| Site | Residue | pLDDT | pLDDT confidence | pLDDT10 | pLDDT10 confidence | SASA | SASA [Ų] | SASA10 | SASA10 [Ų] | RSA | RSA unformatted | RSA10 | RSA10 unformatted | Surface | Surface10 (not used) | Disorder (not used) | Disorder | Sec. str. | Secondary structure | Isomer | Phi (φ) | Psi (ψ) | Omega (ω) | Chi 1 (χ1) | Chi 2 (χ2) | Chi 3 (χ3) | Chi 4 (χ4) | Chi 5 (χ5) | Tau (τ) | Contacts (colored by PAE) | Contact details |
|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|
| 1 | M | 62.2 | Low | 58.9 | Low | 247 Ų | 247 | 151.5 Ų | 151.5 | 100% | 1.217 | 82% | 0.822 | S | S | * | * | 0 | 116 | 0 | -69.6 | -166.6 | 169.9 | 0 | 0 | 107.6 | |||||
| 2 | S | 68.3 | Low | 57.8 | Low | 121 Ų | 121 | 147.3 Ų | 147.3 | 85% | 0.846 | 81% | 0.811 | S | S | * | * | trans | -70.5 | 128.3 | 178.9 | -54 | 0 | 0 | 0 | 0 | 110 | ||||
| 3 | S | 63.5 | Low | 57.2 | Low | 124 Ų | 124 | 144.2 Ų | 144.2 | 87% | 0.867 | 82% | 0.817 | S | S | * | * | trans | -179.4 | 63.1 | 151.6 | -78.7 | 0 | 0 | 0 | 0 | 109.2 | ||||
| 4 | S | 66.3 | Low | 56.3 | Low | 103 Ų | 103 | 140.6 Ų | 140.6 | 72% | 0.72 | 81% | 0.806 | S | S | * | * | trans | -90.2 | 100.3 | 161.8 | -72.3 | 0 | 0 | 0 | 0 | 107.3 | ||||
| 5 | M | 65.3 | Low | 56.1 | Low | 143 Ų | 143 | 144.7 Ų | 144.7 | 70% | 0.704 | 81% | 0.811 | S | S | * | * | trans | -148.7 | 71.1 | 156.9 | -162.8 | 89.3 | -57.8 | 0 | 0 | 109.8 | K7 | M5-K7 HydrophobicContact CG-CG 4.41Å; M5-K7 PolarHBondContact O-N 3.4Å; M5-K7 VanDerWaalsContact O-N 3.11Å; M5-K7 HydrophobicContact SD-CD 4.37Å | ||
| 6 | E | 61.7 | Low | 56.1 | Low | 170 Ų | 170 | 140.6 Ų | 140.6 | 79% | 0.794 | 79% | 0.785 | S | S | * | * | trans | -71.5 | 94.1 | 159.9 | -53.3 | 105.9 | 128.6 | 0 | 0 | 109 | ||||
| 7 | K | 55 | Low | 56 | Low | 172 Ų | 172 | 134.1 Ų | 134.1 | 75% | 0.748 | 75% | 0.751 | S | S | * | * | trans | -118.8 | 80 | 164.1 | -85.1 | -170.8 | 177 | -153.5 | 0 | 109.8 | M5 | M5-K7 HydrophobicContact CG-CG 4.41Å; M5-K7 PolarHBondContact O-N 3.4Å; M5-K7 VanDerWaalsContact O-N 3.11Å; M5-K7 HydrophobicContact SD-CD 4.37Å | ||
| 8 | L | 49.4 | Very low | 55.8 | Low | 165 Ų | 165 | 133.3 Ų | 133.3 | 86% | 0.864 | 74% | 0.744 | S | S | * | * | trans | -110.1 | 80.1 | 159.1 | -81.8 | 160.5 | 0 | 0 | 0 | 107.5 | S10 | L8-S10 PolarHBondContact O-N 2.85Å; L8-S10 VanDerWaalsContact O-N 3.11Å | ||
| 9 | N | 59.9 | Low | 55.7 | Low | 158 Ų | 158 | 129.4 Ų | 129.4 | 85% | 0.845 | 72% | 0.721 | S | S | * | * | trans | -81.1 | 82.8 | 162.9 | -175.4 | 79.8 | 0 | 0 | 0 | 107.9 | Q11 | N9-Q11 PolarHBondContact O-N 3.33Š| ||
| 10 | S | 50.2 | Low | 55.7 | Low | 85 Ų | 85 | 131.4 Ų | 131.4 | 59% | 0.594 | 73% | 0.73 | S | S | * | * | trans | -63.7 | 119.3 | 162 | -60.4 | 0 | 0 | 0 | 0 | 109 | L8 | L8-S10 PolarHBondContact O-N 2.85Å; L8-S10 VanDerWaalsContact O-N 3.11Å | ||
| 11 | Q | 46.2 | Very low | 55.7 | Low | 179 Ų | 179 | 131.6 Ų | 131.6 | 84% | 0.836 | 73% | 0.726 | S | S | * | * | trans | -179.8 | 146.7 | 130.8 | -103.4 | 166 | 81.5 | 0 | 0 | 114.8 | N9 | N9-Q11 PolarHBondContact O-N 3.33Š| ||
| 12 | S | 45.3 | Very low | 55.3 | Low | 100 Ų | 100 | 122.2 Ų | 122.2 | 70% | 0.699 | 69% | 0.692 | S | S | * | * | trans | 86.5 | 100.8 | 154.3 | -66.6 | 0 | 0 | 0 | 0 | 117.9 | S14 | S12-S14 PolarHBondContact O-N 3.41Š| ||
| 13 | A | 49.7 | Very low | 54.7 | Low | 107 Ų | 107 | 121.9 Ų | 121.9 | 88% | 0.884 | 68% | 0.676 | S | S | * | * | trans | -45.5 | 97.7 | 163.9 | 0 | 0 | 0 | 0 | 0 | 111.8 | ||||
| 14 | S | 45.8 | Very low | 54.5 | Low | 94 Ų | 94 | 119.8 Ų | 119.8 | 66% | 0.657 | 66% | 0.659 | S | S | * | * | trans | -145.4 | 127 | 152.8 | -68.9 | 0 | 0 | 0 | 0 | 103.5 | S12 I16 | S12-S14 PolarHBondContact O-N 3.41Å; S14-I16 VanDerWaalsContact C-N 3.26Å; S14-I16 WeakPolarHBondContact O-CG1 3.31Å; S14-I16 PolarHBondContact O-N 3.29Å | ||
| 15 | K | 52.3 | Low | 54.1 | Low | 203 Ų | 203 | 116.9 Ų | 116.9 | 88% | 0.883 | 64% | 0.635 | S | S | * | * | trans | -64.8 | 82.7 | -167.2 | -56.8 | 174.2 | -173.5 | -171.6 | 0 | 109.8 | ||||
| 16 | I | 55.7 | Low | 54.1 | Low | 79 Ų | 79 | 116.8 Ų | 116.8 | 41% | 0.405 | 63% | 0.631 | S | S | . | * | P | Polyproline II helix | trans | -87.6 | 127.3 | 172.3 | -30.5 | -173 | 0 | 0 | 0 | 105.8 | S14 L18 P24 F66 | S14-I16 VanDerWaalsContact C-N 3.26Å; S14-I16 WeakPolarHBondContact O-CG1 3.31Å; S14-I16 PolarHBondContact O-N 3.29Å; I16-L18 PolarHBondContact O-N 3.07Å; I16-P24 HydrophobicContact CD1-CB 4.13Å; I16-P24 HydrophobicContact CG2-CB 4.45Å; I16-F66 HydrophobicContact CG2-CD1 3.91Å; I16-F66 HydrophobicContact CG2-CE1 3.32Å; I16-F66 HydrophobicContact CG2-CZ 4.12Å |
