| 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 | 50.2 | Low | 79.2 | Confident | 238 Ų | 238 | 122.7 Ų | 122.7 | 100% | 1.172 | 66% | 0.663 | S | S | * | * | 0 | 118.6 | 0 | -173.9 | 169.3 | -108.4 | 0 | 0 | 105.6 | E3 | M1-E3 PolarHBondContact O-N 3.47Š| |||
| 2 | E | 66.3 | Low | 80.4 | Confident | 178 Ų | 178 | 122.8 Ų | 122.8 | 83% | 0.832 | 66% | 0.662 | S | S | * | * | trans | -61.3 | 123.8 | 174 | -68.4 | 179.1 | 166.3 | 0 | 0 | 107.6 | I4 | E2-I4 PolarHBondContact O-N 3.36Š| ||
| 3 | E | 69.2 | Low | 81.5 | Confident | 194 Ų | 194 | 122.2 Ų | 122.2 | 91% | 0.907 | 65% | 0.65 | S | S | * | * | trans | -79.1 | 94.7 | -179 | -160.6 | 179.2 | 168.2 | 0 | 0 | 108 | M1 S5 | M1-E3 PolarHBondContact O-N 3.47Å; E3-S5 PolarHBondContact O-N 3.04Å | ||
| 4 | I | 76.3 | Confident | 82.4 | Confident | 116 Ų | 116 | 119.1 Ų | 119.1 | 60% | 0.595 | 63% | 0.633 | S | S | * | * | trans | -71.9 | 111.9 | 176.5 | -60.3 | 166.1 | 0 | 0 | 0 | 107.4 | E2 L6 | E2-I4 PolarHBondContact O-N 3.36Å; I4-L6 PolarHBondContact O-N 3.35Å | ||
| 5 | S | 83 | Confident | 83.2 | Confident | 65 Ų | 65 | 118.7 Ų | 118.7 | 46% | 0.455 | 63% | 0.626 | S | S | . | * | trans | -71.7 | 96.9 | 172.1 | -172.9 | 0 | 0 | 0 | 0 | 109.4 | E3 A7 N8 | E3-S5 PolarHBondContact O-N 3.04Å; S5-A7 PolarHBondContact O-N 3.08Å; S5-A7 VanDerWaalsContact O-N 3.08Å; S5-N8 PolarHBondContact O-N 3.29Å; S5-N8 PolarHBondContact OG-ND2 3.22Å | ||
| 6 | L | 82.7 | Confident | 84 | Confident | 102 Ų | 102 | 115.1 Ų | 115.1 | 53% | 0.534 | 62% | 0.619 | S | S | . | * | G | 310 helix | trans | -56 | -28 | -178.4 | -153.8 | 74.4 | 0 | 0 | 0 | 112.4 | I4 N8 L9 L14 I17 | I4-L6 PolarHBondContact O-N 3.35Å; L6-N8 VanDerWaalsContact C-N 3.27Å; L6-N8 PolarHBondContact O-N 2.97Å; L6-L9 HydrophobicContact CD1-CD2 4.41Å; L6-L9 WeakPolarHBondContact O-CB 3.37Å; L6-L9 PolarHBondContact O-N 3.07Å; L6-L14 HydrophobicContact CD1-CD1 3.83Å; L6-L14 HydrophobicContact CD2-CD1 4.08Å; L6-L14 HydrophobicContact CG-CD1 3.91Å; L6-I17 HydrophobicContact CD1-CD1 4.22Å |
| 7 | A | 81.7 | Confident | 84.6 | Confident | 92 Ų | 92 | 111 Ų | 111 | 76% | 0.76 | 60% | 0.596 | S | S | * | * | G | 310 helix | trans | -67.5 | -22.6 | 179.4 | 0 | 0 | 0 | 0 | 0 | 114.2 | S5 | S5-A7 PolarHBondContact O-N 3.08Å; S5-A7 VanDerWaalsContact O-N 3.08Å |
| 8 | N | 86.5 | Confident | 85.2 | Confident | 143 Ų | 143 | 106.7 Ų | 106.7 | 77% | 0.765 | 58% | 0.578 | S | S | * | * | G | 310 helix | trans | -97.8 | 7.4 | -178.4 | -66.2 | -32 | 0 | 0 | 0 | 112.8 | S5 L6 | S5-N8 PolarHBondContact O-N 3.29Å; S5-N8 PolarHBondContact OG-ND2 3.22Å; L6-N8 VanDerWaalsContact C-N 3.27Å; L6-N8 PolarHBondContact O-N 2.97Å |
