| 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 | 59.8 | Low | 79.6 | Confident | 204 Ų | 204 | 109.5 Ų | 109.5 | 100% | 1.005 | 54% | 0.54 | S | S | * | . | 0 | -21.8 | 0 | -60.1 | -49.9 | -171.5 | 0 | 0 | 115.1 | |||||
| 2 | K | 68.4 | Low | 80.3 | Confident | 137 Ų | 137 | 106 Ų | 106 | 60% | 0.596 | 52% | 0.524 | S | S | * | . | H | α-helix | trans | -79.4 | -29.7 | 178.9 | -52.7 | -171.4 | 166.4 | 176.1 | 0 | 114.7 | L4 F5 I6 F91 | K2-L4 PolarHBondContact O-N 3.4Å; K2-F5 WeakPolarHBondContact O-CB 3.32Å; K2-F5 PolarHBondContact O-N 3.46Å; K2-I6 PolarHBondContact O-N 2.99Å; K2-F91 HydrophobicContact CB-CZ 4.17Å; K2-F91 HydrophobicContact CD-CE1 4.25Å; K2-F91 HydrophobicContact CD-CE2 4.23Å; K2-F91 HydrophobicContact CD-CZ 3.46Å; K2-F91 VanDerWaalsContact CD-CZ 3.46Å; K2-F91 HydrophobicContact CG-CE2 3.98Å; K2-F91 HydrophobicContact CG-CZ 3.53Å |
| 3 | I | 76.3 | Confident | 81.1 | Confident | 143 Ų | 143 | 104.8 Ų | 104.8 | 73% | 0.733 | 52% | 0.519 | S | S | * | . | H | α-helix | trans | -64 | -38.5 | 179.6 | -73.6 | 137.8 | 0 | 0 | 0 | 112.8 | F5 I6 L7 | I3-F5 PolarHBondContact O-N 2.84Å; I3-I6 PolarHBondContact O-N 3.25Å; I3-L7 PolarHBondContact O-N 3.34Å |
| 4 | L | 79.3 | Confident | 81.6 | Confident | 120 Ų | 120 | 104.6 Ų | 104.6 | 63% | 0.628 | 52% | 0.519 | S | S | * | . | H | α-helix | trans | -61.8 | -34 | 176.2 | -87.4 | 153.7 | 0 | 0 | 0 | 112.3 | K2 F8 | K2-L4 PolarHBondContact O-N 3.4Å; L4-F8 PolarHBondContact O-N 2.98Å |
| 5 | F | 74 | Confident | 82 | Confident | 53 Ų | 53 | 107.9 Ų | 107.9 | 23% | 0.232 | 53% | 0.525 | C | S | . | . | H | α-helix | trans | -71.1 | -41.8 | 179 | -174.6 | -104.6 | 0 | 0 | 0 | 112.1 | K2 I3 L7 F8 I9 L84 L88 | K2-F5 WeakPolarHBondContact O-CB 3.32Å; K2-F5 PolarHBondContact O-N 3.46Å; I3-F5 PolarHBondContact O-N 2.84Å; F5-L7 VanDerWaalsContact C-N 3.34Å; F5-F8 WeakPolarHBondContact O-CB 3.23Å; F5-F8 PolarHBondContact O-N 3.22Å; F5-I9 HydrophobicContact CD1-CD1 4.03Å; F5-I9 HydrophobicContact CE1-CD1 3.39Å; F5-I9 HydrophobicContact CE1-CG1 4.26Å; F5-I9 HydrophobicContact CZ-CD1 3.73Å; F5-I9 HydrophobicContact CZ-CG1 4.32Å; F5-I9 PolarHBondContact O-N 3.04Å; F5-L84 HydrophobicContact CE2-CD1 4.43Å; F5-L88 HydrophobicContact CE1-CD2 4.11Å; F5-L88 HydrophobicContact CE2-CG 4.29Å; F5-L88 HydrophobicContact CZ-CD1 4.21Å; F5-L88 HydrophobicContact CZ-CD2 3.57Å; F5-L88 HydrophobicContact CZ-CG 3.76Å |
| 6 | I | 80.5 | Confident | 82 | Confident | 100 Ų | 100 | 110.3 Ų | 110.3 | 51% | 0.513 | 53% | 0.528 | S | S | . | . | H | α-helix | trans | -63.9 | -42.4 | 175.2 | -63.1 | 169.2 | 0 | 0 | 0 | 110.2 | K2 I3 F8 I9 I10 | K2-I6 PolarHBondContact O-N 2.99Å; I3-I6 PolarHBondContact O-N 3.25Å; I6-F8 VanDerWaalsContact C-N 3.3Å; I6-F8 PolarHBondContact O-N 2.83Å; I6-I9 PolarHBondContact O-N 3.36Å; I6-I10 HydrophobicContact CG2-CD1 3.86Å; I6-I10 HydrophobicContact CG2-CG1 4.46Å; I6-I10 VanDerWaalsContact O-CG1 3.3Å; I6-I10 WeakPolarHBondContact O-CG1 3.43Å; I6-I10 PolarHBondContact O-N 3.36Å |
| 7 | L | 85.1 | Confident | 82 | Confident | 96 Ų | 96 | 108.6 Ų | 108.6 | 50% | 0.503 | 52% | 0.523 | S | S | . | . | H | α-helix | trans | -59.2 | -42.2 | 176 | -168.4 | 74.5 | 0 | 0 | 0 | 111.5 | I3 F5 I10 I11 | I3-L7 PolarHBondContact O-N 3.34Å; F5-L7 VanDerWaalsContact C-N 3.34Å; L7-I10 PolarHBondContact O-N 2.94Å; L7-I11 HydrophobicContact CG-CD1 4.34Å; L7-I11 WeakPolarHBondContact O-CG1 3.36Å; L7-I11 PolarHBondContact O-N 3.49Å |
| 8 | F | 83 | Confident | 81.7 | Confident | 99 Ų | 99 | 108.8 Ų | 108.8 | 43% | 0.434 | 52% | 0.523 | S | S | . | . | H | α-helix | trans | -63.3 | -44.1 | 177.6 | -175.5 | -104.3 | 0 | 0 | 0 | 112.6 | L4 F5 I6 I10 I11 I12 L84 | L4-F8 PolarHBondContact O-N 2.98Å; F5-F8 WeakPolarHBondContact O-CB 3.23Å; F5-F8 PolarHBondContact O-N 3.22Å; I6-F8 VanDerWaalsContact C-N 3.3Å; I6-F8 PolarHBondContact O-N 2.83Å; F8-I10 VanDerWaalsContact C-N 3.35Å; F8-I10 PolarHBondContact O-N 3.47Å; F8-I11 PolarHBondContact O-N 3.36Å; F8-I12 HydrophobicContact CD1-CD1 3.95Å; F8-I12 HydrophobicContact CE1-CD1 3.39Å; F8-I12 HydrophobicContact CE1-CG1 4.4Å; F8-I12 HydrophobicContact CZ-CD1 3.72Å; F8-I12 HydrophobicContact CZ-CG1 4.47Å; F8-I12 PolarHBondContact O-N 2.92Å; F8-I12 VanDerWaalsContact O-N 3.15Å; F8-L84 HydrophobicContact CE1-CD1 4.21Å |
| 9 | I | 87.4 | Confident | 81.1 | Confident | 72 Ų | 72 | 106.3 Ų | 106.3 | 37% | 0.369 | 51% | 0.514 | S | S | . | . | H | α-helix | trans | -62.2 | -42.9 | 175.6 | -69.7 | -178.7 | 0 | 0 | 0 | 111.1 | F5 I6 I11 I12 I13 | F5-I9 HydrophobicContact CD1-CD1 4.03Å; F5-I9 HydrophobicContact CE1-CD1 3.39Å; F5-I9 HydrophobicContact CE1-CG1 4.26Å; F5-I9 HydrophobicContact CZ-CD1 3.73Å; F5-I9 HydrophobicContact CZ-CG1 4.32Å; F5-I9 PolarHBondContact O-N 3.04Å; I6-I9 PolarHBondContact O-N 3.36Å; I9-I11 VanDerWaalsContact C-N 3.33Å; I9-I11 PolarHBondContact O-N 3.47Å; I9-I12 PolarHBondContact O-N 3.34Å; I9-I13 HydrophobicContact CG2-CD1 3.62Å; I9-I13 HydrophobicContact CG2-CG1 4.25Å; I9-I13 VanDerWaalsContact O-CG1 3.31Å; I9-I13 WeakPolarHBondContact O-CG1 3.49Å; I9-I13 PolarHBondContact O-N 3.06Å |
