-N298 PolarHBondContact O-N 3.44Å; D296-N298 VanDerWaalsContact O-N 3.11Å; D296-C299 PolarHBondContact O-SG 2.87Å |
| 297 | A | 94.6 | Very high | 90.4 | Very high | 17 Ų | 17 | 31.3 Ų | 31.3 | 14% | 0.14 | 16% | 0.163 | C | C | . | . | T | Hydrogen-bonded Turn | trans | -61.9 | -18.6 | 176.4 | 0 | 0 | 0 | 0 | 0 | 113.6 | Y56 I294 S295 C299 C300 L301 | Y56-A297 WeakPolarHBondContact OH-CB 3.39Å; I294-A297 VanDerWaalsContact O-CB 3.23Å; I294-A297 WeakPolarHBondContact O-CB 3.18Å; I294-A297 PolarHBondContact O-N 3.36Å; I294-A297 VanDerWaalsContact O-N 3.15Å; S295-A297 PolarHBondContact O-N 3.11Å; A297-C299 PolarHBondContact O-N 3.05Å; A297-C300 PolarHBondContact O-N 2.03Å; A297-L301 HydrophobicContact CB-CD1 4.08Å; A297-L301 WeakPolarHBondContact O-CG 3.39Å; A297-L301 PolarHBondContact O-N 3.16Å |
| 298 | N | 94.4 | Very high | 90.2 | Very high | 1 Ų | 1 | 30 Ų | 30 | 1% | 0.005 | 15% | 0.152 | C | C | . | . | H | α-helix | trans | -52.5 | -43.2 | -177.9 | -173.9 | 80 | 0 | 0 | 0 | 112 | S133 C259 F260 S295 D296 C300 L301 D302 | S133-N298 WeakPolarHBondContact CB-ND2 3.4Å; C259-N298 HydrophobicContact CB-CB 4.05Å; F260-N298 HydrophobicContact CE1-CB 4.34Å; F260-N298 WeakPolarHBondContact CE2-OD1 3.3Å; F260-N298 HydrophobicContact CZ-CB 3.87Å; F260-N298 VanDerWaalsContact CZ-CG 3.4Å; F260-N298 WeakPolarHBondContact CZ-OD1 3.41Å; S295-N298 VanDerWaalsContact O-CB 3.3Å; S295-N298 WeakPolarHBondContact O-CB 3.29Å; S295-N298 PolarHBondContact O-N 2.97Å; D296-N298 PolarHBondContact O-N 3.44Å; D296-N298 VanDerWaalsContact O-N 3.11Å; N298-C300 PolarHBondContact O-N 2.92Å; N298-L301 PolarHBondContact O-N 2.86Å; N298-L301 VanDerWaalsContact O-N 3.07Å; N298-D302 PolarHBondContact ND2-OD2 2.95Å; N298-D302 PolarHBondContact O-N 2.78Å |
| 299 | C | 94 | Very high | 90 | Very high | 2 Ų | 2 | 29.1 Ų | 29.1 | 1% | 0.014 | 15% | 0.147 | C | C | . | . | H | α-helix | trans | -61.2 | -21.3 | -178.1 | 68.8 | 0 | 0 | 0 | 0 | 113.9 | N68 D96 L99 D296 A297 | N68-C299 PolarHBondContact ND2-O 2.91Å; D96-C299 HydrophobicContact CB-CB 3.91Å; L99-C299 HydrophobicContact CD2-CB 4.39Å; D296-C299 PolarHBondContact O-SG 2.87Å; A297-C299 PolarHBondContact O-N 3.05Å |
| 300 | C | 94.8 | Very high | 89.8 | Confident | 15 Ų | 15 | 28 Ų | 28 | 10% | 0.101 | 15% | 0.147 | C | C | . | . | H | α-helix | trans | -96.1 | -37.2 | 174.1 | -67 | 0 | 0 | 0 | 0 | 111.6 | L60 L63 A297 N298 D302 A303 | L60-C300 HydrophobicContact CD2-CB 4.36Å; L63-C300 HydrophobicContact CD2-CB 4.41Å; A297-C300 PolarHBondContact O-N 2.03Å; N298-C300 PolarHBondContact O-N 2.92Å; C300-D302 PolarHBondContact O-N 2.89Å; C300-A303 WeakPolarHBondContact O-CB 3.47Å; C300-A303 PolarHBondContact O-N 3.14Å; C300-A303 VanDerWaalsContact O-N 3.16Å |