| 9 | L | 90 | Very high | 85.8 | Confident | 42 Ų | 42 | 106.7 Ų | 106.7 | 22% | 0.22 | 57% | 0.574 | C | S | . | * | trans | -92.7 | 136.7 | -174.2 | -157.1 | 68.1 | 0 | 0 | 0 | 110.7 | L6 K13 L14 I17 | L6-L9 HydrophobicContact CD1-CD2 4.41Å; L6-L9 WeakPolarHBondContact O-CB 3.37Å; L6-L9 PolarHBondContact O-N 3.07Å; L9-K13 HydrophobicContact CD1-CB 3.47Å; L9-K13 VanDerWaalsContact CD1-CB 3.47Å; L9-K13 HydrophobicContact CD1-CD 3.33Å; L9-K13 HydrophobicContact CD1-CG 4.06Å; L9-K13 HydrophobicContact CD2-CB 3.68Å; L9-K13 HydrophobicContact CG-CB 3.37Å; L9-K13 HydrophobicContact CG-CD 4.09Å; L9-K13 HydrophobicContact CG-CG 4.41Å; L9-L14 HydrophobicContact CD2-CB 4.24Å; L9-I17 HydrophobicContact CD2-CD1 3.4Å; L9-I17 VanDerWaalsContact CD2-CD1 3.4Å; L9-I17 HydrophobicContact CD2-CG1 4.43Å | ||
| 10 | D | 92.5 | Very high | 86.3 | Confident | 69 Ų | 69 | 107.7 Ų | 107.7 | 37% | 0.369 | 58% | 0.575 | S | S | . | * | trans | -71.3 | 160.3 | 170.3 | 62.7 | 75 | 0 | 0 | 0 | 111.4 | N12 K13 L14 | D10-N12 VanDerWaalsContact C-N 3.26Å; D10-N12 PolarHBondContact O-N 2.99Å; D10-N12 WeakPolarHBondContact OD1-CB 3.11Å; D10-N12 PolarHBondContact OD1-N 3.28Å; D10-K13 PolarHBondContact O-N 3.19Å; D10-K13 PolarHBondContact OD1-N 3.04Å; D10-K13 WeakPolarHBondContact OD2-CD 3.46Å; D10-K13 WeakPolarHBondContact OD2-CE 3.42Å; D10-K13 IonicContact OD2-NZ 3.26Å; D10-K13 PolarHBondContact OD2-NZ 3.26Å; D10-L14 PolarHBondContact O-N 3.21Å | ||
| 11 | T | 92.5 | Very high | 86.8 | Confident | 111 Ų | 111 | 107.3 Ų | 107.3 | 68% | 0.681 | 57% | 0.571 | S | S | * | * | H | α-helix | trans | -57 | -37.6 | -175.3 | -46.7 | 0 | 0 | 0 | 0 | 113 | L14 E15 | T11-L14 PolarHBondContact O-N 2.87Å; T11-E15 WeakPolarHBondContact O-CB 3.19Å; T11-E15 PolarHBondContact O-N 2.95Å |
| 12 | N | 94.7 | Very high | 89.1 | Confident | 123 Ų | 123 | 102.4 Ų | 102.4 | 66% | 0.658 | 54% | 0.541 | S | S | * | . | H | α-helix | trans | -67.5 | -40.9 | -177.8 | -63.2 | -30.6 | 0 | 0 | 0 | 111 | D10 E15 A16 | D10-N12 VanDerWaalsContact C-N 3.26Å; D10-N12 PolarHBondContact O-N 2.99Å; D10-N12 WeakPolarHBondContact OD1-CB 3.11Å; D10-N12 PolarHBondContact OD1-N 3.28Å; N12-E15 PolarHBondContact O-N 3.23Å; N12-A16 PolarHBondContact O-N 3.01Å |