| 17 | P | 54.7 | Low | 54.2 | Low | 30 Ų | 30 | 111.9 Ų | 111.9 | 20% | 0.195 | 61% | 0.614 | C | S | . | * | P | Polyproline II helix | trans | -54.8 | 127.9 | 168.2 | 26.1 | -36.4 | 0 | 0 | 0 | 108.5 | L25 L64 F66 | P17-L25 HydrophobicContact CB-CD1 4.15Å; P17-L25 WeakPolarHBondContact O-CB 3.07Å; P17-L25 WeakPolarHBondContact O-CD1 3.05Å; P17-L25 PolarHBondContact O-N 2.94Å; P17-L64 VanDerWaalsContact CB-O 3.27Å; P17-L64 WeakPolarHBondContact CB-O 3.41Å; P17-L64 WeakPolarHBondContact CD-O 3.43Å; P17-L64 HydrophobicContact CG-CB 4.27Å; P17-L64 WeakPolarHBondContact CG-O 3.08Å; P17-F66 HydrophobicContact CG-CD1 4.47Å; P17-F66 HydrophobicContact CG-CD2 3.75Å; P17-F66 HydrophobicContact CG-CE1 4.03Å; P17-F66 HydrophobicContact CG-CE2 3.23Å; P17-F66 HydrophobicContact CG-CG 4.34Å; P17-F66 HydrophobicContact CG-CZ 3.39Å |
| 18 | L | 53.1 | Low | 54.8 | Low | 119 Ų | 119 | 106.7 Ų | 106.7 | 62% | 0.623 | 60% | 0.599 | S | S | * | * | B | Isolated β-bridge | trans | -92 | 134.2 | 179.4 | -73.9 | 145.7 | 0 | 0 | 0 | 108.3 | I16 G22 L25 | I16-L18 PolarHBondContact O-N 3.07Å; L18-G22 WeakPolarHBondContact CD2-O 3.18Å; L18-L25 VanDerWaalsContact C-CD1 3.42Å |
| 19 | D | 53.2 | Low | 55.7 | Low | 59 Ų | 59 | 103.1 Ų | 103.1 | 32% | 0.316 | 59% | 0.586 | S | S | . | * | P | Polyproline II helix | trans | -63.9 | 167.6 | 172.7 | 178.7 | -113.2 | 0 | 0 | 0 | 111 | E21 G22 K23 L25 | D19-E21 PolarHBondContact O-N 3.24Å; D19-E21 WeakPolarHBondContact OD1-CB 2.98Å; D19-E21 PolarHBondContact OD1-N 3.49Å; D19-G22 PolarHBondContact O-N 3.16Å; D19-K23 PolarHBondContact N-O 2.88Å; D19-L25 HydrophobicContact CB-CD1 4.09Å; D19-L25 HydrophobicContact CB-CG 3.91Å; D19-L25 VanDerWaalsContact N-CD1 3.29Å |
| 20 | N | 55.7 | Low | 56.4 | Low | 170 Ų | 170 | 96.5 Ų | 96.5 | 91% | 0.909 | 55% | 0.553 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -52.1 | -26.3 | 169.9 | -76.2 | -79.9 | 0 | 0 | 0 | 113 | G22 | N20-G22 VanDerWaalsContact C-N 3.34Š|
| 21 | E | 56.7 | Low | 57.9 | Low | 136 Ų | 136 | 92.6 Ų | 92.6 | 64% | 0.636 | 53% | 0.526 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -88.4 | 10.8 | 174.2 | -72.4 | -175.1 | 59.7 | 0 | 0 | 114.8 | D19 K23 | D19-E21 PolarHBondContact O-N 3.24Å; D19-E21 WeakPolarHBondContact OD1-CB 2.98Å; D19-E21 PolarHBondContact OD1-N 3.49Å; E21-K23 HydrophobicContact CB-CD 3.83Å; E21-K23 PolarHBondContact O-N 3.18Å; E21-K23 IonicContact OE1-NZ 3.74Å; E21-K23 PolarHBondContact OE1-NZ 3.1Å |
| 22 | G | 53.1 | Low | 59.7 | Low | 50 Ų | 50 | 88 Ų | 88 | 52% | 0.515 | 51% | 0.512 | S | S | . | . | S | Bend | trans | 66.1 | 18.7 | 179.7 | 0 | 0 | 0 | 0 | 0 | 113.6 | L18 D19 N20 | L18-G22 WeakPolarHBondContact CD2-O 3.18Å; D19-G22 PolarHBondContact O-N 3.16Å; N20-G22 VanDerWaalsContact C-N 3.34Å |
| 23 | K | 56.3 | Low | 61.6 | Low | 114 Ų | 114 | 91.2 Ų | 91.2 | 50% | 0.496 | 52% | 0.516 | S | S | . | . | trans | -96.8 | 144.7 | 179 | -73.2 | 147.2 | -162.2 | 178.7 | 0 | 109.5 | D19 E21 L25 | D19-K23 PolarHBondContact N-O 2.88Å; E21-K23 HydrophobicContact CB-CD 3.83Å; E21-K23 PolarHBondContact O-N 3.18Å; E21-K23 IonicContact OE1-NZ 3.74Å; E21-K23 PolarHBondContact OE1-NZ 3.1Å; K23-L25 PolarHBondContact O-N 2.03Å | ||
| 24 | P | 59.4 | Low | 63.5 | Low | 80 Ų | 80 | 86.9 Ų | 86.9 | 52% | 0.519 | 48% | 0.479 | S | S | . | . | B | Isolated β-bridge | trans | -58.9 | 114.7 | 176.5 | 24.3 | -32.2 | 0 | 0 | 0 | 108.1 | I16 K26 | I16-P24 HydrophobicContact CD1-CB 4.13Å; I16-P24 HydrophobicContact CG2-CB 4.45Å; P24-K26 PolarHBondContact O-N 3.17Å |
| 25 | L | 58.3 | Low | 65.4 | Low | 41 Ų | 41 | 86 Ų | 86 | 22% | 0.215 | 46% | 0.461 | C | S | . | . | trans | -58.3 | 134.1 | 175.2 | -90.7 | 130.1 | 0 | 0 | 0 | 107 | P17 L18 D19 K23 C29 F66 | P17-L25 HydrophobicContact CB-CD1 4.15Å; P17-L25 WeakPolarHBondContact O-CB 3.07Å; P17-L25 WeakPolarHBondContact O-CD1 3.05Å; P17-L25 PolarHBondContact O-N 2.94Å; L18-L25 VanDerWaalsContact C-CD1 3.42Å; D19-L25 HydrophobicContact CB-CD1 4.09Å; D19-L25 HydrophobicContact CB-CG 3.91Å; D19-L25 VanDerWaalsContact N-CD1 3.29Å; K23-L25 PolarHBondContact O-N 2.03Å; L25-C29 HydrophobicContact CD2-CB 4.33Å; L25-F66 HydrophobicContact CB-CE2 4.25Å; L25-F66 HydrophobicContact CB-CZ 3.53Å; L25-F66 WeakPolarHBondContact O-CE1 3.21Å; L25-F66 WeakPolarHBondContact O-CZ 3.42Å | ||