| 10 | I | 91.6 | Very high | 80.2 | Confident | 81 Ų | 81 | 107.6 Ų | 107.6 | 42% | 0.415 | 52% | 0.524 | S | S | . | . | H | α-helix | trans | -59.6 | -44.4 | 178.1 | -69.7 | 166.9 | 0 | 0 | 0 | 110.8 | I6 L7 F8 I12 I13 I14 | I6-I10 HydrophobicContact CG2-CD1 3.86Å; I6-I10 HydrophobicContact CG2-CG1 4.46Å; I6-I10 VanDerWaalsContact O-CG1 3.3Å; I6-I10 WeakPolarHBondContact O-CG1 3.43Å; I6-I10 PolarHBondContact O-N 3.36Å; L7-I10 PolarHBondContact O-N 2.94Å; F8-I10 VanDerWaalsContact C-N 3.35Å; F8-I10 PolarHBondContact O-N 3.47Å; I10-I12 PolarHBondContact O-N 3.22Å; I10-I13 PolarHBondContact O-N 3.26Å; I10-I14 HydrophobicContact CG2-CD1 3.62Å; I10-I14 HydrophobicContact CG2-CG1 4.26Å; I10-I14 WeakPolarHBondContact O-CB 3.5Å; I10-I14 VanDerWaalsContact O-CG1 3.26Å; I10-I14 WeakPolarHBondContact O-CG1 3.45Å; I10-I14 PolarHBondContact O-N 3.17Å |
| 11 | I | 90.6 | Very high | 79.3 | Confident | 99 Ų | 99 | 108.8 Ų | 108.8 | 51% | 0.508 | 53% | 0.531 | S | S | . | . | H | α-helix | trans | -60.9 | -44.1 | 178.2 | -67.8 | 165.6 | 0 | 0 | 0 | 111.1 | L7 F8 I9 I14 Y15 | L7-I11 HydrophobicContact CG-CD1 4.34Å; L7-I11 WeakPolarHBondContact O-CG1 3.36Å; L7-I11 PolarHBondContact O-N 3.49Å; F8-I11 PolarHBondContact O-N 3.36Å; I9-I11 VanDerWaalsContact C-N 3.33Å; I9-I11 PolarHBondContact O-N 3.47Å; I11-I14 PolarHBondContact O-N 3.33Å; I11-Y15 WeakPolarHBondContact O-CB 3.48Å; I11-Y15 PolarHBondContact O-N 3.33Å |
| 12 | I | 87.6 | Confident | 79.3 | Confident | 68 Ų | 68 | 103 Ų | 103 | 35% | 0.349 | 50% | 0.504 | S | S | . | . | H | α-helix | trans | -62.5 | -45.2 | 177 | -68.8 | 178.8 | 0 | 0 | 0 | 110.8 | F8 I9 I10 I14 Y15 Y16 | F8-I12 HydrophobicContact CD1-CD1 3.95Å; F8-I12 HydrophobicContact CE1-CD1 3.39Å; F8-I12 HydrophobicContact CE1-CG1 4.4Å; F8-I12 HydrophobicContact CZ-CD1 3.72Å; F8-I12 HydrophobicContact CZ-CG1 4.47Å; F8-I12 PolarHBondContact O-N 2.92Å; F8-I12 VanDerWaalsContact O-N 3.15Å; I9-I12 PolarHBondContact O-N 3.34Å; I10-I12 PolarHBondContact O-N 3.22Å; I12-I14 PolarHBondContact O-N 3.35Å; I12-Y15 PolarHBondContact O-N 2.94Å; I12-Y16 HydrophobicContact CG2-CD2 3.7Å; I12-Y16 HydrophobicContact CG2-CE2 3.9Å; I12-Y16 WeakPolarHBondContact O-CD2 3.45Å; I12-Y16 PolarHBondContact O-N 2.89Å |
| 13 | I | 90.3 | Very high | 78.5 | Confident | 90 Ų | 90 | 99.4 Ų | 99.4 | 46% | 0.462 | 51% | 0.506 | S | S | . | . | H | α-helix | trans | -61.9 | -45.4 | 179 | -68.7 | 170.3 | 0 | 0 | 0 | 110.6 | I9 I10 Y15 Y16 N17 | I9-I13 HydrophobicContact CG2-CD1 3.62Å; I9-I13 HydrophobicContact CG2-CG1 4.25Å; I9-I13 VanDerWaalsContact O-CG1 3.31Å; I9-I13 WeakPolarHBondContact O-CG1 3.49Å; I9-I13 PolarHBondContact O-N 3.06Å; I10-I13 PolarHBondContact O-N 3.26Å; I13-Y15 VanDerWaalsContact C-N 3.35Å; I13-Y16 PolarHBondContact O-N 3.36Å; I13-N17 WeakPolarHBondContact CG2-ND2 3.39Å; I13-N17 WeakPolarHBondContact O-CB 3.43Å; I13-N17 PolarHBondContact O-N 3.02Å; I13-N17 PolarHBondContact O-ND2 3.15Å |
| 14 | I | 89 | Confident | 77.3 | Confident | 102 Ų | 102 | 95.8 Ų | 95.8 | 52% | 0.523 | 49% | 0.493 | S | S | . | . | H | α-helix | trans | -60.1 | -47.7 | 176.6 | -69.4 | 169.1 | 0 | 0 | 0 | 109.7 | I10 I11 I12 Y16 N17 H18 | I10-I14 HydrophobicContact CG2-CD1 3.62Å; I10-I14 HydrophobicContact CG2-CG1 4.26Å; I10-I14 WeakPolarHBondContact O-CB 3.5Å; I10-I14 VanDerWaalsContact O-CG1 3.26Å; I10-I14 WeakPolarHBondContact O-CG1 3.45Å; I10-I14 PolarHBondContact O-N 3.17Å; I11-I14 PolarHBondContact O-N 3.33Å; I12-I14 PolarHBondContact O-N 3.35Å; I14-Y16 PolarHBondContact O-N 2.9Å; I14-N17 PolarHBondContact O-N 3.01Å; I14-H18 VanDerWaalsContact O-CB 3.24Å; I14-H18 WeakPolarHBondContact O-CB 3.45Å; I14-H18 PolarHBondContact O-N 3.34Å |
| 15 | Y | 87 | Confident | 75.7 | Confident | 154 Ų | 154 | 93.2 Ų | 93.2 | 60% | 0.604 | 50% | 0.496 | S | S | * | . | H | α-helix | trans | -59.5 | -46.3 | 179.5 | 179.6 | -93.2 | 0 | 0 | 0 | 112.4 | I11 I12 I13 H18 T19 | I11-Y15 WeakPolarHBondContact O-CB 3.48Å; I11-Y15 PolarHBondContact O-N 3.33Å; I12-Y15 PolarHBondContact O-N 2.94Å; I13-Y15 VanDerWaalsContact C-N 3.35Å; Y15-H18 PolarHBondContact O-N 3.22Å; Y15-T19 WeakPolarHBondContact O-CB 3.39Å; Y15-T19 PolarHBondContact O-N 3.44Å; Y15-T19 PolarHBondContact O-OG1 3.21Å |
| 16 | Y | 82.9 | Confident | 74.3 | Confident | 147 Ų | 147 | 95.5 Ų | 95.5 | 58% | 0.576 | 52% | 0.518 | S | S | * | . | H | α-helix | trans | -66 | -42.8 | 178 | -93.6 | -81.7 | 0 | 0 | 0 | 112.4 | I12 I13 I14 H18 T19 L20 | I12-Y16 HydrophobicContact CG2-CD2 3.7Å; I12-Y16 HydrophobicContact CG2-CE2 3.9Å; I12-Y16 WeakPolarHBondContact O-CD2 3.45Å; I12-Y16 PolarHBondContact O-N 2.89Å; I13-Y16 PolarHBondContact O-N 3.36Å; I14-Y16 PolarHBondContact O-N 2.9Å; Y16-H18 VanDerWaalsContact C-N 3.34Å; Y16-T19 PolarHBondContact O-N 3.27Å; Y16-L20 WeakPolarHBondContact O-CB 3.38Å; Y16-L20 WeakPolarHBondContact O-CD1 3.39Å; Y16-L20 VanDerWaalsContact O-CG 3.3Å; Y16-L20 WeakPolarHBondContact O-CG 3.07Å; Y16-L20 PolarHBondContact O-N 3.35Å |
| 17 | N | 81.6 | Confident | 72.8 | Confident | 82 Ų | 82 | 99.9 Ų | 99.9 | 44% | 0.439 | 53% | 0.534 | S | S | . | . | H | α-helix | trans | -63.5 | -42.3 | 175.6 | -82.9 | -82.4 | 0 | 0 | 0 | 111 | I13 I14 T19 L20 I21 | I13-N17 WeakPolarHBondContact CG2-ND2 3.39Å; I13-N17 WeakPolarHBondContact O-CB 3.43Å; I13-N17 PolarHBondContact O-N 3.02Å; I13-N17 PolarHBondContact O-ND2 3.15Å; I14-N17 PolarHBondContact O-N 3.01Å; N17-T19 VanDerWaalsContact C-N 3.35Å; N17-T19 PolarHBondContact O-N 3.06Å; N17-L20 PolarHBondContact O-N 2.99Å; N17-I21 HydrophobicContact CB-CD1 4.41Å; N17-I21 VanDerWaalsContact O-CB 3.27Å; N17-I21 WeakPolarHBondContact O-CB 3.3Å; N17-I21 WeakPolarHBondContact O-CD1 3.22Å; N17-I21 WeakPolarHBondContact O-CG1 3.25Å; N17-I21 PolarHBondContact O-N 2.88Å |