| 13 | K | 94 | Very high | 90.6 | Very high | 116 Ų | 116 | 97.1 Ų | 97.1 | 50% | 0.504 | 52% | 0.521 | S | S | . | . | H | α-helix | trans | -69.8 | -35.7 | 175.3 | -72.1 | 177.7 | -168.1 | 162.5 | 0 | 111.9 | L9 D10 E15 A16 I17 | L9-K13 HydrophobicContact CD1-CB 3.47Å; L9-K13 VanDerWaalsContact CD1-CB 3.47Å; L9-K13 HydrophobicContact CD1-CD 3.33Å; L9-K13 HydrophobicContact CD1-CG 4.06Å; L9-K13 HydrophobicContact CD2-CB 3.68Å; L9-K13 HydrophobicContact CG-CB 3.37Å; L9-K13 HydrophobicContact CG-CD 4.09Å; L9-K13 HydrophobicContact CG-CG 4.41Å; D10-K13 PolarHBondContact O-N 3.19Å; D10-K13 PolarHBondContact OD1-N 3.04Å; D10-K13 WeakPolarHBondContact OD2-CD 3.46Å; D10-K13 WeakPolarHBondContact OD2-CE 3.42Å; D10-K13 IonicContact OD2-NZ 3.26Å; D10-K13 PolarHBondContact OD2-NZ 3.26Å; K13-E15 VanDerWaalsContact C-N 3.34Å; K13-A16 PolarHBondContact O-N 3.23Å; K13-I17 WeakPolarHBondContact O-CG1 3.41Å; K13-I17 PolarHBondContact O-N 3.47Å; K13-I17 VanDerWaalsContact O-N 3.08Å |
| 14 | L | 93.8 | Very high | 91.9 | Very high | 78 Ų | 78 | 91.9 Ų | 91.9 | 41% | 0.408 | 50% | 0.499 | S | S | . | . | H | α-helix | trans | -63.8 | -41.5 | 173.5 | -177.2 | 63.7 | 0 | 0 | 0 | 111.4 | L6 L9 D10 T11 I17 A18 | L6-L14 HydrophobicContact CD1-CD1 3.83Å; L6-L14 HydrophobicContact CD2-CD1 4.08Å; L6-L14 HydrophobicContact CG-CD1 3.91Å; L9-L14 HydrophobicContact CD2-CB 4.24Å; D10-L14 PolarHBondContact O-N 3.21Å; T11-L14 PolarHBondContact O-N 2.87Å; L14-I17 PolarHBondContact O-N 3.44Å; L14-A18 WeakPolarHBondContact O-CB 3.33Å; L14-A18 PolarHBondContact O-N 2.86Å |
| 15 | E | 95.5 | Very high | 93 | Very high | 114 Ų | 114 | 91.2 Ų | 91.2 | 53% | 0.533 | 50% | 0.496 | S | S | . | . | H | α-helix | trans | -62.6 | -41.8 | 174.4 | -176.1 | 176.2 | -169.9 | 0 | 0 | 111.7 | T11 N12 K13 I17 A18 Q19 | T11-E15 WeakPolarHBondContact O-CB 3.19Å; T11-E15 PolarHBondContact O-N 2.95Å; N12-E15 PolarHBondContact O-N 3.23Å; K13-E15 VanDerWaalsContact C-N 3.34Å; E15-I17 PolarHBondContact O-N 3.41Å; E15-A18 PolarHBondContact O-N 2.97Å; E15-Q19 VanDerWaalsContact O-CG 3.32Å; E15-Q19 WeakPolarHBondContact O-CG 3.46Å; E15-Q19 PolarHBondContact O-N 2.96Å |
| 16 | A | 95.3 | Very high | 93.7 | Very high | 61 Ų | 61 | 93 Ų | 93 | 50% | 0.504 | 50% | 0.5 | S | S | . | . | H | α-helix | trans | -60.5 | -45 | 175.9 | 0 | 0 | 0 | 0 | 0 | 112.5 | N12 K13 A18 Q19 E20 | N12-A16 PolarHBondContact O-N 3.01Å; K13-A16 PolarHBondContact O-N 3.23Å; A16-A18 VanDerWaalsContact C-N 3.35Å; A16-Q19 PolarHBondContact O-N 3.33Å; A16-E20 PolarHBondContact O-N 3.34Å |