| 301 | L | 93.4 | Very high | 89.4 | Confident | 57 Ų | 57 | 27.7 Ų | 27.7 | 30% | 0.298 | 14% | 0.144 | S | C | . | . | H | α-helix | trans | -69.7 | -22.3 | -178 | -70 | 173.7 | 0 | 0 | 0 | 112.8 | V255 C259 A297 N298 A303 I304 | V255-L301 HydrophobicContact CG1-CB 3.75Å; V255-L301 HydrophobicContact CG1-CD1 4.5Å; V255-L301 HydrophobicContact CG2-CB 4.06Å; C259-L301 VanDerWaalsContact SG-CD1 3.57Å; A297-L301 HydrophobicContact CB-CD1 4.08Å; A297-L301 WeakPolarHBondContact O-CG 3.39Å; A297-L301 PolarHBondContact O-N 3.16Å; N298-L301 PolarHBondContact O-N 2.86Å; N298-L301 VanDerWaalsContact O-N 3.07Å; L301-A303 PolarHBondContact O-N 2.9Å; L301-A303 VanDerWaalsContact O-N 3.14Å; L301-I304 HydrophobicContact CD2-CD1 4.13Å; L301-I304 WeakPolarHBondContact O-CB 3.49Å; L301-I304 WeakPolarHBondContact O-CG1 3.47Å; L301-I304 PolarHBondContact O-N 3.1Å |
| 302 | D | 89.4 | Confident | 88.7 | Confident | 1 Ų | 1 | 30 Ų | 30 | 1% | 0.005 | 15% | 0.153 | C | C | . | . | H | α-helix | trans | -61.3 | -18.1 | 171.5 | -75.2 | -31.3 | 0 | 0 | 0 | 113.1 | L92 N298 C300 I304 C305 Y306 | L92-D302 HydrophobicContact CD2-CB 4.05Å; L92-D302 HydrophobicContact CG-CB 4.45Å; N298-D302 PolarHBondContact ND2-OD2 2.95Å; N298-D302 PolarHBondContact O-N 2.78Å; C300-D302 PolarHBondContact O-N 2.89Å; D302-I304 PolarHBondContact O-N 3.12Å; D302-C305 WeakPolarHBondContact O-CA 3.48Å; D302-C305 WeakPolarHBondContact O-CB 3.49Å; D302-C305 PolarHBondContact O-N 3.33Å; D302-Y306 HydrophobicContact CB-CE1 4.39Å; D302-Y306 HydrophobicContact CB-CE2 4.45Å; D302-Y306 WeakPolarHBondContact O-CD1 3.46Å; D302-Y306 PolarHBondContact O-N 3.37Å; D302-Y306 VanDerWaalsContact O-N 3.12Å |
| 303 | A | 86.7 | Confident | 88.2 | Confident | 22 Ų | 22 | 31.5 Ų | 31.5 | 18% | 0.182 | 16% | 0.158 | C | C | . | . | H | α-helix | trans | -61.1 | -26.6 | 170.8 | 0 | 0 | 0 | 0 | 0 | 113.8 | L67 C300 L301 C305 Y306 Y307 | L67-A303 HydrophobicContact CB-CB 4.18Å; L67-A303 HydrophobicContact CD1-CB 3.76Å; L67-A303 HydrophobicContact CD2-CB 4.17Å; L67-A303 HydrophobicContact CG-CB 4.26Å; C300-A303 WeakPolarHBondContact O-CB 3.47Å; C300-A303 PolarHBondContact O-N 3.14Å; C300-A303 VanDerWaalsContact O-N 3.16Å; L301-A303 PolarHBondContact O-N 2.9Å; L301-A303 VanDerWaalsContact O-N 3.14Å; A303-C305 VanDerWaalsContact C-N 3.29Å; A303-C305 PolarHBondContact O-N 3.32Å; A303-Y306 HydrophobicContact CB-CD2 4.4Å; A303-Y306 PolarHBondContact O-N 3.5Å; A303-Y307 PolarHBondContact O-N 2.82Å |