| 18 | H | 75.8 | Confident | 71 | Confident | 112 Ų | 112 | 100.5 Ų | 100.5 | 52% | 0.519 | 54% | 0.544 | S | S | . | . | H | α-helix | trans | -63.4 | -41.6 | 176.1 | -160.3 | -83.7 | 0 | 0 | 0 | 111.3 | I14 Y15 Y16 L20 I21 D22 | I14-H18 VanDerWaalsContact O-CB 3.24Å; I14-H18 WeakPolarHBondContact O-CB 3.45Å; I14-H18 PolarHBondContact O-N 3.34Å; Y15-H18 PolarHBondContact O-N 3.22Å; Y16-H18 VanDerWaalsContact C-N 3.34Å; H18-L20 VanDerWaalsContact C-N 3.34Å; H18-L20 PolarHBondContact O-N 3.33Å; H18-I21 PolarHBondContact O-N 3.49Å; H18-D22 IonicContact CE1-OD1 3.98Å; H18-D22 IonicContact CE1-OD2 2.74Å; H18-D22 PolarHBondContact CE1-OD2 3.39Å; H18-D22 IonicContact CG-OD2 3.84Å; H18-D22 IonicContact ND1-OD2 2.74Å; H18-D22 PolarHBondContact ND1-OD2 3.07Å; H18-D22 IonicContact NE2-OD2 3.8Å; H18-D22 WeakPolarHBondContact O-CB 3.29Å; H18-D22 VanDerWaalsContact O-CG 3.31Å; H18-D22 PolarHBondContact O-N 3.28Å |
| 19 | T | 71.8 | Confident | 69 | Low | 60 Ų | 60 | 102.5 Ų | 102.5 | 37% | 0.368 | 56% | 0.559 | S | S | . | * | H | α-helix | trans | -66.5 | -36.2 | 176.7 | -49.9 | 0 | 0 | 0 | 0 | 111.9 | Y15 Y16 N17 G23 | Y15-T19 WeakPolarHBondContact O-CB 3.39Å; Y15-T19 PolarHBondContact O-N 3.44Å; Y15-T19 PolarHBondContact O-OG1 3.21Å; Y16-T19 PolarHBondContact O-N 3.27Å; N17-T19 VanDerWaalsContact C-N 3.35Å; N17-T19 PolarHBondContact O-N 3.06Å; T19-G23 PolarHBondContact O-N 3.34Å |
| 20 | L | 62.3 | Low | 67.1 | Low | 133 Ų | 133 | 109.6 Ų | 109.6 | 70% | 0.696 | 58% | 0.581 | S | S | * | * | H | α-helix | trans | -72 | -41.2 | 176.1 | -79.1 | 163.6 | 0 | 0 | 0 | 112.4 | Y16 N17 H18 | Y16-L20 WeakPolarHBondContact O-CB 3.38Å; Y16-L20 WeakPolarHBondContact O-CD1 3.39Å; Y16-L20 VanDerWaalsContact O-CG 3.3Å; Y16-L20 WeakPolarHBondContact O-CG 3.07Å; Y16-L20 PolarHBondContact O-N 3.35Å; N17-L20 PolarHBondContact O-N 2.99Å; H18-L20 VanDerWaalsContact C-N 3.34Å; H18-L20 PolarHBondContact O-N 3.33Å |
| 21 | I | 61.3 | Low | 64.9 | Low | 133 Ų | 133 | 109.7 Ų | 109.7 | 68% | 0.682 | 59% | 0.585 | S | S | * | * | H | α-helix | trans | -73.6 | -41.3 | 179.5 | -68.4 | 164.7 | 0 | 0 | 0 | 110.4 | N17 H18 G23 | N17-I21 HydrophobicContact CB-CD1 4.41Å; N17-I21 VanDerWaalsContact O-CB 3.27Å; N17-I21 WeakPolarHBondContact O-CB 3.3Å; N17-I21 WeakPolarHBondContact O-CD1 3.22Å; N17-I21 WeakPolarHBondContact O-CG1 3.25Å; N17-I21 PolarHBondContact O-N 2.88Å; H18-I21 PolarHBondContact O-N 3.49Å; I21-G23 VanDerWaalsContact C-N 3.26Å; I21-G23 PolarHBondContact O-N 3.41Å |
| 22 | D | 60.6 | Low | 63.2 | Low | 83 Ų | 83 | 111.8 Ų | 111.8 | 44% | 0.444 | 60% | 0.597 | S | S | . | * | H | α-helix | trans | -75.2 | -16.5 | 179.3 | -76.6 | -10.3 | 0 | 0 | 0 | 112.9 | H18 S24 | H18-D22 IonicContact CE1-OD1 3.98Å; H18-D22 IonicContact CE1-OD2 2.74Å; H18-D22 PolarHBondContact CE1-OD2 3.39Å; H18-D22 IonicContact CG-OD2 3.84Å; H18-D22 IonicContact ND1-OD2 2.74Å; H18-D22 PolarHBondContact ND1-OD2 3.07Å; H18-D22 IonicContact NE2-OD2 3.8Å; H18-D22 WeakPolarHBondContact O-CB 3.29Å; H18-D22 VanDerWaalsContact O-CG 3.31Å; H18-D22 PolarHBondContact O-N 3.28Å; D22-S24 WeakPolarHBondContact O-CB 3.5Å; D22-S24 PolarHBondContact O-N 2.72Å |
| 23 | G | 50.5 | Low | 61.2 | Low | 61 Ų | 61 | 115 Ų | 115 | 63% | 0.629 | 61% | 0.614 | S | S | * | * | trans | 52.7 | 10.9 | 177.2 | 0 | 0 | 0 | 0 | 0 | 114.5 | T19 I21 G25 | T19-G23 PolarHBondContact O-N 3.34Å; I21-G23 VanDerWaalsContact C-N 3.26Å; I21-G23 PolarHBondContact O-N 3.41Å; G23-G25 VanDerWaalsContact C-N 3.33Å; G23-G25 PolarHBondContact O-N 3.21Å | ||
| 24 | S | 50.5 | Low | 59.3 | Low | 66 Ų | 66 | 116.5 Ų | 116.5 | 46% | 0.462 | 62% | 0.623 | S | S | . | * | trans | -102.8 | 63.9 | -167.7 | 66.7 | 0 | 0 | 0 | 0 | 108.8 | D22 S26 | D22-S24 WeakPolarHBondContact O-CB 3.5Å; D22-S24 PolarHBondContact O-N 2.72Å; S24-S26 PolarHBondContact O-N 3.14Å | ||
| 25 | G | 46 | Very low | 57.5 | Low | 66 Ų | 66 | 116.6 Ų | 116.6 | 68% | 0.68 | 63% | 0.628 | S | S | * | * | -55 | 77.5 | 122.9 | 0 | 0 | 0 | 0 | 0 | 107.1 | G23 F27 | G23-G25 VanDerWaalsContact C-N 3.33Å; G23-G25 PolarHBondContact O-N 3.21Å; G25-F27 PolarHBondContact O-N 3.43Å | |||
| 26 | S | 45.7 | Very low | 55.5 | Low | 101 Ų | 101 | 115.8 Ų | 115.8 | 71% | 0.706 | 64% | 0.639 | S | S | * | * | trans | -64.7 | 85.8 | 175.5 | 38.5 | 0 | 0 | 0 | 0 | 105.3 | S24 P28 | S24-S26 PolarHBondContact O-N 3.14Å; S26-P28 VanDerWaalsContact O-N 3.17Å | ||
| 27 | F | 49 | Very low | 54.1 | Low | 192 Ų | 192 | 115.8 Ų | 115.8 | 84% | 0.842 | 65% | 0.649 | S | S | * | * | trans | -47.1 | 125.2 | 161.4 | -112.1 | -95.7 | 0 | 0 | 0 | 105.3 | G25 N29 | G25-F27 PolarHBondContact O-N 3.43Å; F27-N29 PolarHBondContact O-N 2.91Å | ||
| 28 | P | 45.8 | Very low | 52.3 | Low | 110 Ų | 110 | 118.2 Ų | 118.2 | 71% | 0.714 | 67% | 0.667 | S | S | * | * | trans | -53.7 | 116.8 | 173 | 21.8 | -30.1 | 0 | 0 | 0 | 105.4 | S26 R30 | S26-P28 VanDerWaalsContact O-N 3.17Å; P28-R30 PolarHBondContact O-N 3.08Å | ||