| 26 | K | 63.7 | Low | 67.2 | Low | 141 Ų | 141 | 81.5 Ų | 81.5 | 61% | 0.613 | 45% | 0.446 | S | S | * | . | trans | -88 | 148.8 | 173.2 | -56.3 | 175.3 | -166.6 | 169.9 | 0 | 107.5 | P24 C28 C29 A30 | P24-K26 PolarHBondContact O-N 3.17Å; K26-C28 WeakPolarHBondContact CB-SG 3.23Å; K26-C28 PolarHBondContact O-N 3.42Å; K26-C29 PolarHBondContact O-N 3.32Å; K26-A30 PolarHBondContact O-N 3.12Å | ||
| 27 | P | 64.7 | Low | 68.9 | Low | 67 Ų | 67 | 82.8 Ų | 82.8 | 44% | 0.435 | 45% | 0.448 | S | S | . | . | H | α-helix | trans | -56.7 | -20.7 | 174.7 | 21 | -31.7 | 0 | 0 | 0 | 113.2 | L61 | P27-L61 HydrophobicContact CB-CD1 3.72Å; P27-L61 HydrophobicContact CB-CD2 3.53Å; P27-L61 HydrophobicContact CB-CG 4.31Å |
| 28 | C | 67.5 | Low | 70.6 | Confident | 64 Ų | 64 | 84.3 Ų | 84.3 | 43% | 0.432 | 45% | 0.45 | S | S | . | . | H | α-helix | trans | -68.6 | -29.3 | 174.2 | 68.5 | 0 | 0 | 0 | 0 | 114.8 | K26 | K26-C28 WeakPolarHBondContact CB-SG 3.23Å; K26-C28 PolarHBondContact O-N 3.42Å |
| 29 | C | 69.3 | Low | 72.4 | Confident | 89 Ų | 89 | 81.7 Ų | 81.7 | 60% | 0.601 | 44% | 0.437 | S | S | * | . | H | α-helix | trans | -97.7 | -22.8 | 178.7 | -80 | 0 | 0 | 0 | 0 | 113.1 | L25 K26 C31 | L25-C29 HydrophobicContact CD2-CB 4.33Å; K26-C29 PolarHBondContact O-N 3.32Å; C29-C31 VanDerWaalsContact C-N 3.35Å; C29-C31 PolarHBondContact O-N 2.8Å |
| 30 | A | 72.6 | Confident | 74.3 | Confident | 19 Ų | 19 | 84.5 Ų | 84.5 | 16% | 0.157 | 45% | 0.448 | C | S | . | . | H | α-helix | trans | -59.7 | -44.3 | -179.1 | 0 | 0 | 0 | 0 | 0 | 112.5 | K26 L61 L64 F66 | K26-A30 PolarHBondContact O-N 3.12Å; A30-L61 HydrophobicContact CB-CD2 3.58Å; A30-L64 HydrophobicContact CB-CD1 3.47Å; A30-L64 VanDerWaalsContact CB-CD1 3.47Å; A30-L64 WeakPolarHBondContact O-CD1 3.17Å; A30-F66 HydrophobicContact CB-CD2 4.35Å; A30-F66 HydrophobicContact CB-CE2 3.71Å; A30-F66 HydrophobicContact CB-CZ 4.42Å |
| 31 | C | 82.6 | Confident | 76.2 | Confident | 4 Ų | 4 | 77.4 Ų | 77.4 | 3% | 0.027 | 41% | 0.412 | C | S | . | . | trans | -142.5 | 71.7 | -170.9 | -53.9 | 0 | 0 | 0 | 0 | 111 | C29 E33 T34 R35 C60 | C29-C31 VanDerWaalsContact C-N 3.35Å; C29-C31 PolarHBondContact O-N 2.8Å; C31-E33 VanDerWaalsContact C-N 3.31Å; C31-E33 PolarHBondContact O-N 2.99Å; C31-T34 WeakPolarHBondContact CB-OG1 3.15Å; C31-T34 PolarHBondContact O-OG1 2.89Å; C31-R35 WeakPolarHBondContact O-CB 3.47Å; C31-R35 PolarHBondContact O-N 3.35Å; C31-C60 HydrophobicContact CB-CB 3.8Å; C31-C60 WeakPolarHBondContact CB-SG 3.09Å; C31-C60 WeakPolarHBondContact SG-CB 3.39Å; C31-C60 CovalentContact SG-SG 2.01Å; C31-C60 PolarHBondContact SG-SG 3.19Å | ||
| 32 | P | 83.2 | Confident | 78 | Confident | 81 Ų | 81 | 73.5 Ų | 73.5 | 53% | 0.526 | 40% | 0.397 | S | S | . | . | H | α-helix | trans | -61.9 | -38.2 | -174.6 | 23.9 | -32.9 | 0 | 0 | 0 | 112.4 | L36 | P32-L36 WeakPolarHBondContact O-CB 3.37Å; P32-L36 PolarHBondContact O-N 3.47Å |
| 33 | E | 86.8 | Confident | 79.9 | Confident | 168 Ų | 168 | 78 Ų | 78 | 79% | 0.785 | 41% | 0.409 | S | S | * | . | H | α-helix | trans | -66 | -54.9 | -179 | -63.8 | -173.4 | 99.3 | 0 | 0 | 112.1 | C31 R35 L36 K37 | C31-E33 VanDerWaalsContact C-N 3.31Å; C31-E33 PolarHBondContact O-N 2.99Å; E33-R35 VanDerWaalsContact C-N 3.32Å; E33-R35 PolarHBondContact O-N 2.7Å; E33-L36 PolarHBondContact O-N 3.3Å; E33-K37 WeakPolarHBondContact O-CB 3.48Å; E33-K37 PolarHBondContact O-N 3Å |
| 34 | T | 89.7 | Confident | 81.8 | Confident | 17 Ų | 17 | 78.7 Ų | 78.7 | 10% | 0.104 | 42% | 0.415 | C | S | . | . | H | α-helix | trans | -68.2 | -33.8 | 179.8 | 65.5 | 0 | 0 | 0 | 0 | 111.5 | C31 R38 E56 H57 C60 | C31-T34 WeakPolarHBondContact CB-OG1 3.15Å; C31-T34 PolarHBondContact O-OG1 2.89Å; T34-R38 WeakPolarHBondContact O-CB 3.37Å; T34-R38 PolarHBondContact O-N 3.42Å; T34-E56 HydrophobicContact CG2-CG 3.86Å; T34-E56 WeakPolarHBondContact CG2-OE1 3.43Å; T34-H57 WeakPolarHBondContact OG1-CA 3.37Å; T34-H57 PolarHBondContact OG1-ND1 2.99Å; T34-C60 HydrophobicContact CG2-CB 4.39Å |