| 304 | I | 87.1 | Confident | 87.8 | Confident | 69 Ų | 69 | 37.1 Ų | 37.1 | 35% | 0.354 | 18% | 0.184 | S | C | . | . | H | α-helix | trans | -62.6 | -42.9 | 173.2 | -60.8 | 171.6 | 0 | 0 | 0 | 109.5 | A251 V255 L301 D302 Y306 Y307 Y308 | A251-I304 HydrophobicContact CB-CG2 3.91Å; V255-I304 HydrophobicContact CG2-CD1 4.32Å; L301-I304 HydrophobicContact CD2-CD1 4.13Å; L301-I304 WeakPolarHBondContact O-CB 3.49Å; L301-I304 WeakPolarHBondContact O-CG1 3.47Å; L301-I304 PolarHBondContact O-N 3.1Å; D302-I304 PolarHBondContact O-N 3.12Å; I304-Y306 VanDerWaalsContact C-N 3.34Å; I304-Y307 PolarHBondContact O-N 2.82Å; I304-Y308 HydrophobicContact CG2-CD2 4.13Å; I304-Y308 HydrophobicContact CG2-CE2 3.81Å; I304-Y308 WeakPolarHBondContact O-CD2 3.49Å; I304-Y308 PolarHBondContact O-N 3.47Å |
| 305 | C | 83.8 | Confident | 87 | Confident | 2 Ų | 2 | 37.8 Ų | 37.8 | 1% | 0.014 | 19% | 0.186 | C | C | . | . | H | α-helix | trans | -63.6 | -41.7 | 177 | -50.7 | 0 | 0 | 0 | 0 | 111 | M89 N252 D302 A303 Y308 M309 | M89-C305 HydrophobicContact CE-CB 3.64Å; M89-C305 HydrophobicContact SD-CB 3.91Å; N252-C305 PolarHBondContact OD1-SG 3Å; D302-C305 WeakPolarHBondContact O-CA 3.48Å; D302-C305 WeakPolarHBondContact O-CB 3.49Å; D302-C305 PolarHBondContact O-N 3.33Å; A303-C305 VanDerWaalsContact C-N 3.29Å; A303-C305 PolarHBondContact O-N 3.32Å; C305-Y308 PolarHBondContact O-N 3.28Å; C305-M309 PolarHBondContact O-N 2.89Å; C305-M309 VanDerWaalsContact O-N 3.16Å |
| 306 | Y | 88.3 | Confident | 86.1 | Confident | 12 Ų | 12 | 40.4 Ų | 40.4 | 5% | 0.047 | 21% | 0.208 | C | C | . | . | H | α-helix | trans | -64.9 | -40.4 | 177.9 | -55.4 | -19.7 | 0 | 0 | 0 | 112.3 | N68 A71 F75 M89 L92 A93 D302 A303 I304 M309 A310 | N68-Y306 WeakPolarHBondContact OD1-CE2 3.35Å; N68-Y306 PolarHBondContact OD1-OH 3.12Å; N68-Y306 VanDerWaalsContact OD1-OH 3.11Å; A71-Y306 HydrophobicContact CB-CD2 3.28Å; A71-Y306 HydrophobicContact CB-CE2 3.68Å; A71-Y306 HydrophobicContact CB-CG 3.89Å; F75-Y306 AromaticContact CE2-CD1 3.91Å; F75-Y306 HydrophobicContact CE2-CD1 3.91Å; F75-Y306 HydrophobicContact CE2-CE1 4.21Å; F75-Y306 HydrophobicContact CE2-CG 4.26Å; F75-Y306 AromaticContact CZ-CD1 3.67Å; F75-Y306 HydrophobicContact CZ-CD1 3.67Å; F75-Y306 HydrophobicContact CZ-CD2 4.5Å; F75-Y306 HydrophobicContact CZ-CE1 4.42Å; F75-Y306 AromaticContact CZ-CG 3.74Å; F75-Y306 HydrophobicContact CZ-CG 3.74Å; M89-Y306 HydrophobicContact CB-CD1 4.22Å; M89-Y306 HydrophobicContact CB-CE1 4.11Å; M89-Y306 HydrophobicContact CG-CD1 4.39Å; M89-Y306 HydrophobicContact SD-CD1 3.95Å; M89-Y306 HydrophobicContact SD-CE1 3.92Å; L92-Y306 HydrophobicContact CD2-CE1 4.46Å; A93-Y306 VanDerWaalsContact CA-OH 3.29Å; A93-Y306 WeakPolarHBondContact CA-OH 3.27Å; A93-Y306 HydrophobicContact CB-CE2 4.48Å; A93-Y306 WeakPolarHBondContact CB-OH 3.45Å; A93-Y306 PolarHBondContact N-OH 3.22Å; D302-Y306 HydrophobicContact CB-CE1 4.39Å; D302-Y306 HydrophobicContact CB-CE2 4.45Å; D302-Y306 WeakPolarHBondContact O-CD1 3.46Å; D302-Y306 PolarHBondContact O-N 3.37Å; D302-Y306 VanDerWaalsContact O-N 3.12Å; A303-Y306 HydrophobicContact CB-CD2 4.4Å; A303-Y306 PolarHBondContact O-N 3.5Å; I304-Y306 VanDerWaalsContact C-N 3.34Å; Y306-M309 PolarHBondContact O-N 3.36Å; Y306-A310 WeakPolarHBondContact O-CB 3.48Å; Y306-A310 PolarHBondContact O-N 3.43Å |