| 17 | I | 93.9 | Very high | 94.4 | Very high | 45 Ų | 45 | 94.1 Ų | 94.1 | 23% | 0.231 | 50% | 0.502 | C | S | . | . | H | α-helix | trans | -63.4 | -42.2 | 175.3 | -66.2 | 173 | 0 | 0 | 0 | 110.7 | L6 L9 K13 L14 E15 Q19 E20 I21 | L6-I17 HydrophobicContact CD1-CD1 4.22Å; L9-I17 HydrophobicContact CD2-CD1 3.4Å; L9-I17 VanDerWaalsContact CD2-CD1 3.4Å; L9-I17 HydrophobicContact CD2-CG1 4.43Å; K13-I17 WeakPolarHBondContact O-CG1 3.41Å; K13-I17 PolarHBondContact O-N 3.47Å; K13-I17 VanDerWaalsContact O-N 3.08Å; L14-I17 PolarHBondContact O-N 3.44Å; E15-I17 PolarHBondContact O-N 3.41Å; I17-Q19 VanDerWaalsContact C-N 3.34Å; I17-Q19 PolarHBondContact O-N 3.08Å; I17-E20 PolarHBondContact O-N 3.49Å; I17-I21 HydrophobicContact CG2-CD1 3.83Å; I17-I21 HydrophobicContact CG2-CG1 4.46Å; I17-I21 WeakPolarHBondContact O-CG1 3.32Å; I17-I21 PolarHBondContact O-N 3.35Å |
| 18 | A | 95.3 | Very high | 95.2 | Very high | 33 Ų | 33 | 95.2 Ų | 95.2 | 27% | 0.273 | 50% | 0.495 | S | S | . | . | H | α-helix | trans | -61.9 | -42.9 | 177.5 | 0 | 0 | 0 | 0 | 0 | 111.5 | L14 E15 A16 I21 Y22 | L14-A18 WeakPolarHBondContact O-CB 3.33Å; L14-A18 PolarHBondContact O-N 2.86Å; E15-A18 PolarHBondContact O-N 2.97Å; A16-A18 VanDerWaalsContact C-N 3.35Å; A18-I21 PolarHBondContact O-N 2.88Å; A18-Y22 HydrophobicContact CB-CD2 4.36Å; A18-Y22 HydrophobicContact CB-CE2 4.04Å; A18-Y22 WeakPolarHBondContact O-CB 2.94Å; A18-Y22 WeakPolarHBondContact O-CD2 3.37Å; A18-Y22 VanDerWaalsContact O-CG 3.3Å; A18-Y22 PolarHBondContact O-N 3.34Å |
| 19 | Q | 97.3 | Very high | 95.7 | Very high | 108 Ų | 108 | 91.7 Ų | 91.7 | 51% | 0.505 | 48% | 0.481 | S | S | . | . | H | α-helix | trans | -60.6 | -44.4 | 175.8 | -73.4 | -70 | -37.2 | 0 | 0 | 111.9 | E15 A16 I17 Y22 V23 | E15-Q19 VanDerWaalsContact O-CG 3.32Å; E15-Q19 WeakPolarHBondContact O-CG 3.46Å; E15-Q19 PolarHBondContact O-N 2.96Å; A16-Q19 PolarHBondContact O-N 3.33Å; I17-Q19 VanDerWaalsContact C-N 3.34Å; I17-Q19 PolarHBondContact O-N 3.08Å; Q19-Y22 PolarHBondContact O-N 3.37Å; Q19-V23 VanDerWaalsContact O-CG2 3.31Å; Q19-V23 WeakPolarHBondContact O-CG2 3.45Å; Q19-V23 PolarHBondContact O-N 3.03Å |
| 20 | E | 96.3 | Very high | 96 | Very high | 126 Ų | 126 | 93.1 Ų | 93.1 | 59% | 0.589 | 49% | 0.494 | S | S | * | . | H | α-helix | trans | -58 | -50.5 | 175.4 | -174 | 177.5 | -174.2 | 0 | 0 | 111.3 | A16 I17 Y22 V23 D24 | A16-E20 PolarHBondContact O-N 3.34Å; I17-E20 PolarHBondContact O-N 3.49Å; E20-Y22 VanDerWaalsContact C-N 3.31Å; E20-Y22 PolarHBondContact O-N 3.04Å; E20-V23 PolarHBondContact O-N 3.5Å; E20-D24 PolarHBondContact O-N 3.27Å |