| 35 | R | 85.7 | Confident | 83.4 | Confident | 74 Ų | 74 | 82.9 Ų | 82.9 | 28% | 0.279 | 42% | 0.422 | S | S | . | . | H | α-helix | trans | -61.5 | -49.9 | 173.9 | -165.3 | -142.4 | 94.3 | 86 | -3.8 | 110.4 | C31 E33 R38 D39 H57 | C31-R35 WeakPolarHBondContact O-CB 3.47Å; C31-R35 PolarHBondContact O-N 3.35Å; E33-R35 VanDerWaalsContact C-N 3.32Å; E33-R35 PolarHBondContact O-N 2.7Å; R35-R38 PolarHBondContact O-N 3.04Å; R35-D39 IonicContact CZ-OD1 2.84Å; R35-D39 IonicContact CZ-OD2 3.34Å; R35-D39 VanDerWaalsContact CZ-OD2 3.27Å; R35-D39 IonicContact NH1-OD1 2.62Å; R35-D39 IonicContact NH1-OD2 3.6Å; R35-D39 PolarHBondContact NH1-OD2 2.86Å; R35-D39 IonicContact NH2-OD1 3.59Å; R35-D39 PolarHBondContact NH2-OD1 3.41Å; R35-D39 IonicContact NH2-OD2 2.76Å; R35-D39 PolarHBondContact NH2-OD2 3.43Å; R35-D39 WeakPolarHBondContact O-CB 3.17Å; R35-D39 PolarHBondContact O-N 3.3Å; R35-H57 PolarHBondContact N-ND1 3.38Å |
| 36 | L | 88.9 | Confident | 84.9 | Confident | 109 Ų | 109 | 82 Ų | 82 | 57% | 0.571 | 42% | 0.422 | S | S | * | . | H | α-helix | trans | -63.7 | -45 | -178.8 | -174.9 | 70.2 | 0 | 0 | 0 | 111.2 | P32 E33 R38 D39 Q40 | P32-L36 WeakPolarHBondContact O-CB 3.37Å; P32-L36 PolarHBondContact O-N 3.47Å; E33-L36 PolarHBondContact O-N 3.3Å; L36-R38 VanDerWaalsContact C-N 3.34Å; L36-R38 PolarHBondContact O-N 2.81Å; L36-D39 PolarHBondContact O-N 2.87Å; L36-Q40 VanDerWaalsContact O-CB 3.27Å; L36-Q40 WeakPolarHBondContact O-CB 3.47Å; L36-Q40 PolarHBondContact O-N 2.88Å |
| 37 | K | 90.9 | Very high | 86 | Confident | 106 Ų | 106 | 81.7 Ų | 81.7 | 46% | 0.461 | 42% | 0.423 | S | S | . | . | H | α-helix | trans | -61.4 | -43.2 | 177.6 | -165.4 | 178.9 | -178.9 | -177.3 | 0 | 111.6 | E33 C41 V53 E56 | E33-K37 WeakPolarHBondContact O-CB 3.48Å; E33-K37 PolarHBondContact O-N 3Å; K37-C41 WeakPolarHBondContact O-CB 3.4Å; K37-C41 PolarHBondContact O-N 3.4Å; K37-V53 HydrophobicContact CD-CG1 3.98Å; K37-V53 HydrophobicContact CG-CB 4.5Å; K37-V53 HydrophobicContact CG-CG1 3.88Å; K37-E56 IonicContact NZ-OE1 2.7Å; K37-E56 IonicContact NZ-OE2 3.86Å |
| 38 | R | 91.5 | Very high | 87.3 | Confident | 63 Ų | 63 | 86.5 Ų | 86.5 | 24% | 0.238 | 44% | 0.44 | C | S | . | . | H | α-helix | trans | -64.2 | -48 | 173.8 | 175 | -90.5 | -57 | -170.4 | -3.8 | 111.9 | T34 R35 L36 Q40 C41 V42 V53 I54 H57 | T34-R38 WeakPolarHBondContact O-CB 3.37Å; T34-R38 PolarHBondContact O-N 3.42Å; R35-R38 PolarHBondContact O-N 3.04Å; L36-R38 VanDerWaalsContact C-N 3.34Å; L36-R38 PolarHBondContact O-N 2.81Å; R38-Q40 PolarHBondContact O-N 2.92Å; R38-C41 PolarHBondContact O-N 3.47Å; R38-V42 HydrophobicContact CG-CG2 4.29Å; R38-V42 WeakPolarHBondContact O-CB 3.4Å; R38-V42 WeakPolarHBondContact O-CG2 3.46Å; R38-V42 PolarHBondContact O-N 3.3Å; R38-V53 HydrophobicContact CB-CB 4.35Å; R38-V53 HydrophobicContact CB-CG2 4.14Å; R38-I54 HydrophobicContact CG-CB 4.43Å; R38-I54 HydrophobicContact CG-CG1 3.58Å; R38-H57 HydrophobicContact CB-CB 4.47Å; R38-H57 PolarHBondContact NH2-CD2 3.14Å; R38-H57 PolarHBondContact NH2-NE2 3.17Å |
| 39 | D | 91.2 | Very high | 88.3 | Confident | 63 Ų | 63 | 90.7 Ų | 90.7 | 34% | 0.337 | 45% | 0.451 | S | S | . | . | H | α-helix | trans | -57.9 | -49 | 177.8 | -122.7 | -129.3 | 0 | 0 | 0 | 111 | R35 L36 V42 L43 | R35-D39 IonicContact CZ-OD1 2.84Å; R35-D39 IonicContact CZ-OD2 3.34Å; R35-D39 VanDerWaalsContact CZ-OD2 3.27Å; R35-D39 IonicContact NH1-OD1 2.62Å; R35-D39 IonicContact NH1-OD2 3.6Å; R35-D39 PolarHBondContact NH1-OD2 2.86Å; R35-D39 IonicContact NH2-OD1 3.59Å; R35-D39 PolarHBondContact NH2-OD1 3.41Å; R35-D39 IonicContact NH2-OD2 2.76Å; R35-D39 PolarHBondContact NH2-OD2 3.43Å; R35-D39 WeakPolarHBondContact O-CB 3.17Å; R35-D39 PolarHBondContact O-N 3.3Å; L36-D39 PolarHBondContact O-N 2.87Å; D39-V42 PolarHBondContact O-N 2.82Å; D39-L43 VanDerWaalsContact O-CB 3.22Å; D39-L43 WeakPolarHBondContact O-CB 3.44Å; D39-L43 PolarHBondContact O-N 3.39Å |
| 40 | Q | 93.4 | Very high | 89.4 | Confident | 118 Ų | 118 | 86.5 Ų | 86.5 | 55% | 0.551 | 42% | 0.422 | S | S | * | . | H | α-helix | trans | -64.8 | -42 | -179.8 | -178.5 | 168.5 | 80 | 0 | 0 | 111.4 | L36 R38 L43 M44 | L36-Q40 VanDerWaalsContact O-CB 3.27Å; L36-Q40 WeakPolarHBondContact O-CB 3.47Å; L36-Q40 PolarHBondContact O-N 2.88Å; R38-Q40 PolarHBondContact O-N 2.92Å; Q40-L43 PolarHBondContact O-N 2.84Å; Q40-M44 HydrophobicContact CG-CG 4.39Å; Q40-M44 WeakPolarHBondContact O-CB 3.19Å; Q40-M44 WeakPolarHBondContact O-CG 3.16Å; Q40-M44 PolarHBondContact O-N 3.47Å |