| 307 | Y | 87.1 | Confident | 85.3 | Confident | 136 Ų | 136 | 42.5 Ų | 42.5 | 53% | 0.533 | 22% | 0.223 | S | C | . | . | H | α-helix | trans | -58.5 | -49.2 | 175.8 | 170.1 | -97.3 | 0 | 0 | 0 | 111.7 | A303 I304 M309 A310 K311 | A303-Y307 PolarHBondContact O-N 2.82Å; I304-Y307 PolarHBondContact O-N 2.82Å; Y307-M309 VanDerWaalsContact C-N 3.3Å; Y307-M309 PolarHBondContact O-N 3.47Å; Y307-A310 PolarHBondContact O-N 2.98Å; Y307-K311 HydrophobicContact CE1-CD 4.48Å; Y307-K311 WeakPolarHBondContact O-CB 3.34Å; Y307-K311 PolarHBondContact O-N 2.95Å |
| 308 | Y | 83.6 | Confident | 84.4 | Confident | 26 Ų | 26 | 44.6 Ų | 44.6 | 10% | 0.102 | 24% | 0.24 | C | C | . | . | H | α-helix | trans | -60.4 | -42.1 | 178.5 | -78.7 | -63.7 | 0 | 0 | 0 | 111.8 | R247 M248 A251 I304 C305 K311 E312 | R247-Y308 HydrophobicContact CB-CE1 4.1Å; R247-Y308 PolarHBondContact NE-OH 3.44Å; R247-Y308 VanDerWaalsContact NE-OH 3.13Å; R247-Y308 PolarHBondContact NH2-OH 3.36Å; M248-Y308 HydrophobicContact CB-CG 4.35Å; A251-Y308 HydrophobicContact CB-CD2 4.43Å; A251-Y308 HydrophobicContact CB-CE2 3.99Å; I304-Y308 HydrophobicContact CG2-CD2 4.13Å; I304-Y308 HydrophobicContact CG2-CE2 3.81Å; I304-Y308 WeakPolarHBondContact O-CD2 3.49Å; I304-Y308 PolarHBondContact O-N 3.47Å; C305-Y308 PolarHBondContact O-N 3.28Å; Y308-K311 PolarHBondContact O-N 3.29Å; Y308-E312 WeakPolarHBondContact O-CG 3.22Å; Y308-E312 PolarHBondContact O-N 3.37Å |
| 309 | M | 83.2 | Confident | 83.3 | Confident | 5 Ų | 5 | 51.1 Ų | 51.1 | 3% | 0.025 | 27% | 0.274 | C | S | . | . | H | α-helix | trans | -67.4 | -43.2 | 178.7 | -165.2 | -152 | 71.1 | 0 | 0 | 112.6 | F75 M79 T85 R86 M89 C305 Y306 Y307 K311 E312 F313 | F75-M309 HydrophobicContact CD1-CE 3.31Å; F75-M309 HydrophobicContact CE1-CE 3Å; F75-M309 HydrophobicContact CE1-SD 4.27Å; F75-M309 HydrophobicContact CE2-CE 4.36Å; F75-M309 HydrophobicContact CG-CE 4.15Å; F75-M309 HydrophobicContact CZ-CE 3.57Å; F75-M309 HydrophobicContact CZ-SD 4.32Å; M79-M309 HydrophobicContact CE-CE 3.55Å; M79-M309 HydrophobicContact CE-SD 4.39Å; M79-M309 HydrophobicContact SD-CE 3.38Å; M79-M309 WeakPolarHBondContact SD-CE 3.26Å; T85-M309 HydrophobicContact CG2-CG 4.4Å; R86-M309 HydrophobicContact CB-SD 4.1Å; M89-M309 HydrophobicContact CB-SD 4.22Å; M89-M309 HydrophobicContact CG-SD 3.97Å; C305-M309 PolarHBondContact O-N 2.89Å; C305-M309 VanDerWaalsContact O-N 3.16Å; Y306-M309 PolarHBondContact O-N 3.36Å; Y307-M309 VanDerWaalsContact C-N 3.3Å; Y307-M309 PolarHBondContact O-N 3.47Å; M309-K311 VanDerWaalsContact C-N 3.29Å; M309-K311 PolarHBondContact O-N 3.13Å; M309-E312 PolarHBondContact O-N 2.88Å; M309-F313 PolarHBondContact O-N 2.96Å; M309-F313 VanDerWaalsContact O-N 3.09Å |