| 29 | N | 41.9 | Very low | 51.5 | Low | 140 Ų | 140 | 121.3 Ų | 121.3 | 75% | 0.749 | 68% | 0.682 | S | S | * | * | trans | -54.5 | 88.2 | 171.3 | -173 | 2.9 | 0 | 0 | 0 | 105.8 | F27 T31 | F27-N29 PolarHBondContact O-N 2.91Å; N29-T31 VanDerWaalsContact CG-OG1 3.23Å; N29-T31 PolarHBondContact ND2-OG1 2.98Å; N29-T31 PolarHBondContact O-N 3.35Å; N29-T31 PolarHBondContact OD1-N 3.35Å; N29-T31 PolarHBondContact OD1-OG1 3.11Å | ||
| 30 | R | 46.9 | Very low | 50.7 | Low | 221 Ų | 221 | 122.4 Ų | 122.4 | 83% | 0.834 | 69% | 0.692 | S | S | * | * | trans | -69.7 | 75.2 | 157.9 | -99.5 | -168.3 | 178.4 | 178 | 0.8 | 104.4 | P28 L32 | P28-R30 PolarHBondContact O-N 3.08Å; R30-L32 PolarHBondContact O-N 2.87Å | ||
| 31 | T | 46.3 | Very low | 49.8 | Very low | 83 Ų | 83 | 122.5 Ų | 122.5 | 51% | 0.509 | 70% | 0.698 | S | S | . | * | trans | -58.1 | 99.3 | 148.3 | -38.2 | 0 | 0 | 0 | 0 | 103.8 | N29 I33 | N29-T31 VanDerWaalsContact CG-OG1 3.23Å; N29-T31 PolarHBondContact ND2-OG1 2.98Å; N29-T31 PolarHBondContact O-N 3.35Å; N29-T31 PolarHBondContact OD1-N 3.35Å; N29-T31 PolarHBondContact OD1-OG1 3.11Å; T31-I33 HydrophobicContact CG2-CD1 4.16Å; T31-I33 HydrophobicContact CG2-CG1 3.73Å; T31-I33 PolarHBondContact O-N 3.37Å | ||
| 32 | L | 54.4 | Low | 49.2 | Very low | 144 Ų | 144 | 124.8 Ų | 124.8 | 75% | 0.754 | 71% | 0.706 | S | S | * | * | trans | -72.4 | 73.1 | 174.7 | -145.7 | 138.4 | 0 | 0 | 0 | 105.8 | R30 N34 | R30-L32 PolarHBondContact O-N 2.87Å; L32-N34 PolarHBondContact O-N 2.91Å | ||
| 33 | I | 46.5 | Very low | 48.7 | Very low | 135 Ų | 135 | 125.4 Ų | 125.4 | 69% | 0.692 | 72% | 0.717 | S | S | * | * | trans | -73.9 | 97.9 | 165.5 | -58.9 | 174.1 | 0 | 0 | 0 | 104.2 | T31 | T31-I33 HydrophobicContact CG2-CD1 4.16Å; T31-I33 HydrophobicContact CG2-CG1 3.73Å; T31-I33 PolarHBondContact O-N 3.37Å | ||
| 34 | N | 48.8 | Very low | 49 | Very low | 122 Ų | 122 | 128.6 Ų | 128.6 | 65% | 0.652 | 73% | 0.729 | S | S | * | * | trans | 161.9 | 120.6 | 158.4 | -81.8 | -10.3 | 0 | 0 | 0 | 105.8 | L32 | L32-N34 PolarHBondContact O-N 2.91Š| ||
| 35 | T | 51 | Low | 48.9 | Very low | 104 Ų | 104 | 132.8 Ų | 132.8 | 64% | 0.638 | 75% | 0.746 | S | S | * | * | cis | -171.7 | 116.9 | 15.1 | 13.8 | 0 | 0 | 0 | 0 | 105.2 | N37 | T35-N37 VanDerWaalsContact C-N 3.35Å; T35-N37 PolarHBondContact O-N 3.25Å | ||
| 36 | T | 46.6 | Very low | 48.9 | Very low | 136 Ų | 136 | 138.9 Ų | 138.9 | 83% | 0.834 | 75% | 0.754 | S | S | * | * | trans | -83.4 | 83.3 | 163.7 | -46.3 | 0 | 0 | 0 | 0 | 107 | ||||
| 37 | N | 53 | Low | 49 | Very low | 148 Ų | 148 | 139 Ų | 139 | 79% | 0.791 | 75% | 0.754 | S | S | * | * | trans | -103.8 | 87.8 | 166.7 | -76.6 | 1.2 | 0 | 0 | 0 | 108.1 | T35 | T35-N37 VanDerWaalsContact C-N 3.35Å; T35-N37 PolarHBondContact O-N 3.25Å | ||
| 38 | T | 44.2 | Very low | 49.1 | Very low | 132 Ų | 132 | 138.5 Ų | 138.5 | 81% | 0.81 | 75% | 0.754 | S | S | * | * | trans | -106.4 | 86.4 | 159.4 | -50.1 | 0 | 0 | 0 | 0 | 106.9 | ||||
| 39 | E | 57.4 | Low | 49.7 | Very low | 178 Ų | 178 | 141.4 Ų | 141.4 | 83% | 0.832 | 76% | 0.763 | S | S | * | * | trans | -134.8 | 101.3 | 154.4 | -113.3 | -171.2 | 143.6 | 0 | 0 | 104.4 | ||||
| 40 | S | 55.7 | Low | 49.8 | Very low | 83 Ų | 83 | 139.6 Ų | 139.6 | 58% | 0.58 | 76% | 0.759 | S | S | * | * | 64.4 | 98.6 | 102.6 | 69.2 | 0 | 0 | 0 | 0 | 113.8 | |||||
| 41 | T | 42.7 | Very low | 50.2 | Low | 134 Ų | 134 | 137.7 Ų | 137.7 | 82% | 0.822 | 76% | 0.76 | S | S | * | * | 43.6 | 113.4 | 126.3 | -33.5 | 0 | 0 | 0 | 0 | 118.2 | |||||
| 42 | E | 49.5 | Very low | 50.6 | Low | 182 Ų | 182 | 138.6 Ų | 138.6 | 85% | 0.85 | 78% | 0.776 | S | S | * | * | 168.5 | 150.9 | 108.5 | -159.8 | 167.6 | 166.4 | 0 | 0 | 111.7 | |||||
| 43 | S | 49.5 | Very low | 50.7 | Low | 95 Ų | 95 | 139.6 Ų | 139.6 | 66% | 0.664 | 78% | 0.777 | S | S | * | * | trans | -46.2 | 143.3 | -174.2 | 56.9 | 0 | 0 | 0 | 0 | 118.6 | ||||
| 44 | S | 57.9 | Low | 51 | Low | 128 Ų | 128 | 138.7 Ų | 138.7 | 90% | 0.895 | 78% | 0.779 | S | S | * | * | -159 | 134 | 118.5 | -134 | 0 | 0 | 0 | 0 | 112.9 | |||||
| 45 | L | 48.9 | Very low | 51.4 | Low | 155 Ų | 155 | 138.6 Ų | 138.6 | 81% | 0.812 | 78% | 0.784 | S | S | * | * | trans | -86.9 | 145.4 | -175.1 | -107 | 139.7 | 0 | 0 | 0 | 110.9 | ||||
| 46 | K | 45.8 | Very low | 51.8 | Low | 194 Ų | 194 | 138.7 Ų | 138.7 | 84% | 0.843 | 79% | 0.788 | S | S | * | * | trans | 84 | 131.1 | 143.9 | -118.9 | 170.3 | -178.4 | 177.2 | 0 | 119.8 | ||||
| 47 | S | 47.9 | Very low | 52.4 | Low | 103 Ų | 103 | 140.2 Ų | 140.2 | 72% | 0.72 | 79% | 0.79 | S | S | * | * | trans | 87.4 | 98.4 | 153.9 | 116.9 | 0 | 0 | 0 | 0 | 117.3 | ||||
| 48 | Q | 51.2 | Low | 52.2 | Low | 181 Ų | 181 | 140 Ų | 140 | 85% | 0.846 | 79% | 0.786 | S | S | * | * | -179.6 | 112.6 | 108.3 | -93.2 | 179.4 | 10.2 | 0 | 0 | 109.6 | |||||
| 49 | L | 56.9 | Low | 53 | Low | 171 Ų | 171 | 143.9 Ų | 143.9 | 90% | 0.895 | 79% | 0.792 | S | S | * | * | trans | -75 | 136.8 | 151.9 | -146.6 | 84.3 | 0 | 0 | 0 | 105 | ||||
| 50 | P | 44.8 | Very low | 52.9 | Low | 102 Ų | 102 | 142 Ų | 142 | 66% | 0.662 | 78% | 0.783 | S | S | * | * | -149.8 | 172.4 | 81.9 | 38.2 | -17.7 | 0 | 0 | 0 | 115.4 | |||||