| 41 | C | 94.6 | Very high | 90.3 | Very high | 22 Ų | 22 | 88 Ų | 88 | 15% | 0.149 | 44% | 0.435 | C | S | . | . | H | α-helix | trans | -63.5 | -49.7 | 176.6 | -172.3 | 0 | 0 | 0 | 0 | 110.9 | K37 R38 L43 M44 Y45 C50 V53 | K37-C41 WeakPolarHBondContact O-CB 3.4Å; K37-C41 PolarHBondContact O-N 3.4Å; R38-C41 PolarHBondContact O-N 3.47Å; C41-L43 PolarHBondContact O-N 2.96Å; C41-M44 PolarHBondContact O-N 3.47Å; C41-M44 VanDerWaalsContact O-N 3.12Å; C41-Y45 PolarHBondContact O-N 2.83Å; C41-C50 VanDerWaalsContact CA-SG 3.5Å; C41-C50 HydrophobicContact CB-CB 3.81Å; C41-C50 WeakPolarHBondContact CB-SG 3.22Å; C41-C50 PolarHBondContact O-SG 3.32Å; C41-C50 VanDerWaalsContact SG-CA 3.57Å; C41-C50 WeakPolarHBondContact SG-CB 3.4Å; C41-C50 CovalentContact SG-SG 2.03Å; C41-C50 PolarHBondContact SG-SG 3.48Å; C41-V53 HydrophobicContact CB-CG2 3.68Å |
| 42 | V | 94.7 | Very high | 90.7 | Very high | 54 Ų | 54 | 93.7 Ų | 93.7 | 33% | 0.327 | 47% | 0.465 | S | S | . | . | H | α-helix | trans | -60.8 | -38.2 | 179.7 | 173.2 | 0 | 0 | 0 | 0 | 110.6 | R38 D39 G46 C50 I54 | R38-V42 HydrophobicContact CG-CG2 4.29Å; R38-V42 WeakPolarHBondContact O-CB 3.4Å; R38-V42 WeakPolarHBondContact O-CG2 3.46Å; R38-V42 PolarHBondContact O-N 3.3Å; D39-V42 PolarHBondContact O-N 2.82Å; V42-G46 VanDerWaalsContact O-CA 3.23Å; V42-G46 WeakPolarHBondContact O-CA 3.38Å; V42-G46 PolarHBondContact O-N 3.24Å; V42-C50 HydrophobicContact CG2-CB 4.05Å; V42-C50 PolarHBondContact N-SG 2.98Å; V42-C50 VanDerWaalsContact N-SG 3.42Å; V42-I54 HydrophobicContact CG2-CD1 4.43Å |
| 43 | L | 93.2 | Very high | 91.1 | Very high | 145 Ų | 145 | 90.7 Ų | 90.7 | 76% | 0.759 | 45% | 0.445 | S | S | * | . | H | α-helix | trans | -65.8 | -38 | 176.4 | -174 | 68.6 | 0 | 0 | 0 | 112.8 | D39 Q40 C41 | D39-L43 VanDerWaalsContact O-CB 3.22Å; D39-L43 WeakPolarHBondContact O-CB 3.44Å; D39-L43 PolarHBondContact O-N 3.39Å; Q40-L43 PolarHBondContact O-N 2.84Å; C41-L43 PolarHBondContact O-N 2.96Å |
| 44 | M | 94.9 | Very high | 91.3 | Very high | 128 Ų | 128 | 83.9 Ų | 83.9 | 63% | 0.631 | 41% | 0.414 | S | S | * | . | H | α-helix | trans | -88.5 | -37.7 | -174.7 | -67.5 | -66.6 | -177.9 | 0 | 0 | 113.6 | Q40 C41 | Q40-M44 HydrophobicContact CG-CG 4.39Å; Q40-M44 WeakPolarHBondContact O-CB 3.19Å; Q40-M44 WeakPolarHBondContact O-CG 3.16Å; Q40-M44 PolarHBondContact O-N 3.47Å; C41-M44 PolarHBondContact O-N 3.47Å; C41-M44 VanDerWaalsContact O-N 3.12Å |
| 45 | Y | 93.4 | Very high | 91.3 | Very high | 167 Ų | 167 | 89 Ų | 89 | 66% | 0.655 | 44% | 0.438 | S | S | * | . | H | α-helix | trans | -122.6 | -13.6 | -169.9 | -55.6 | -75.1 | 0 | 0 | 0 | 114 | C41 | C41-Y45 PolarHBondContact O-N 2.83Å |
| 46 | G | 90.7 | Very high | 91.5 | Very high | 22 Ų | 22 | 89.3 Ų | 89.3 | 23% | 0.227 | 44% | 0.443 | C | S | . | . | trans | 87 | 162.6 | -171.7 | 0 | 0 | 0 | 0 | 0 | 113.6 | V42 E48 K49 C50 | V42-G46 VanDerWaalsContact O-CA 3.23Å; V42-G46 WeakPolarHBondContact O-CA 3.38Å; V42-G46 PolarHBondContact O-N 3.24Å; G46-E48 VanDerWaalsContact C-N 3.25Å; G46-E48 PolarHBondContact O-N 3.46Å; G46-K49 PolarHBondContact O-N 3.34Å; G46-C50 PolarHBondContact O-SG 3.36Å | ||
| 47 | E | 87.4 | Confident | 91.5 | Very high | 136 Ų | 136 | 84.8 Ų | 84.8 | 64% | 0.636 | 42% | 0.418 | S | S | * | . | G | 310 helix | trans | -61.2 | -34.3 | -175.7 | -164.2 | 177.8 | 177.2 | 0 | 0 | 112.9 | K49 C50 I54 | E47-K49 VanDerWaalsContact C-N 3.33Å; E47-K49 PolarHBondContact O-N 3.03Å; E47-C50 PolarHBondContact O-N 2.83Å; E47-C50 VanDerWaalsContact O-N 3.07Å; E47-I54 HydrophobicContact CG-CD1 3.42Å; E47-I54 VanDerWaalsContact CG-CD1 3.42Å |
| 48 | E | 90.1 | Very high | 91.4 | Very high | 167 Ų | 167 | 84.1 Ų | 84.1 | 78% | 0.78 | 42% | 0.416 | S | S | * | . | G | 310 helix | trans | -62.1 | -33.7 | -177.3 | 66.5 | -153.3 | 106.8 | 0 | 0 | 114.2 | G46 | G46-E48 VanDerWaalsContact C-N 3.25Å; G46-E48 PolarHBondContact O-N 3.46Å |
| 49 | K | 89.1 | Confident | 91.3 | Very high | 153 Ų | 153 | 86 Ų | 86 | 67% | 0.665 | 43% | 0.427 | S | S | * | . | G | 310 helix | trans | -88.9 | -9.1 | 177.3 | -68.5 | -62.1 | -174.2 | -178.9 | 0 | 113 | G46 E47 | G46-K49 PolarHBondContact O-N 3.34Å; E47-K49 VanDerWaalsContact C-N 3.33Å; E47-K49 PolarHBondContact O-N 3.03Å |