| 310 | A | 83.4 | Confident | 81.8 | Confident | 27 Ų | 27 | 55 Ų | 55 | 22% | 0.223 | 31% | 0.306 | C | S | . | . | H | α-helix | trans | -62.1 | -40 | 176.2 | 0 | 0 | 0 | 0 | 0 | 111.3 | Y306 Y307 F313 Q314 | Y306-A310 WeakPolarHBondContact O-CB 3.48Å; Y306-A310 PolarHBondContact O-N 3.43Å; Y307-A310 PolarHBondContact O-N 2.98Å; A310-F313 PolarHBondContact O-N 2.73Å; A310-Q314 WeakPolarHBondContact O-CG 3.19Å; A310-Q314 PolarHBondContact O-N 3.38Å |
| 311 | K | 82.4 | Confident | 80.4 | Confident | 65 Ų | 65 | 59.8 Ų | 59.8 | 28% | 0.283 | 34% | 0.335 | S | S | . | . | H | α-helix | trans | -63.5 | -41.8 | 175.1 | -164.1 | -174.2 | 178.6 | -174.1 | 0 | 111.7 | K244 Y307 Y308 M309 F313 E315 | K244-K311 PolarHBondContact NZ-O 3.49Å; Y307-K311 HydrophobicContact CE1-CD 4.48Å; Y307-K311 WeakPolarHBondContact O-CB 3.34Å; Y307-K311 PolarHBondContact O-N 2.95Å; Y308-K311 PolarHBondContact O-N 3.29Å; M309-K311 VanDerWaalsContact C-N 3.29Å; M309-K311 PolarHBondContact O-N 3.13Å; K311-F313 VanDerWaalsContact C-N 3.29Å; K311-F313 PolarHBondContact O-N 3.44Å; K311-E315 WeakPolarHBondContact CE-OE1 3.3Å; K311-E315 WeakPolarHBondContact CG-OE1 2.98Å; K311-E315 WeakPolarHBondContact O-CG 3.4Å; K311-E315 PolarHBondContact O-N 3.46Å |
| 312 | E | 77.3 | Confident | 78.3 | Confident | 58 Ų | 58 | 62.2 Ų | 62.2 | 27% | 0.271 | 35% | 0.352 | S | S | . | . | H | α-helix | trans | -58.4 | -41.8 | 173.9 | -72.2 | -176.7 | 167.1 | 0 | 0 | 111.7 | R144 K244 Y308 M309 A316 | R144-E312 IonicContact NH2-OE2 2.62Å; K244-E312 HydrophobicContact CD-CG 4.08Å; K244-E312 VanDerWaalsContact CE-CG 3.42Å; K244-E312 VanDerWaalsContact NZ-CA 3.29Å; K244-E312 VanDerWaalsContact NZ-N 3.13Å; Y308-E312 WeakPolarHBondContact O-CG 3.22Å; Y308-E312 PolarHBondContact O-N 3.37Å; M309-E312 PolarHBondContact O-N 2.88Å; E312-A316 WeakPolarHBondContact O-CB 3.26Å; E312-A316 PolarHBondContact O-N 3.33Å; E312-A316 VanDerWaalsContact O-N 3.1Å |
| 313 | F | 78.8 | Confident | 76.2 | Confident | 55 Ų | 55 | 67 Ų | 67 | 24% | 0.241 | 38% | 0.383 | C | S | . | . | H | α-helix | trans | -67.9 | -45.5 | 179.5 | 177.5 | -100.3 | 0 | 0 | 0 | 113.1 | M79 M309 A310 K311 E315 A316 S317 | M79-F313 HydrophobicContact CB-CD2 4.37Å; M79-F313 HydrophobicContact CB-CE2 4.09Å; M79-F313 HydrophobicContact CB-CZ 4.17Å; M79-F313 HydrophobicContact CE-CB 3.67Å; M79-F313 HydrophobicContact CE-CD2 3.69Å; M79-F313 HydrophobicContact CE-CG 3.71Å; M79-F313 HydrophobicContact CG-CD1 3.95Å; M79-F313 HydrophobicContact CG-CD2 4.11Å; M79-F313 HydrophobicContact CG-CE1 