| 51 | E | 54.4 | Low | 53 | Low | 181 Ų | 181 | 142.5 Ų | 142.5 | 85% | 0.846 | 79% | 0.787 | S | S | * | * | trans | 91.4 | 102.6 | 157.8 | -52.4 | -165.1 | 142.5 | 0 | 0 | 119.4 | Q53 | E51-Q53 PolarHBondContact O-N 3.45Š| ||
| 52 | A | 54.7 | Low | 53.7 | Low | 103 Ų | 103 | 144 Ų | 144 | 85% | 0.851 | 78% | 0.784 | S | S | * | * | trans | -60.8 | 115.5 | 159.7 | 0 | 0 | 0 | 0 | 0 | 110.7 | ||||
| 53 | Q | 56.5 | Low | 54.2 | Low | 165 Ų | 165 | 144 Ų | 144 | 77% | 0.771 | 78% | 0.782 | S | S | * | * | trans | -112.2 | 115.5 | 160.7 | -113.6 | -172.4 | 4.4 | 0 | 0 | 108.9 | E51 T55 | E51-Q53 PolarHBondContact O-N 3.45Å; Q53-T55 PolarHBondContact O-N 2.89Å; Q53-T55 VanDerWaalsContact O-N 3.09Å | ||
| 54 | P | 53.1 | Low | 55 | Low | 115 Ų | 115 | 143.3 Ų | 143.3 | 75% | 0.747 | 78% | 0.776 | S | S | * | * | trans | -79.6 | 88.8 | 168.4 | 32.3 | -28.3 | 0 | 0 | 0 | 107.5 | S56 | P54-S56 PolarHBondContact O-N 3.41Š| ||
| 55 | T | 58.6 | Low | 55.6 | Low | 121 Ų | 121 | 141.5 Ų | 141.5 | 74% | 0.742 | 76% | 0.764 | S | S | * | * | trans | -76 | 73.6 | 167.2 | 46.1 | 0 | 0 | 0 | 0 | 109.7 | Q53 | Q53-T55 PolarHBondContact O-N 2.89Å; Q53-T55 VanDerWaalsContact O-N 3.09Å | ||
| 56 | S | 59.7 | Low | 57.2 | Low | 105 Ų | 105 | 136.6 Ų | 136.6 | 73% | 0.734 | 75% | 0.746 | S | S | * | * | trans | -83.5 | 96.5 | 155.7 | 61.3 | 0 | 0 | 0 | 0 | 108.2 | P54 | P54-S56 PolarHBondContact O-N 3.41Š| ||
| 57 | L | 58.8 | Low | 59 | Low | 169 Ų | 169 | 134.6 Ų | 134.6 | 89% | 0.885 | 73% | 0.734 | S | S | * | * | trans | -143.7 | 105.5 | 168 | -105.4 | 148.3 | 0 | 0 | 0 | 109.8 | ||||
| 58 | M | 48.7 | Very low | 60.5 | Low | 143 Ų | 143 | 136.9 Ų | 136.9 | 70% | 0.704 | 73% | 0.731 | S | S | * | * | trans | -28.1 | 122.1 | -179.2 | -74 | 164.7 | 137.4 | 0 | 0 | 117.6 | Q60 | M58-Q60 VanDerWaalsContact C-N 3.27Å; M58-Q60 HydrophobicContact CB-CB 4.35Å; M58-Q60 HydrophobicContact CB-CG 4.33Å; M58-Q60 PolarHBondContact O-N 3.42Å; M58-Q60 VanDerWaalsContact O-N 3.07Å | ||
| 59 | K | 59.8 | Low | 62.1 | Low | 214 Ų | 214 | 134.8 Ų | 134.8 | 93% | 0.93 | 72% | 0.719 | S | S | * | * | trans | -74.4 | 77.8 | 149.8 | -91 | -179 | 173.4 | 173.2 | 0 | 109.5 | ||||
| 60 | Q | 56.5 | Low | 63.6 | Low | 138 Ų | 138 | 134 Ų | 134 | 65% | 0.645 | 71% | 0.709 | S | S | * | * | trans | -119.7 | 5.8 | 169.5 | -78.4 | -166.9 | -14.5 | 0 | 0 | 114.1 | M58 | M58-Q60 VanDerWaalsContact C-N 3.27Å; M58-Q60 HydrophobicContact CB-CB 4.35Å; M58-Q60 HydrophobicContact CB-CG 4.33Å; M58-Q60 PolarHBondContact O-N 3.42Å; M58-Q60 VanDerWaalsContact O-N 3.07Å | ||
| 61 | S | 58.1 | Low | 65.5 | Low | 93 Ų | 93 | 136.8 Ų | 136.8 | 65% | 0.65 | 71% | 0.706 | S | S | * | * | S | Bend | trans | -81.3 | -16.4 | -169.1 | 53.9 | 0 | 0 | 0 | 0 | 116.6 | ||
| 62 | H | 56.1 | Low | 67.1 | Low | 165 Ų | 165 | 131.9 Ų | 131.9 | 76% | 0.764 | 69% | 0.689 | S | S | * | * | S | Bend | trans | -85.6 | -19.9 | -173.8 | -87.7 | -92.1 | 0 | 0 | 0 | 115.9 | ||
| 63 | F | 60.2 | Low | 68.6 | Low | 184 Ų | 184 | 134.1 Ų | 134.1 | 81% | 0.807 | 68% | 0.675 | S | S | * | * | H | α-helix | trans | -79.5 | -23.9 | -179.4 | -81.1 | -80.4 | 0 | 0 | 0 | 113.8 | S65 Y67 | F63-S65 VanDerWaalsContact C-N 3.34Å; F63-S65 PolarHBondContact O-N 2.87Å; F63-Y67 PolarHBondContact O-N 3.25Å |
| 64 | S | 66.2 | Low | 70.2 | Confident | 79 Ų | 79 | 132.6 Ų | 132.6 | 55% | 0.552 | 67% | 0.666 | S | S | * | * | H | α-helix | trans | -68.4 | -32.3 | -176.3 | -164.5 | 0 | 0 | 0 | 0 | 113 | K68 | S64-K68 PolarHBondContact O-N 3.37Å |
| 65 | S | 71.8 | Confident | 71.9 | Confident | 90 Ų | 90 | 131.4 Ų | 131.4 | 63% | 0.629 | 66% | 0.657 | S | S | * | * | H | α-helix | trans | -75.4 | -46.1 | -178.5 | -169.8 | 0 | 0 | 0 | 0 | 112.6 | F63 Y67 K68 F69 | F63-S65 VanDerWaalsContact C-N 3.34Å; F63-S65 PolarHBondContact O-N 2.87Å; S65-Y67 VanDerWaalsContact C-N 3.34Å; S65-Y67 PolarHBondContact O-N 3.27Å; S65-K68 PolarHBondContact O-N 3.03Å; S65-F69 PolarHBondContact O-N 3.49Å |
| 66 | A | 80.8 | Confident | 73.2 | Confident | 53 Ų | 53 | 133.1 Ų | 133.1 | 44% | 0.438 | 65% | 0.654 | S | S | . | * | H | α-helix | trans | -62.5 | -40.5 | 179.2 | 0 | 0 | 0 | 0 | 0 | 112 | K68 F69 F70 | A66-K68 PolarHBondContact O-N 2.94Å; A66-F69 PolarHBondContact O-N 3.32Å; A66-F70 WeakPolarHBondContact O-CB 3.3Å; A66-F70 PolarHBondContact O-N 3.5Å |
| 67 | Y | 83.9 | Confident | 74.4 | Confident | 152 Ų | 152 | 131 Ų | 131 | 60% | 0.596 | 64% | 0.635 | S | S | * | * | H | α-helix | trans | -62.7 | -41.2 | 176 | 176.9 | -103.2 | 0 | 0 | 0 | 112.4 | F63 S65 F70 R71 | F63-Y67 PolarHBondContact O-N 3.25Å; S65-Y67 VanDerWaalsContact C-N 3.34Å; S65-Y67 PolarHBondContact O-N 3.27Å; Y67-F70 PolarHBondContact O-N 2.87Å; Y67-R71 VanDerWaalsContact O-CB 3.24Å; Y67-R71 WeakPolarHBondContact O-CB 3.39Å; Y67-R71 PolarHBondContact O-N 3.32Å |
| 68 | K | 80.3 | Confident | 75.7 | Confident | 150 Ų | 150 | 127.4 Ų | 127.4 | 65% | 0.652 | 61% | 0.614 | S | S | * | * | H | α-helix | trans | -61.6 | -43.4 | 174 | -94.3 | -176.3 | 176.4 | 179 | 0 | 111.7 | S64 S65 A66 T72 | S64-K68 PolarHBondContact O-N 3.37Å; S65-K68 PolarHBondContact O-N 3.03Å; A66-K68 PolarHBondContact O-N 2.94Å; K68-T72 PolarHBondContact O-N 2.88Å; K68-T72 VanDerWaalsContact O-N 3.08Å; K68-T72 PolarHBondContact O-OG1 3.34Å |