| 50 | C | 92.5 | Very high | 91 | Very high | 1 Ų | 1 | 84.5 Ų | 84.5 | 1% | 0.007 | 42% | 0.421 | C | S | . | . | trans | -109.3 | 15.5 | -170.7 | -61.2 | 0 | 0 | 0 | 0 | 112.4 | C41 V42 G46 E47 D52 V53 I54 | C41-C50 VanDerWaalsContact CA-SG 3.5Å; C41-C50 HydrophobicContact CB-CB 3.81Å; C41-C50 WeakPolarHBondContact CB-SG 3.22Å; C41-C50 PolarHBondContact O-SG 3.32Å; C41-C50 VanDerWaalsContact SG-CA 3.57Å; C41-C50 WeakPolarHBondContact SG-CB 3.4Å; C41-C50 CovalentContact SG-SG 2.03Å; C41-C50 PolarHBondContact SG-SG 3.48Å; V42-C50 HydrophobicContact CG2-CB 4.05Å; V42-C50 PolarHBondContact N-SG 2.98Å; V42-C50 VanDerWaalsContact N-SG 3.42Å; G46-C50 PolarHBondContact O-SG 3.36Å; E47-C50 PolarHBondContact O-N 2.83Å; E47-C50 VanDerWaalsContact O-N 3.07Å; C50-D52 PolarHBondContact O-N 2.97Å; C50-V53 HydrophobicContact CB-CG2 3.55Å; C50-V53 WeakPolarHBondContact O-CG2 3.36Å; C50-V53 PolarHBondContact O-N 2.92Å; C50-V53 VanDerWaalsContact O-N 3.16Å; C50-I54 HydrophobicContact CB-CD1 4.23Å; C50-I54 WeakPolarHBondContact O-CB 3.46Å; C50-I54 WeakPolarHBondContact O-CD1 3.39Å; C50-I54 WeakPolarHBondContact O-CG1 3.27Å; C50-I54 PolarHBondContact O-N 3.19Å | ||
| 51 | A | 91.9 | Very high | 90.6 | Very high | 50 Ų | 50 | 79.2 Ų | 79.2 | 41% | 0.413 | 40% | 0.397 | S | S | . | . | H | α-helix | trans | -50.6 | -41.2 | 177 | 0 | 0 | 0 | 0 | 0 | 112.1 | I54 M55 | A51-I54 PolarHBondContact O-N 2.01Å; A51-M55 VanDerWaalsContact O-CB 3.31Å; A51-M55 WeakPolarHBondContact O-CB 3.21Å; A51-M55 PolarHBondContact O-N 3.47Å |
| 52 | D | 91.3 | Very high | 90.1 | Very high | 124 Ų | 124 | 86.3 Ų | 86.3 | 66% | 0.663 | 42% | 0.42 | S | S | * | . | H | α-helix | trans | -63.2 | -49 | 179.7 | -59.6 | -34 | 0 | 0 | 0 | 112.2 | C50 I54 M55 E56 | C50-D52 PolarHBondContact O-N 2.97Å; D52-I54 VanDerWaalsContact C-N 3.34Å; D52-I54 PolarHBondContact O-N 3.37Å; D52-M55 WeakPolarHBondContact O-CB 3.45Å; D52-M55 PolarHBondContact O-N 2.91Å; D52-E56 PolarHBondContact O-N 3.35Å |
| 53 | V | 91.7 | Very high | 89.5 | Confident | 17 Ų | 17 | 91.3 Ų | 91.3 | 10% | 0.103 | 44% | 0.438 | C | S | . | . | H | α-helix | trans | -71.7 | -29.5 | 179.3 | -63 | 0 | 0 | 0 | 0 | 112.4 | K37 R38 C41 C50 H57 | K37-V53 HydrophobicContact CD-CG1 3.98Å; K37-V53 HydrophobicContact CG-CB 4.5Å; K37-V53 HydrophobicContact CG-CG1 3.88Å; R38-V53 HydrophobicContact CB-CB 4.35Å; R38-V53 HydrophobicContact CB-CG2 4.14Å; C41-V53 HydrophobicContact CB-CG2 3.68Å; C50-V53 HydrophobicContact CB-CG2 3.55Å; C50-V53 WeakPolarHBondContact O-CG2 3.36Å; C50-V53 PolarHBondContact O-N 2.92Å; C50-V53 VanDerWaalsContact O-N 3.16Å; V53-H57 WeakPolarHBondContact O-CB 3.32Å; V53-H57 PolarHBondContact O-N 3.45Å |
| 54 | I | 91.5 | Very high | 88.8 | Confident | 25 Ų | 25 | 88 Ų | 88 | 13% | 0.128 | 42% | 0.421 | C | S | . | . | H | α-helix | trans | -66.8 | -42.6 | 171.6 | -67.1 | 161.1 | 0 | 0 | 0 | 109.8 | R38 V42 E47 C50 A51 D52 H57 K58 | R38-I54 HydrophobicContact CG-CB 4.43Å; R38-I54 HydrophobicContact CG-CG1 3.58Å; V42-I54 HydrophobicContact CG2-CD1 4.43Å; E47-I54 HydrophobicContact CG-CD1 3.42Å; E47-I54 VanDerWaalsContact CG-CD1 3.42Å; C50-I54 HydrophobicContact CB-CD1 4.23Å; C50-I54 WeakPolarHBondContact O-CB 3.46Å; C50-I54 WeakPolarHBondContact O-CD1 3.39Å; C50-I54 WeakPolarHBondContact O-CG1 3.27Å; C50-I54 PolarHBondContact O-N 3.19Å; A51-I54 PolarHBondContact O-N 2.01Å; D52-I54 VanDerWaalsContact C-N 3.34Å; D52-I54 PolarHBondContact O-N 3.37Å; I54-H57 PolarHBondContact O-N 2.92Å; I54-K58 HydrophobicContact CG2-CD 4.25Å; I54-K58 HydrophobicContact CG2-CG 4.47Å; I54-K58 WeakPolarHBondContact O-CB 2.94Å; I54-K58 WeakPolarHBondContact O-CG 3.19Å; I54-K58 PolarHBondContact O-N 3.32Å |
| 55 | M | 89.8 | Confident | 87.9 | Confident | 125 Ų | 125 | 84 Ų | 84 | 62% | 0.616 | 41% | 0.411 | S | S | * | . | H | α-helix | trans | -64.4 | -42.4 | 177.5 | -156.1 | -178.2 | -50.8 | 0 | 0 | 111.1 | A51 D52 H57 K58 E59 | A51-M55 VanDerWaalsContact O-CB 3.31Å; A51-M55 WeakPolarHBondContact O-CB 3.21Å; A51-M55 PolarHBondContact O-N 3.47Å; D52-M55 WeakPolarHBondContact O-CB 3.45Å; D52-M55 PolarHBondContact O-N 2.91Å; M55-H57 VanDerWaalsContact C-N 3.35Å; M55-H57 PolarHBondContact O-N 3Å; M55-K58 PolarHBondContact O-N 3.44Å; M55-E59 WeakPolarHBondContact O-CB 3.09Å; M55-E59 PolarHBondContact O-N 3.34Å |
| 56 | E | 89.2 | Confident | 87 | Confident | 81 Ų | 81 | 77.2 Ų | 77.2 | 38% | 0.379 | 39% | 0.385 | S | S | . | . | H | α-helix | trans | -59.6 | -43.5 | 173.7 | -164 | -175.3 | 86.1 | 0 | 0 | 111.5 | T34 K37 D52 E59 C60 | T34-E56 HydrophobicContact CG2-CG 3.86Å; T34-E56 WeakPolarHBondContact CG2-OE1 3.43Å; K37-E56 IonicContact NZ-OE1 2.7Å; K37-E56 IonicContact NZ-OE2 3.86Å; D52-E56 PolarHBondContact O-N 3.35Å; E56-E59 PolarHBondContact O-N 2.76Å; E56-C60 PolarHBondContact O-N 2.84Å |