4.04Å; M79-F313 HydrophobicContact CG-CE2 4.19Å; M79-F313 HydrophobicContact CG-CG 3.99Å; M79-F313 HydrophobicContact CG-CZ 4.17Å; M309-F313 PolarHBondContact O-N 2.96Å; M309-F313 VanDerWaalsContact O-N 3.09Å; A310-F313 PolarHBondContact O-N 2.73Å; K311-F313 VanDerWaalsContact C-N 3.29Å; K311-F313 PolarHBondContact O-N 3.44Å; F313-E315 VanDerWaalsContact C-N 3.33Å; F313-E315 PolarHBondContact O-N 2.98Å; F313-A316 PolarHBondContact O-N 3Å; F313-S317 PolarHBondContact O-N 3.28Å; F313-S317 PolarHBondContact O-OG 3.45Å |
| 314 | Q | 81.9 | Confident | 74.2 | Confident | 134 Ų | 134 | 71.6 Ų | 71.6 | 63% | 0.626 | 41% | 0.414 | S | S | * | . | H | α-helix | trans | -59 | -43.9 | 179.4 | -75 | 176.8 | -15.3 | 0 | 0 | 112.2 | A310 S317 A318 | A310-Q314 WeakPolarHBondContact O-CG 3.19Å; A310-Q314 PolarHBondContact O-N 3.38Å; Q314-S317 PolarHBondContact O-N 2.8Å; Q314-A318 WeakPolarHBondContact O-CB 3.41Å; Q314-A318 PolarHBondContact O-N 2.89Å |
| 315 | E | 78.3 | Confident | 72.2 | Confident | 77 Ų | 77 | 72.4 Ų | 72.4 | 36% | 0.36 | 43% | 0.431 | S | S | . | . | H | α-helix | trans | -67.1 | -42.9 | 177.7 | -70.7 | 165.5 | -158 | 0 | 0 | 112 | K244 K311 F313 S317 A318 L319 | K244-E315 IonicContact NZ-OE1 3.85Å; K244-E315 PolarHBondContact NZ-OE1 2.74Å; K244-E315 IonicContact NZ-OE2 3.17Å; K244-E315 PolarHBondContact NZ-OE2 3.48Å; K311-E315 WeakPolarHBondContact CE-OE1 3.3Å; K311-E315 WeakPolarHBondContact CG-OE1 2.98Å; K311-E315 WeakPolarHBondContact O-CG 3.4Å; K311-E315 PolarHBondContact O-N 3.46Å; F313-E315 VanDerWaalsContact C-N 3.33Å; F313-E315 PolarHBondContact O-N 2.98Å; E315-S317 VanDerWaalsContact C-N 3.29Å; E315-S317 PolarHBondContact O-N 2.97Å; E315-A318 PolarHBondContact O-N 3.28Å; E315-L319 WeakPolarHBondContact O-CG 3.27Å; E315-L319 PolarHBondContact O-N 3.07Å |
| 316 | A | 74.3 | Confident | 70.1 | Confident | 60 Ų | 60 | 82.2 Ų | 82.2 | 50% | 0.496 | 47% | 0.473 | S | S | . | . | H | α-helix | trans | -62.6 | -36.9 | 176.8 | 0 | 0 | 0 | 0 | 0 | 112.2 | E312 F313 A320 | E312-A316 WeakPolarHBondContact O-CB 3.26Å; E312-A316 PolarHBondContact O-N 3.33Å; E312-A316 VanDerWaalsContact O-N 3.1Å; F313-A316 PolarHBondContact O-N 3Å; A316-A320 PolarHBondContact O-N 3.44Å |
| 317 | S | 75.6 | Confident | 67.8 | Low | 52 Ų | 52 | 86.1 Ų | 86.1 | 36% | 0.364 | 51% | 0.508 | S | S | . | . | H | α-helix | trans | -69 | -40 | 173 | -65.5 | 0 | 0 | 0 | 0 | 112.4 | F313 Q314 E315 L319 A320 V321 | F313-S317 PolarHBondContact O-N 3.28Å; F313-S317 PolarHBondContact O-OG 3.45Å; Q314-S317 PolarHBondContact O-N 2.8Å; E315-S317 VanDerWaalsContact C-N 3.29Å; E315-S317 PolarHBondContact O-N 2.97Å; S317-L319 PolarHBondContact O-N 3.19Å; S317-A320 PolarHBondContact O-N 3.48Å; S317-V321 WeakPolarHBondContact O-CG2 3.44Å; S317-V321 PolarHBondContact O-N 3.03Å |