| 69 | F | 85.2 | Confident | 77.8 | Confident | 138 Ų | 138 | 124.4 Ų | 124.4 | 61% | 0.605 | 61% | 0.605 | S | S | * | * | H | α-helix | trans | -63.7 | -51.1 | 177.8 | -165.1 | -88.9 | 0 | 0 | 0 | 111.4 | S65 A66 R71 T72 W73 | S65-F69 PolarHBondContact O-N 3.49Å; A66-F69 PolarHBondContact O-N 3.32Å; F69-R71 VanDerWaalsContact C-N 3.33Å; F69-R71 PolarHBondContact O-N 2.91Å; F69-T72 PolarHBondContact O-N 2.85Å; F69-T72 VanDerWaalsContact O-N 3.14Å; F69-W73 AromaticContact CE1-CD1 3.96Å; F69-W73 HydrophobicContact CE1-CG 4.38Å; F69-W73 WeakPolarHBondContact O-CB 3.45Å; F69-W73 PolarHBondContact O-N 3.45Å |
| 70 | F | 86.5 | Confident | 79 | Confident | 153 Ų | 153 | 121.5 Ų | 121.5 | 67% | 0.671 | 60% | 0.595 | S | S | * | * | H | α-helix | trans | -57.8 | -43.9 | 177.7 | -102 | -82.2 | 0 | 0 | 0 | 112.7 | A66 Y67 T72 W73 F74 | A66-F70 WeakPolarHBondContact O-CB 3.3Å; A66-F70 PolarHBondContact O-N 3.5Å; Y67-F70 PolarHBondContact O-N 2.87Å; F70-T72 VanDerWaalsContact C-N 3.31Å; F70-T72 PolarHBondContact O-N 3.39Å; F70-W73 PolarHBondContact O-N 3.49Å; F70-F74 WeakPolarHBondContact O-CB 3.43Å; F70-F74 PolarHBondContact O-N 3.4Å |
| 71 | R | 85.1 | Confident | 80.6 | Confident | 161 Ų | 161 | 119.2 Ų | 119.2 | 61% | 0.608 | 59% | 0.586 | S | S | * | * | H | α-helix | trans | -61 | -43.4 | 177.9 | -175.4 | 177.4 | -179.6 | -178.2 | 0.4 | 111.2 | Y67 F69 V75 | Y67-R71 VanDerWaalsContact O-CB 3.24Å; Y67-R71 WeakPolarHBondContact O-CB 3.39Å; Y67-R71 PolarHBondContact O-N 3.32Å; F69-R71 VanDerWaalsContact C-N 3.33Å; F69-R71 PolarHBondContact O-N 2.91Å; R71-V75 VanDerWaalsContact O-CG2 3.25Å; R71-V75 WeakPolarHBondContact O-CG2 3.33Å; R71-V75 PolarHBondContact O-N 3.21Å; R71-V75 VanDerWaalsContact O-N 3.11Å |
| 72 | T | 88.4 | Confident | 82.3 | Confident | 78 Ų | 78 | 117.8 Ų | 117.8 | 48% | 0.479 | 58% | 0.576 | S | S | . | * | H | α-helix | trans | -66.6 | -44.8 | 179.3 | -48.1 | 0 | 0 | 0 | 0 | 110.1 | K68 F69 F70 F74 V75 F76 | K68-T72 PolarHBondContact O-N 2.88Å; K68-T72 VanDerWaalsContact O-N 3.08Å; K68-T72 PolarHBondContact O-OG1 3.34Å; F69-T72 PolarHBondContact O-N 2.85Å; F69-T72 VanDerWaalsContact O-N 3.14Å; F70-T72 VanDerWaalsContact C-N 3.31Å; F70-T72 PolarHBondContact O-N 3.39Å; T72-F74 VanDerWaalsContact C-N 3.35Å; T72-F74 PolarHBondContact O-N 2.7Å; T72-V75 PolarHBondContact O-N 3.29Å; T72-F76 HydrophobicContact CG2-CD2 4.15Å; T72-F76 HydrophobicContact CG2-CE2 4.17Å; T72-F76 WeakPolarHBondContact O-CD2 3.33Å; T72-F76 PolarHBondContact O-N 2.81Å |
| 73 | W | 85.8 | Confident | 83.8 | Confident | 151 Ų | 151 | 117 Ų | 117 | 57% | 0.572 | 57% | 0.57 | S | S | * | * | H | α-helix | trans | -60.2 | -43.8 | 178.4 | -138 | 66.5 | 0 | 0 | 0 | 112.1 | F69 F70 F76 L77 | F69-W73 AromaticContact CE1-CD1 3.96Å; F69-W73 HydrophobicContact CE1-CG 4.38Å; F69-W73 WeakPolarHBondContact O-CB 3.45Å; F69-W73 PolarHBondContact O-N 3.45Å; F70-W73 PolarHBondContact O-N 3.49Å; W73-F76 PolarHBondContact O-N 2.91Å; W73-L77 HydrophobicContact CD2-CD1 3.59Å; W73-L77 HydrophobicContact CE3-CD1 3.56Å; W73-L77 HydrophobicContact CG-CD1 4.25Å; W73-L77 HydrophobicContact CH2-CD1 3.9Å; W73-L77 HydrophobicContact CH2-CD2 4.45Å; W73-L77 HydrophobicContact CZ2-CD1 3.94Å; W73-L77 HydrophobicContact CZ3-CD1 3.71Å; W73-L77 HydrophobicContact CZ3-CD2 4.08Å; W73-L77 WeakPolarHBondContact O-CB 3.33Å; W73-L77 PolarHBondContact O-N 2.84Å |
| 74 | F | 90.2 | Very high | 85.1 | Confident | 132 Ų | 132 | 111.5 Ų | 111.5 | 58% | 0.579 | 55% | 0.549 | S | S | * | . | H | α-helix | trans | -65 | -42.2 | 178.8 | -171.2 | -98.6 | 0 | 0 | 0 | 112.9 | F70 T72 F76 L77 M78 | F70-F74 WeakPolarHBondContact O-CB 3.43Å; F70-F74 PolarHBondContact O-N 3.4Å; T72-F74 VanDerWaalsContact C-N 3.35Å; T72-F74 PolarHBondContact O-N 2.7Å; F74-F76 VanDerWaalsContact C-N 3.27Å; F74-F76 PolarHBondContact O-N 3.42Å; F74-L77 PolarHBondContact O-N 2.93Å; F74-M78 HydrophobicContact CD1-SD 4.2Å; F74-M78 HydrophobicContact CE1-CB 4.37Å; F74-M78 HydrophobicContact CE1-CG 4.49Å; F74-M78 HydrophobicContact CE1-SD 3.22Å; F74-M78 WeakPolarHBondContact CE1-SD 3.45Å; F74-M78 HydrophobicContact CE2-SD 4.32Å; F74-M78 HydrophobicContact CZ-SD 3.3Å; F74-M78 WeakPolarHBondContact CZ-SD 3.31Å; F74-M78 VanDerWaalsContact O-CB 3.25Å; F74-M78 WeakPolarHBondContact O-CB 3.49Å; F74-M78 PolarHBondContact O-N 3.35Å |
| 75 | V | 89.7 | Confident | 86.2 | Confident | 91 Ų | 91 | 111.8 Ų | 111.8 | 55% | 0.552 | 55% | 0.547 | S | S | * | . | H | α-helix | trans | -63.2 | -34.6 | 178.5 | 171 | 0 | 0 | 0 | 0 | 111.6 | R71 T72 P79 | R71-V75 VanDerWaalsContact O-CG2 3.25Å; R71-V75 WeakPolarHBondContact O-CG2 3.33Å; R71-V75 PolarHBondContact O-N 3.21Å; R71-V75 VanDerWaalsContact O-N 3.11Å; T72-V75 PolarHBondContact O-N 3.29Å; V75-P79 WeakPolarHBondContact O-CD 3.25Å; V75-P79 WeakPolarHBondContact O-CG 3.24Å |
| 76 | F | 85.4 | Confident | 87.2 | Confident | 156 Ų | 156 | 111.5 Ų | 111.5 | 68% | 0.684 | 54% | 0.542 | S | S | * | . | H | α-helix | trans | -80.8 | -35.9 | 176.1 | -84.5 | -82.3 | 0 | 0 | 0 | 113.5 | T72 W73 F74 | T72-F76 HydrophobicContact CG2-CD2 4.15Å; T72-F76 HydrophobicContact CG2-CE2 4.17Å; T72-F76 WeakPolarHBondContact O-CD2 3.33Å; T72-F76 PolarHBondContact O-N 2.81Å; W73-F76 PolarHBondContact O-N 2.91Å; F74-F76 VanDerWaalsContact C-N 3.27Å; F74-F76 PolarHBondContact O-N 3.42Å |