| 21 | I | 96.9 | Very high | 96.2 | Very high | 99 Ų | 99 | 94 Ų | 94 | 51% | 0.508 | 50% | 0.499 | S | S | . | . | H | α-helix | trans | -59.7 | -41.6 | 177 | -66 | 166.9 | 0 | 0 | 0 | 111.5 | I17 A18 L25 | I17-I21 HydrophobicContact CG2-CD1 3.83Å; I17-I21 HydrophobicContact CG2-CG1 4.46Å; I17-I21 WeakPolarHBondContact O-CG1 3.32Å; I17-I21 PolarHBondContact O-N 3.35Å; A18-I21 PolarHBondContact O-N 2.88Å; I21-L25 VanDerWaalsContact O-CB 3.25Å; I21-L25 WeakPolarHBondContact O-CB 3.31Å; I21-L25 PolarHBondContact O-N 2.97Å |
| 22 | Y | 97.8 | Very high | 96.4 | Very high | 136 Ų | 136 | 90.6 Ų | 90.6 | 53% | 0.533 | 49% | 0.485 | S | S | . | . | H | α-helix | trans | -66.6 | -40 | 179.5 | -74.4 | -50.5 | 0 | 0 | 0 | 112.2 | A18 Q19 E20 L25 I26 | A18-Y22 HydrophobicContact CB-CD2 4.36Å; A18-Y22 HydrophobicContact CB-CE2 4.04Å; A18-Y22 WeakPolarHBondContact O-CB 2.94Å; A18-Y22 WeakPolarHBondContact O-CD2 3.37Å; A18-Y22 VanDerWaalsContact O-CG 3.3Å; A18-Y22 PolarHBondContact O-N 3.34Å; Q19-Y22 PolarHBondContact O-N 3.37Å; E20-Y22 VanDerWaalsContact C-N 3.31Å; E20-Y22 PolarHBondContact O-N 3.04Å; Y22-L25 PolarHBondContact O-N 3.43Å; Y22-I26 WeakPolarHBondContact O-CB 3.25Å; Y22-I26 WeakPolarHBondContact O-CD1 3.41Å; Y22-I26 WeakPolarHBondContact O-CG1 3.38Å; Y22-I26 PolarHBondContact O-N 3.22Å |
| 23 | V | 97.6 | Very high | 96.4 | Very high | 67 Ų | 67 | 91.2 Ų | 91.2 | 41% | 0.406 | 48% | 0.482 | S | S | . | . | H | α-helix | trans | -61.5 | -52.6 | 176.2 | 169.2 | 0 | 0 | 0 | 0 | 109.8 | Q19 E20 L25 I26 E27 | Q19-V23 VanDerWaalsContact O-CG2 3.31Å; Q19-V23 WeakPolarHBondContact O-CG2 3.45Å; Q19-V23 PolarHBondContact O-N 3.03Å; E20-V23 PolarHBondContact O-N 3.5Å; V23-L25 VanDerWaalsContact C-N 3.32Å; V23-L25 PolarHBondContact O-N 3.37Å; V23-I26 PolarHBondContact O-N 3.33Å; V23-I26 VanDerWaalsContact O-N 3.14Å; V23-E27 HydrophobicContact CG1-CG 4.39Å; V23-E27 WeakPolarHBondContact O-CG 3.15Å; V23-E27 PolarHBondContact O-N 2.92Å |
| 24 | D | 97.4 | Very high | 96.4 | Very high | 84 Ų | 84 | 89.3 Ų | 89.3 | 45% | 0.449 | 48% | 0.483 | S | S | . | . | H | α-helix | trans | -56.8 | -46.2 | 179.1 | -70.8 | -9.2 | 0 | 0 | 0 | 111.4 | E20 I26 E27 D28 | E20-D24 PolarHBondContact O-N 3.27Å; D24-I26 PolarHBondContact O-N 2.95Å; D24-E27 PolarHBondContact O-N 2.68Å; D24-D28 WeakPolarHBondContact O-CB 3.33Å; D24-D28 PolarHBondContact O-N 2.94Å |
| 25 | L | 98.2 | Very high | 96.3 | Very high | 102 Ų | 102 | 91.8 Ų | 91.8 | 53% | 0.534 | 49% | 0.49 | S | S | . | . | H | α-helix | trans | -61.9 | -41.9 | 178.7 | -179.3 | 65.3 | 0 | 0 | 0 | 112.4 | I21 Y22 V23 S29 | I21-L25 VanDerWaalsContact O-CB 3.25Å; I21-L25 WeakPolarHBondContact O-CB 3.31Å; I21-L25 PolarHBondContact O-N 2.97Å; Y22-L25 PolarHBondContact O-N 3.43Å; V23-L25 VanDerWaalsContact C-N 3.32Å; V23-L25 PolarHBondContact O-N 3.37Å; L25-S29 WeakPolarHBondContact O-CB 3.41Å; L25-S29 PolarHBondContact O-N 2.91Å; L25-S29 PolarHBondContact O-OG 3.13Å |