| 318 | A | 74.9 | Confident | 65.4 | Low | 60 Ų | 60 | 88.3 Ų | 88.3 | 50% | 0.496 | 52% | 0.523 | S | S | . | . | H | α-helix | trans | -62.5 | -41.6 | 177.1 | 0 | 0 | 0 | 0 | 0 | 112.2 | Q314 E315 A320 V321 | Q314-A318 WeakPolarHBondContact O-CB 3.41Å; Q314-A318 PolarHBondContact O-N 2.89Å; E315-A318 PolarHBondContact O-N 3.28Å; A318-A320 VanDerWaalsContact C-N 3.29Å; A318-A320 PolarHBondContact O-N 3.33Å; A318-V321 PolarHBondContact O-N 3.48Å |
| 319 | L | 70.2 | Confident | 63.1 | Low | 139 Ų | 139 | 94.9 Ų | 94.9 | 73% | 0.728 | 55% | 0.552 | S | S | * | * | H | α-helix | trans | -65.8 | -30 | 176.2 | -69.9 | 166.7 | 0 | 0 | 0 | 113 | E315 S317 V321 | E315-L319 WeakPolarHBondContact O-CG 3.27Å; E315-L319 PolarHBondContact O-N 3.07Å; S317-L319 PolarHBondContact O-N 3.19Å; L319-V321 VanDerWaalsContact C-N 3.3Å |
| 320 | A | 64.1 | Low | 60.8 | Low | 82 Ų | 82 | 100.6 Ų | 100.6 | 68% | 0.678 | 59% | 0.593 | S | S | * | * | H | α-helix | trans | -76 | -16.5 | 177.3 | 0 | 0 | 0 | 0 | 0 | 113.7 | A316 S317 A318 | A316-A320 PolarHBondContact O-N 3.44Å; S317-A320 PolarHBondContact O-N 3.48Å; A318-A320 VanDerWaalsContact C-N 3.29Å; A318-A320 PolarHBondContact O-N 3.33Å |
| 321 | V | 65.1 | Low | 58.9 | Low | 117 Ų | 117 | 107.1 Ų | 107.1 | 71% | 0.709 | 62% | 0.618 | S | S | * | * | H | α-helix | trans | -93.3 | -18.3 | -177.6 | 172.7 | 0 | 0 | 0 | 0 | 112.5 | S317 A318 L319 P323 | S317-V321 WeakPolarHBondContact O-CG2 3.44Å; S317-V321 PolarHBondContact O-N 3.03Å; A318-V321 PolarHBondContact O-N 3.48Å; L319-V321 VanDerWaalsContact C-N 3.3Å; V321-P323 WeakPolarHBondContact O-CD 3.31Å |
| 322 | V | 49.8 | Very low | 56.7 | Low | 108 Ų | 108 | 108.4 Ų | 108.4 | 66% | 0.655 | 64% | 0.641 | S | S | * | * | S | Bend | trans | -69.9 | 112.7 | 175.2 | -178.1 | 0 | 0 | 0 | 0 | 109.3 | ||
| 323 | P | 45.3 | Very low | 54.9 | Low | 100 Ų | 100 | 110.8 Ų | 110.8 | 65% | 0.649 | 66% | 0.664 | S | S | * | * | trans | -66.6 | 141.1 | 175 | -12.8 | 28.9 | 0 | 0 | 0 | 109.1 | V321 A325 | V321-P323 WeakPolarHBondContact O-CD 3.31Å; P323-A325 PolarHBondContact O-N 3.06Å | ||
| 324 | S | 43.6 | Very low | 52.8 | Low | 119 Ų | 119 | 116.4 Ų | 116.4 | 83% | 0.832 | 70% | 0.696 | S | S | * | * | trans | -58.7 | 81.1 | 166.1 | 171.3 | 0 | 0 | 0 | 0 | 110.2 | ||||
| 325 | A | 45.6 | Very low | 50.7 | Low | 87 Ų | 87 | 114.8 Ų | 114.8 | 72% | 0.719 | 70% | 0.698 | S | S | * | * | trans | -108.9 | 55.2 | 177.9 | 0 | 0 | 0 | 0 | 0 | 110.4 | P323 | P323-A325 PolarHBondContact O-N 3.06Š| ||
| 326 | K | 39.4 | Very low | 48.9 | Very low | 207 Ų | 207 | 117.3 Ų | 117.3 | 90% | 0.9 | 72% | 0.718 | S | S | * | * | trans | -146.4 | 64.3 | 154.2 | -75.9 | -164.7 | -179.2 | 175.2 | 0 | 110.3 | ||||