| 77 | L | 84.6 | Confident | 87.7 | Confident | 62 Ų | 62 | 113.4 Ų | 113.4 | 33% | 0.325 | 54% | 0.543 | S | S | . | . | H | α-helix | trans | -76.3 | -40.8 | -179.4 | -106.3 | 98.8 | 0 | 0 | 0 | 113.4 | W73 F74 Q80 I81 | W73-L77 HydrophobicContact CD2-CD1 3.59Å; W73-L77 HydrophobicContact CE3-CD1 3.56Å; W73-L77 HydrophobicContact CG-CD1 4.25Å; W73-L77 HydrophobicContact CH2-CD1 3.9Å; W73-L77 HydrophobicContact CH2-CD2 4.45Å; W73-L77 HydrophobicContact CZ2-CD1 3.94Å; W73-L77 HydrophobicContact CZ3-CD1 3.71Å; W73-L77 HydrophobicContact CZ3-CD2 4.08Å; W73-L77 WeakPolarHBondContact O-CB 3.33Å; W73-L77 PolarHBondContact O-N 2.84Å; F74-L77 PolarHBondContact O-N 2.93Å; L77-Q80 PolarHBondContact O-N 3.49Å; L77-I81 HydrophobicContact CB-CD1 4.2Å; L77-I81 HydrophobicContact CD2-CD1 4.03Å; L77-I81 WeakPolarHBondContact O-CG1 3.26Å; L77-I81 PolarHBondContact O-N 3.41Å |
| 78 | M | 86.3 | Confident | 87.7 | Confident | 93 Ų | 93 | 109.2 Ų | 109.2 | 46% | 0.458 | 53% | 0.531 | S | S | . | . | H | α-helix | trans | -57.2 | -43.6 | -171.9 | -177.2 | 156.8 | 162.3 | 0 | 0 | 113.5 | F74 Q80 I81 C82 | F74-M78 HydrophobicContact CD1-SD 4.2Å; F74-M78 HydrophobicContact CE1-CB 4.37Å; F74-M78 HydrophobicContact CE1-CG 4.49Å; F74-M78 HydrophobicContact CE1-SD 3.22Å; F74-M78 WeakPolarHBondContact CE1-SD 3.45Å; F74-M78 HydrophobicContact CE2-SD 4.32Å; F74-M78 HydrophobicContact CZ-SD 3.3Å; F74-M78 WeakPolarHBondContact CZ-SD 3.31Å; F74-M78 VanDerWaalsContact O-CB 3.25Å; F74-M78 WeakPolarHBondContact O-CB 3.49Å; F74-M78 PolarHBondContact O-N 3.35Å; M78-Q80 VanDerWaalsContact C-N 3.29Å; M78-Q80 PolarHBondContact O-N 3.32Å; M78-I81 PolarHBondContact O-N 3.44Å; M78-C82 WeakPolarHBondContact O-CB 3.4Å; M78-C82 PolarHBondContact O-N 3.47Å; M78-C82 PolarHBondContact O-SG 2.87Å |
| 79 | P | 91.9 | Very high | 88.3 | Confident | 79 Ų | 79 | 105.8 Ų | 105.8 | 51% | 0.513 | 53% | 0.526 | S | S | . | . | H | α-helix | trans | -61.2 | -36.4 | 175.3 | -20.7 | 31.4 | 0 | 0 | 0 | 113.2 | V75 K83 | V75-P79 WeakPolarHBondContact O-CD 3.25Å; V75-P79 WeakPolarHBondContact O-CG 3.24Å; P79-K83 VanDerWaalsContact O-CB 3.32Å; P79-K83 WeakPolarHBondContact O-CB 3.24Å; P79-K83 PolarHBondContact O-N 2.74Å |
| 80 | Q | 86.8 | Confident | 88.4 | Confident | 154 Ų | 154 | 106.2 Ų | 106.2 | 72% | 0.72 | 53% | 0.53 | S | S | * | . | H | α-helix | trans | -71.4 | -42.9 | 179.8 | -63.8 | -134.9 | -23.7 | 0 | 0 | 111.5 | L77 M78 K83 L84 | L77-Q80 PolarHBondContact O-N 3.49Å; M78-Q80 VanDerWaalsContact C-N 3.29Å; M78-Q80 PolarHBondContact O-N 3.32Å; Q80-K83 PolarHBondContact O-N 2.74Å; Q80-L84 WeakPolarHBondContact O-CB 3.49Å; Q80-L84 PolarHBondContact O-N 2.78Å |
| 81 | I | 89.3 | Confident | 88.2 | Confident | 89 Ų | 89 | 104.1 Ų | 104.1 | 46% | 0.456 | 52% | 0.521 | S | S | . | . | H | α-helix | trans | -62.6 | -46.6 | 174.9 | -59.7 | 161.9 | 0 | 0 | 0 | 109.6 | L77 M78 K83 L84 V85 | L77-I81 HydrophobicContact CB-CD1 4.2Å; L77-I81 HydrophobicContact CD2-CD1 4.03Å; L77-I81 WeakPolarHBondContact O-CG1 3.26Å; L77-I81 PolarHBondContact O-N 3.41Å; M78-I81 PolarHBondContact O-N 3.44Å; I81-K83 VanDerWaalsContact C-N 3.34Å; I81-K83 PolarHBondContact O-N 2.79Å; I81-L84 WeakPolarHBondContact O-CB 3.41Å; I81-L84 PolarHBondContact O-N 2.69Å; I81-V85 HydrophobicContact CG2-CG2 4.28Å; I81-V85 VanDerWaalsContact O-CG2 3.29Å; I81-V85 WeakPolarHBondContact O-CG2 3.13Å; I81-V85 PolarHBondContact O-N 3.22Å |
| 82 | C | 93.2 | Very high | 88.2 | Confident | 64 Ų | 64 | 103.4 Ų | 103.4 | 43% | 0.432 | 53% | 0.528 | S | S | . | . | H | α-helix | trans | -58.1 | -46.3 | 177 | -70.5 | 0 | 0 | 0 | 0 | 111.3 | M78 L84 V85 T86 | M78-C82 WeakPolarHBondContact O-CB 3.4Å; M78-C82 PolarHBondContact O-N 3.47Å; M78-C82 PolarHBondContact O-SG 2.87Å; C82-L84 VanDerWaalsContact C-N 3.34Å; C82-L84 PolarHBondContact O-N 2.71Å; C82-V85 PolarHBondContact O-N 3.28Å; C82-T86 PolarHBondContact O-N 3.19Å; C82-T86 PolarHBondContact O-OG1 3.07Å |
| 83 | K | 87.5 | Confident | 87.5 | Confident | 149 Ų | 149 | 111.2 Ų | 111.2 | 65% | 0.648 | 56% | 0.555 | S | S | * | * | H | α-helix | trans | -63.9 | -39.1 | 178.5 | -163.9 | 168.4 | -173.5 | 174.8 | 0 | 112.2 | P79 Q80 I81 T86 I87 | P79-K83 VanDerWaalsContact O-CB 3.32Å; P79-K83 WeakPolarHBondContact O-CB 3.24Å; P79-K83 PolarHBondContact O-N 2.74Å; Q80-K83 PolarHBondContact O-N 2.74Å; I81-K83 VanDerWaalsContact C-N 3.34Å; I81-K83 PolarHBondContact O-N 2.79Å; K83-T86 PolarHBondContact O-N 3.41Å; K83-I87 HydrophobicContact CG-CD1 4.16Å; K83-I87 WeakPolarHBondContact O-CB 3.33Å; K83-I87 WeakPolarHBondContact O-CD1 3.3Å; K83-I87 VanDerWaalsContact O-CG1 3.23Å; K83-I87 WeakPolarHBondContact O-CG1 3.48Å; K83-I87 PolarHBondContact O-N 2.77Å |
| 84 | L | 87.4 | Confident | 87.6 | Confident | 68 Ų | 68 | 109.2 Ų | 109.2 | 36% | 0.356 | 55% | 0.554 | S | S | . | * | H | α-helix | trans | -61.8 | -46.9 | 174.2 | -171.1 | 80.3 | 0 | 0 | 0 | 111.1 | F5 F8 Q80 I81 C82 I87 L88 | F5-L84 HydrophobicContact CE2-CD1 4.43Å; F8-L84 HydrophobicContact CE1-CD1 4.21Å; Q80-L84 WeakPolarHBondContact O-CB 3.49Å; Q80-L84 PolarHBondContact O-N 2.78Å; I81-L84 WeakPolarHBondContact O-CB 3.41Å; I81-L84 PolarHBondContact O-N 2.69Å; C82-L84 VanDerWaalsContact C-N 3.34Å; C82-L84 PolarHBondContact O-N 2.71Å; L84-I87 PolarHBondContact O-N 2.82Å; L84-L88 HydrophobicContact CG-CD1 4.3Å; L84-L88 WeakPolarHBondContact O-CB 3.4Å; L84-L88 PolarHBondContact O-N 2.67Å |