| 57 | H | 89.5 | Confident | 85.8 | Confident | 13 Ų | 13 | 81.3 Ų | 81.3 | 6% | 0.06 | 42% | 0.417 | C | S | . | . | H | α-helix | trans | -65 | -45 | 175.5 | -173.9 | 58.6 | 0 | 0 | 0 | 112.6 | T34 R35 R38 V53 I54 M55 E59 C60 L61 | T34-H57 WeakPolarHBondContact OG1-CA 3.37Å; T34-H57 PolarHBondContact OG1-ND1 2.99Å; R35-H57 PolarHBondContact N-ND1 3.38Å; R38-H57 HydrophobicContact CB-CB 4.47Å; R38-H57 PolarHBondContact NH2-CD2 3.14Å; R38-H57 PolarHBondContact NH2-NE2 3.17Å; V53-H57 WeakPolarHBondContact O-CB 3.32Å; V53-H57 PolarHBondContact O-N 3.45Å; I54-H57 PolarHBondContact O-N 2.92Å; M55-H57 VanDerWaalsContact C-N 3.35Å; M55-H57 PolarHBondContact O-N 3Å; H57-E59 VanDerWaalsContact C-N 3.34Å; H57-E59 PolarHBondContact O-N 3.47Å; H57-C60 PolarHBondContact O-N 2.94Å; H57-L61 WeakPolarHBondContact O-CG 2.98Å; H57-L61 PolarHBondContact O-N 3.3Å |
| 58 | K | 87.2 | Confident | 84.9 | Confident | 93 Ų | 93 | 79.5 Ų | 79.5 | 40% | 0.404 | 42% | 0.415 | S | S | . | . | H | α-helix | trans | -61.7 | -40.9 | 175.3 | -75.8 | -177.1 | 178.8 | -172.2 | 0 | 111.9 | I54 M55 L61 R62 V68 | I54-K58 HydrophobicContact CG2-CD 4.25Å; I54-K58 HydrophobicContact CG2-CG 4.47Å; I54-K58 WeakPolarHBondContact O-CB 2.94Å; I54-K58 WeakPolarHBondContact O-CG 3.19Å; I54-K58 PolarHBondContact O-N 3.32Å; M55-K58 PolarHBondContact O-N 3.44Å; K58-L61 PolarHBondContact O-N 3Å; K58-R62 VanDerWaalsContact O-CB 3.32Å; K58-R62 WeakPolarHBondContact O-CB 3.38Å; K58-R62 PolarHBondContact O-N 2.95Å; K58-V68 HydrophobicContact CB-CG2 3.85Å; K58-V68 HydrophobicContact CG-CB 4.25Å; K58-V68 HydrophobicContact CG-CG2 4.02Å |
| 59 | E | 89.1 | Confident | 84.6 | Confident | 101 Ų | 101 | 75.1 Ų | 75.1 | 47% | 0.472 | 40% | 0.397 | S | S | . | . | H | α-helix | trans | -63.2 | -43.7 | 177.3 | -171.4 | -177.6 | 94.7 | 0 | 0 | 111.2 | M55 E56 H57 L61 R62 K63 | M55-E59 WeakPolarHBondContact O-CB 3.09Å; M55-E59 PolarHBondContact O-N 3.34Å; E56-E59 PolarHBondContact O-N 2.76Å; H57-E59 VanDerWaalsContact C-N 3.34Å; H57-E59 PolarHBondContact O-N 3.47Å; E59-L61 VanDerWaalsContact C-N 3.34Å; E59-L61 PolarHBondContact O-N 2.72Å; E59-R62 PolarHBondContact O-N 3.2Å; E59-K63 HydrophobicContact CG-CD 4.28Å; E59-K63 WeakPolarHBondContact O-CB 3.42Å; E59-K63 WeakPolarHBondContact O-CG 3.01Å; E59-K63 PolarHBondContact O-N 2.95Å; E59-K63 WeakPolarHBondContact OE1-CE 3.4Å; E59-K63 IonicContact OE1-NZ 3.27Å; E59-K63 PolarHBondContact OE1-NZ 3.24Å |
| 60 | C | 86 | Confident | 84.4 | Confident | 33 Ų | 33 | 71 Ų | 71 | 22% | 0.223 | 38% | 0.382 | C | S | . | . | H | α-helix | trans | -61.2 | -43.4 | 176.5 | -177.3 | 0 | 0 | 0 | 0 | 111.8 | C31 T34 E56 H57 K63 L64 | C31-C60 HydrophobicContact CB-CB 3.8Å; C31-C60 WeakPolarHBondContact CB-SG 3.09Å; C31-C60 WeakPolarHBondContact SG-CB 3.39Å; C31-C60 CovalentContact SG-SG 2.01Å; C31-C60 PolarHBondContact SG-SG 3.19Å; T34-C60 HydrophobicContact CG2-CB 4.39Å; E56-C60 PolarHBondContact O-N 2.84Å; H57-C60 PolarHBondContact O-N 2.94Å; C60-K63 PolarHBondContact O-N 2.82Å; C60-L64 WeakPolarHBondContact O-CG 3.49Å; C60-L64 PolarHBondContact O-N 2.96Å |
| 61 | L | 84.3 | Confident | 84 | Confident | 6 Ų | 6 | 74.9 Ų | 74.9 | 3% | 0.031 | 40% | 0.403 | C | S | . | . | H | α-helix | trans | -63.4 | -43.1 | 174.2 | -69.9 | 176.9 | 0 | 0 | 0 | 112.2 | P27 A30 H57 K58 E59 K63 L64 G65 F66 V68 | P27-L61 HydrophobicContact CB-CD1 3.72Å; P27-L61 HydrophobicContact CB-CD2 3.53Å; P27-L61 HydrophobicContact CB-CG 4.31Å; A30-L61 HydrophobicContact CB-CD2 3.58Å; H57-L61 WeakPolarHBondContact O-CG 2.98Å; H57-L61 PolarHBondContact O-N 3.3Å; K58-L61 PolarHBondContact O-N 3Å; E59-L61 VanDerWaalsContact C-N 3.34Å; E59-L61 PolarHBondContact O-N 2.72Å; L61-K63 PolarHBondContact O-N 3.06Å; L61-L64 PolarHBondContact O-N 2.89Å; L61-G65 PolarHBondContact O-N 2.62Å; L61-G65 VanDerWaalsContact O-N 3.14Å; L61-F66 HydrophobicContact CB-CB 3.99Å; L61-F66 HydrophobicContact CB-CD2 4.43Å; L61-F66 HydrophobicContact CD2-CD2 3.82Å; L61-F66 HydrophobicContact CD2-CE2 4.32Å; L61-F66 HydrophobicContact CD2-CG 4.25Å; L61-F66 WeakPolarHBondContact O-CB 3.27Å; L61-F66 PolarHBondContact O-N 3.11Å; L61-V68 HydrophobicContact CB-CG1 3.52Å; L61-V68 HydrophobicContact CD1-CG1 3.5Å; L61-V68 VanDerWaalsContact CD1-CG1 3.5Å; L61-V68 HydrophobicContact CG-CG1 4.14Å |