| 327 | A | 40.1 | Very low | 47.4 | Very low | 94 Ų | 94 | 120 Ų | 120 | 78% | 0.777 | 73% | 0.729 | S | S | * | * | trans | -139.2 | 57 | 154.9 | 0 | 0 | 0 | 0 | 0 | 108 | K329 | A327-K329 PolarHBondContact O-N 2.87Š| ||
| 328 | H | 36.8 | Very low | 45.6 | Very low | 182 Ų | 182 | 125.5 Ų | 125.5 | 84% | 0.843 | 75% | 0.753 | S | S | * | * | trans | -86.8 | 109.2 | 168.6 | -148.6 | -65.1 | 0 | 0 | 0 | 108.4 | S330 | H328-S330 PolarHBondContact O-N 3.34Š| ||
| 329 | K | 36 | Very low | 43.7 | Very low | 164 Ų | 164 | 131.1 Ų | 131.1 | 71% | 0.713 | 80% | 0.8 | S | S | * | * | trans | -16.7 | 119.8 | 151.7 | -84.2 | 170.2 | 163.6 | 177.9 | 0 | 112.8 | A327 | A327-K329 PolarHBondContact O-N 2.87Š| ||
| 330 | S | 33.9 | Very low | 42.4 | Very low | 126 Ų | 126 | 130.8 Ų | 130.8 | 88% | 0.881 | 80% | 0.804 | S | S | * | * | trans | -100 | 98.1 | 140.9 | -172.6 | 0 | 0 | 0 | 0 | 106.8 | H328 | H328-S330 PolarHBondContact O-N 3.34Š| ||
| 331 | Q | 43.1 | Very low | 41.3 | Very low | 164 Ų | 164 | 133.3 Ų | 133.3 | 77% | 0.766 | 81% | 0.81 | S | S | * | * | trans | -122.7 | 108.1 | 159.1 | -107.8 | -169.7 | -30.3 | 0 | 0 | 105.5 | ||||
| 332 | A | 37.3 | Very low | 40 | Very low | 91 Ų | 91 | 134.2 Ų | 134.2 | 75% | 0.752 | 82% | 0.816 | S | S | * | * | trans | -159.6 | 109 | 148.6 | 0 | 0 | 0 | 0 | 0 | 109.7 | ||||
| 333 | S | 38.2 | Very low | 39.4 | Very low | 109 Ų | 109 | 135.8 Ų | 135.8 | 76% | 0.762 | 83% | 0.825 | S | S | * | * | trans | 63.7 | 102.5 | 132.8 | -145.9 | 0 | 0 | 0 | 0 | 118.8 | ||||
| 334 | L | 35.8 | Very low | 39 | Very low | 172 Ų | 172 | 138 Ų | 138 | 90% | 0.901 | 84% | 0.836 | S | S | * | * | trans | -137.2 | 102.6 | 131.3 | -113.2 | 130.5 | 0 | 0 | 0 | 108.9 | ||||
| 335 | C | 37.9 | Very low | 38.7 | Very low | 101 Ų | 101 | 139.3 Ų | 139.3 | 68% | 0.682 | 84% | 0.837 | S | S | * | * | trans | -63.4 | 123.3 | 161.5 | -174.8 | 0 | 0 | 0 | 0 | 109 | ||||
| 336 | V | 39.7 | Very low | 38.2 | Very low | 129 Ų | 129 | 143 Ų | 143 | 78% | 0.782 | 85% | 0.845 | S | S | * | * | trans | -150.9 | 106.8 | 142.8 | 178.9 | 0 | 0 | 0 | 0 | 108 | ||||
| 337 | T | 43.1 | Very low | 38.1 | Very low | 116 Ų | 116 | 138.1 Ų | 138.1 | 71% | 0.712 | 84% | 0.841 | S | S | * | * | trans | -72.7 | 152.3 | 154.8 | -11.7 | 0 | 0 | 0 | 0 | 109.3 | ||||
| 338 | L | 36.7 | Very low | 38 | Very low | 168 Ų | 168 | 141.8 Ų | 141.8 | 88% | 0.88 | 85% | 0.846 | S | S | * | * | trans | 93.6 | 97.5 | 172 | -65.7 | 149.3 | 0 | 0 | 0 | 117.1 | ||||
| 339 | A | 36.9 | Very low | 38.1 | Very low | 179 Ų | 179 | 138.1 Ų | 138.1 | 100% | 1.479 | 85% | 0.846 | S | S | * | * | -167.5 | 0 | 101.3 | 0 | 0 | 0 | 0 | 0 | 109.9 |
Retrieved 339 of 339 residues in 97.8 ms
(Link to these results)