| 85 | V | 90 | Very high | 87.4 | Confident | 84 Ų | 84 | 108 Ų | 108 | 51% | 0.509 | 55% | 0.552 | S | S | . | * | H | α-helix | trans | -64.4 | -41.8 | 178.6 | 173.3 | 0 | 0 | 0 | 0 | 111.1 | I81 C82 L88 S89 | I81-V85 HydrophobicContact CG2-CG2 4.28Å; I81-V85 VanDerWaalsContact O-CG2 3.29Å; I81-V85 WeakPolarHBondContact O-CG2 3.13Å; I81-V85 PolarHBondContact O-N 3.22Å; C82-V85 PolarHBondContact O-N 3.28Å; V85-L88 WeakPolarHBondContact O-CB 3.4Å; V85-L88 PolarHBondContact O-N 2.88Å; V85-S89 WeakPolarHBondContact O-CB 3.4Å; V85-S89 PolarHBondContact O-N 2.94Å |
| 86 | T | 93.6 | Very high | 87.3 | Confident | 85 Ų | 85 | 108.9 Ų | 108.9 | 52% | 0.521 | 55% | 0.552 | S | S | . | * | H | α-helix | trans | -61.3 | -46.8 | 175.5 | -58 | 0 | 0 | 0 | 0 | 111.4 | C82 K83 L88 S89 E90 | C82-T86 PolarHBondContact O-N 3.19Å; C82-T86 PolarHBondContact O-OG1 3.07Å; K83-T86 PolarHBondContact O-N 3.41Å; T86-L88 VanDerWaalsContact C-N 3.34Å; T86-L88 PolarHBondContact O-N 3.09Å; T86-S89 PolarHBondContact O-N 2.99Å; T86-E90 PolarHBondContact O-N 2.8Å |
| 87 | I | 89.8 | Confident | 87.4 | Confident | 92 Ų | 92 | 106.2 Ų | 106.2 | 47% | 0.472 | 55% | 0.545 | S | S | . | . | H | α-helix | trans | -62.4 | -43.2 | 177.9 | -68.9 | 164.1 | 0 | 0 | 0 | 110.8 | K83 L84 S89 E90 F91 | K83-I87 HydrophobicContact CG-CD1 4.16Å; K83-I87 WeakPolarHBondContact O-CB 3.33Å; K83-I87 WeakPolarHBondContact O-CD1 3.3Å; K83-I87 VanDerWaalsContact O-CG1 3.23Å; K83-I87 WeakPolarHBondContact O-CG1 3.48Å; K83-I87 PolarHBondContact O-N 2.77Å; L84-I87 PolarHBondContact O-N 2.82Å; I87-S89 VanDerWaalsContact C-N 3.33Å; I87-S89 PolarHBondContact O-N 3.37Å; I87-E90 PolarHBondContact O-N 3.34Å; I87-F91 WeakPolarHBondContact O-CB 3.13Å; I87-F91 PolarHBondContact O-N 2.85Å |
| 88 | L | 85.6 | Confident | 87.6 | Confident | 64 Ų | 64 | 108.9 Ų | 108.9 | 34% | 0.335 | 56% | 0.558 | S | S | . | * | H | α-helix | trans | -59.1 | -44.4 | 174.5 | -97.4 | 159.7 | 0 | 0 | 0 | 111.9 | F5 L84 V85 T86 F91 I92 | F5-L88 HydrophobicContact CE1-CD2 4.11Å; F5-L88 HydrophobicContact CE2-CG 4.29Å; F5-L88 HydrophobicContact CZ-CD1 4.21Å; F5-L88 HydrophobicContact CZ-CD2 3.57Å; F5-L88 HydrophobicContact CZ-CG 3.76Å; L84-L88 HydrophobicContact CG-CD1 4.3Å; L84-L88 WeakPolarHBondContact O-CB 3.4Å; L84-L88 PolarHBondContact O-N 2.67Å; V85-L88 WeakPolarHBondContact O-CB 3.4Å; V85-L88 PolarHBondContact O-N 2.88Å; T86-L88 VanDerWaalsContact C-N 3.34Å; T86-L88 PolarHBondContact O-N 3.09Å; L88-F91 WeakPolarHBondContact O-CB 3.4Å; L88-F91 PolarHBondContact O-N 3.18Å; L88-F91 VanDerWaalsContact O-N 3.17Å; L88-I92 WeakPolarHBondContact O-CG1 3.27Å; L88-I92 PolarHBondContact O-N 3.27Å |
| 89 | S | 91.6 | Very high | 87.7 | Confident | 79 Ų | 79 | 110 Ų | 110 | 55% | 0.552 | 57% | 0.565 | S | S | * | * | H | α-helix | trans | -65.1 | -39 | 179 | -175 | 0 | 0 | 0 | 0 | 112.2 | V85 T86 I87 F91 | V85-S89 WeakPolarHBondContact O-CB 3.4Å; V85-S89 PolarHBondContact O-N 2.94Å; T86-S89 PolarHBondContact O-N 2.99Å; I87-S89 VanDerWaalsContact C-N 3.33Å; I87-S89 PolarHBondContact O-N 3.37Å; S89-F91 VanDerWaalsContact C-N 3.27Å |
| 90 | E | 87.5 | Confident | 87.4 | Confident | 147 Ų | 147 | 112.2 Ų | 112.2 | 69% | 0.687 | 57% | 0.569 | S | S | * | * | H | α-helix | trans | -68 | -29.5 | 173.7 | -74.8 | -139.3 | 148.2 | 0 | 0 | 112.4 | T86 I87 I92 K93 | T86-E90 PolarHBondContact O-N 2.8Å; I87-E90 PolarHBondContact O-N 3.34Å; E90-I92 VanDerWaalsContact C-N 3.33Å; E90-K93 PolarHBondContact O-N 3.35Å |
| 91 | F | 83.2 | Confident | 87.4 | Confident | 108 Ų | 108 | 109 Ų | 109 | 47% | 0.474 | 56% | 0.557 | S | S | . | * | H | α-helix | trans | -73.8 | -25.8 | -178.8 | -149.4 | -88 | 0 | 0 | 0 | 113.9 | K2 I87 L88 S89 K93 | K2-F91 HydrophobicContact CB-CZ 4.17Å; K2-F91 HydrophobicContact CD-CE1 4.25Å; K2-F91 HydrophobicContact CD-CE2 4.23Å; K2-F91 HydrophobicContact CD-CZ 3.46Å; K2-F91 VanDerWaalsContact CD-CZ 3.46Å; K2-F91 HydrophobicContact CG-CE2 3.98Å; K2-F91 HydrophobicContact CG-CZ 3.53Å; I87-F91 WeakPolarHBondContact O-CB 3.13Å; I87-F91 PolarHBondContact O-N 2.85Å; L88-F91 WeakPolarHBondContact O-CB 3.4Å; L88-F91 PolarHBondContact O-N 3.18Å; L88-F91 VanDerWaalsContact O-N 3.17Å; S89-F91 VanDerWaalsContact C-N 3.27Å; F91-K93 VanDerWaalsContact C-N 3.32Å |
| 92 | I | 84.7 | Confident | 87.3 | Confident | 147 Ų | 147 | 110.7 Ų | 110.7 | 75% | 0.754 | 57% | 0.566 | S | S | * | * | H | α-helix | trans | -77.7 | -24.3 | 175.7 | -65.9 | 166.6 | 0 | 0 | 0 | 110.9 | L88 E90 | L88-I92 WeakPolarHBondContact O-CG1 3.27Å; L88-I92 PolarHBondContact O-N 3.27Å; E90-I92 VanDerWaalsContact C-N 3.33Å |
| 93 | K | 73.4 | Confident | 86.7 | Confident | 241 Ų | 241 | 114.9 Ų | 114.9 | 100% | 1.048 | 58% | 0.578 | S | S | * | * | trans | -83.2 | 0 | -178.6 | -152.4 | -180 | -173.3 | -176.8 | 0 | 111.4 | E90 F91 | E90-K93 PolarHBondContact O-N 3.35Å; F91-K93 VanDerWaalsContact C-N 3.32Å |
Retrieved 93 of 93 residues in 64.9 ms
(Link to these results)