| 62 | R | 84.8 | Confident | 83.5 | Confident | 172 Ų | 172 | 76.4 Ų | 76.4 | 65% | 0.649 | 40% | 0.403 | S | S | * | . | H | α-helix | trans | -62.9 | -40.6 | 176.9 | -171 | -172.7 | -70.9 | 158.9 | -4.6 | 111.9 | K58 E59 L64 G65 | K58-R62 VanDerWaalsContact O-CB 3.32Å; K58-R62 WeakPolarHBondContact O-CB 3.38Å; K58-R62 PolarHBondContact O-N 2.95Å; E59-R62 PolarHBondContact O-N 3.2Å; R62-L64 PolarHBondContact O-N 3.19Å; R62-G65 PolarHBondContact O-N 3.47Å |
| 63 | K | 81.4 | Confident | 83 | Confident | 159 Ų | 159 | 73.4 Ų | 73.4 | 69% | 0.691 | 39% | 0.386 | S | S | * | . | H | α-helix | trans | -60.9 | -34.4 | 175.2 | -80.5 | 170.2 | 171.4 | 163.6 | 0 | 112.2 | E59 C60 L61 G65 | E59-K63 HydrophobicContact CG-CD 4.28Å; E59-K63 WeakPolarHBondContact O-CB 3.42Å; E59-K63 WeakPolarHBondContact O-CG 3.01Å; E59-K63 PolarHBondContact O-N 2.95Å; E59-K63 WeakPolarHBondContact OE1-CE 3.4Å; E59-K63 IonicContact OE1-NZ 3.27Å; E59-K63 PolarHBondContact OE1-NZ 3.24Å; C60-K63 PolarHBondContact O-N 2.82Å; L61-K63 PolarHBondContact O-N 3.06Å; K63-G65 VanDerWaalsContact C-N 3.28Å |
| 64 | L | 79.3 | Confident | 82.4 | Confident | 76 Ų | 76 | 77.1 Ų | 77.1 | 40% | 0.398 | 41% | 0.405 | S | S | . | . | H | α-helix | trans | -79.9 | -10.4 | 175.6 | -67.9 | 166 | 0 | 0 | 0 | 112.7 | P17 A30 C60 L61 R62 F66 | P17-L64 VanDerWaalsContact CB-O 3.27Å; P17-L64 WeakPolarHBondContact CB-O 3.41Å; P17-L64 WeakPolarHBondContact CD-O 3.43Å; P17-L64 HydrophobicContact CG-CB 4.27Å; P17-L64 WeakPolarHBondContact CG-O 3.08Å; A30-L64 HydrophobicContact CB-CD1 3.47Å; A30-L64 VanDerWaalsContact CB-CD1 3.47Å; A30-L64 WeakPolarHBondContact O-CD1 3.17Å; C60-L64 WeakPolarHBondContact O-CG 3.49Å; C60-L64 PolarHBondContact O-N 2.96Å; L61-L64 PolarHBondContact O-N 2.89Å; R62-L64 PolarHBondContact O-N 3.19Å; L64-F66 HydrophobicContact CB-CD2 3.84Å; L64-F66 HydrophobicContact CB-CE2 4.01Å |
| 65 | G | 75.2 | Confident | 81.8 | Confident | 42 Ų | 42 | 80.9 Ų | 80.9 | 43% | 0.433 | 43% | 0.425 | S | S | . | . | T | Hydrogen-bonded Turn | trans | 94.7 | 9.7 | 179.4 | 0 | 0 | 0 | 0 | 0 | 114.4 | L61 R62 K63 | L61-G65 PolarHBondContact O-N 2.62Å; L61-G65 VanDerWaalsContact O-N 3.14Å; R62-G65 PolarHBondContact O-N 3.47Å; K63-G65 VanDerWaalsContact C-N 3.28Å |
| 66 | F | 76 | Confident | 81.2 | Confident | 26 Ų | 26 | 77.5 Ų | 77.5 | 11% | 0.114 | 41% | 0.41 | C | S | . | . | trans | -72.6 | 132.3 | 169.1 | -68 | -80.3 | 0 | 0 | 0 | 110.7 | I16 P17 L25 A30 L61 L64 V68 | I16-F66 HydrophobicContact CG2-CD1 3.91Å; I16-F66 HydrophobicContact CG2-CE1 3.32Å; I16-F66 HydrophobicContact CG2-CZ 4.12Å; P17-F66 HydrophobicContact CG-CD1 4.47Å; P17-F66 HydrophobicContact CG-CD2 3.75Å; P17-F66 HydrophobicContact CG-CE1 4.03Å; P17-F66 HydrophobicContact CG-CE2 3.23Å; P17-F66 HydrophobicContact CG-CG 4.34Å; P17-F66 HydrophobicContact CG-CZ 3.39Å; L25-F66 HydrophobicContact CB-CE2 4.25Å; L25-F66 HydrophobicContact CB-CZ 3.53Å; L25-F66 WeakPolarHBondContact O-CE1 3.21Å; L25-F66 WeakPolarHBondContact O-CZ 3.42Å; A30-F66 HydrophobicContact CB-CD2 4.35Å; A30-F66 HydrophobicContact CB-CE2 3.71Å; A30-F66 HydrophobicContact CB-CZ 4.42Å; L61-F66 HydrophobicContact CB-CB 3.99Å; L61-F66 HydrophobicContact CB-CD2 4.43Å; L61-F66 HydrophobicContact CD2-CD2 3.82Å; L61-F66 HydrophobicContact CD2-CE2 4.32Å; L61-F66 HydrophobicContact CD2-CG 4.25Å; L61-F66 WeakPolarHBondContact O-CB 3.27Å; L61-F66 PolarHBondContact O-N 3.11Å; L64-F66 HydrophobicContact CB-CD2 3.84Å; L64-F66 HydrophobicContact CB-CE2 4.01Å; F66-V68 HydrophobicContact CB-CG1 4.38Å; F66-V68 PolarHBondContact O-N 3.11Å | ||
| 67 | A | 65.5 | Low | 80.5 | Confident | 108 Ų | 108 | 77.2 Ų | 77.2 | 89% | 0.893 | 41% | 0.413 | S | S | * | . | trans | -74.5 | 118.6 | 164.1 | 0 | 0 | 0 | 0 | 0 | 108.6 | ||||
| 68 | V | 67.4 | Low | 79.7 | Confident | 97 Ų | 97 | 83 Ų | 83 | 59% | 0.588 | 45% | 0.445 | S | S | * | . | trans | -126.5 | 0 | 178.4 | -68.2 | 0 | 0 | 0 | 0 | 111.7 | K58 L61 F66 | K58-V68 HydrophobicContact CB-CG2 3.85Å; K58-V68 HydrophobicContact CG-CB 4.25Å; K58-V68 HydrophobicContact CG-CG2 4.02Å; L61-V68 HydrophobicContact CB-CG1 3.52Å; L61-V68 HydrophobicContact CD1-CG1 3.5Å; L61-V68 VanDerWaalsContact CD1-CG1 3.5Å; L61-V68 HydrophobicContact CG-CG1 4.14Å; F66-V68 HydrophobicContact CB-CG1 4.38Å; F66-V68 PolarHBondContact O-N 3.11Å |
Retrieved 68 of 68 residues in 43.5 ms
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