| 26 | I | 98 | Very high | 96.2 | Very high | 103 Ų | 103 | 92.3 Ų | 92.3 | 53% | 0.528 | 49% | 0.493 | S | S | . | . | H | α-helix | trans | -66.7 | -45.3 | 179.1 | -72.6 | 165.6 | 0 | 0 | 0 | 110.1 | Y22 V23 D24 S29 C30 | Y22-I26 WeakPolarHBondContact O-CB 3.25Å; Y22-I26 WeakPolarHBondContact O-CD1 3.41Å; Y22-I26 WeakPolarHBondContact O-CG1 3.38Å; Y22-I26 PolarHBondContact O-N 3.22Å; V23-I26 PolarHBondContact O-N 3.33Å; V23-I26 VanDerWaalsContact O-N 3.14Å; D24-I26 PolarHBondContact O-N 2.95Å; I26-S29 PolarHBondContact O-N 3.14Å; I26-C30 WeakPolarHBondContact O-CB 3.2Å; I26-C30 PolarHBondContact O-N 3.21Å; I26-C30 PolarHBondContact O-SG 3.42Å |
| 27 | E | 97.8 | Very high | 95.9 | Very high | 124 Ų | 124 | 91.7 Ų | 91.7 | 58% | 0.579 | 48% | 0.483 | S | S | * | . | H | α-helix | trans | -61.4 | -49.1 | 179.3 | -71.5 | -173.6 | 171.7 | 0 | 0 | 111.3 | V23 D24 S29 C30 L31 | V23-E27 HydrophobicContact CG1-CG 4.39Å; V23-E27 WeakPolarHBondContact O-CG 3.15Å; V23-E27 PolarHBondContact O-N 2.92Å; D24-E27 PolarHBondContact O-N 2.68Å; E27-S29 VanDerWaalsContact C-N 3.34Å; E27-S29 PolarHBondContact O-N 2.88Å; E27-C30 PolarHBondContact O-N 2.85Å; E27-L31 WeakPolarHBondContact O-CB 3.5Å; E27-L31 PolarHBondContact O-N 3.46Å |
| 28 | D | 97.6 | Very high | 95.7 | Very high | 115 Ų | 115 | 93.8 Ų | 93.8 | 62% | 0.615 | 49% | 0.491 | S | S | * | . | H | α-helix | trans | -62.2 | -40.8 | 177.1 | -82.1 | -11.2 | 0 | 0 | 0 | 112.1 | D24 L31 G32 | D24-D28 WeakPolarHBondContact O-CB 3.33Å; D24-D28 PolarHBondContact O-N 2.94Å; D28-L31 PolarHBondContact O-N 3.36Å; D28-G32 PolarHBondContact O-N 3.43Å |
| 29 | S | 97.4 | Very high | 95.4 | Very high | 69 Ų | 69 | 99.6 Ų | 99.6 | 48% | 0.483 | 51% | 0.506 | S | S | . | . | H | α-helix | trans | -65.2 | -42.5 | 177.1 | -62.2 | 0 | 0 | 0 | 0 | 111.8 | L25 I26 E27 G32 F33 | L25-S29 WeakPolarHBondContact O-CB 3.41Å; L25-S29 PolarHBondContact O-N 2.91Å; L25-S29 PolarHBondContact O-OG 3.13Å; I26-S29 PolarHBondContact O-N 3.14Å; E27-S29 VanDerWaalsContact C-N 3.34Å; E27-S29 PolarHBondContact O-N 2.88Å; S29-G32 PolarHBondContact O-N 3.28Å; S29-F33 WeakPolarHBondContact O-CB 3.37Å; S29-F33 PolarHBondContact O-N 3.02Å |
| 30 | C | 97.4 | Very high | 94.9 | Very high | 72 Ų | 72 | 95.1 Ų | 95.1 | 49% | 0.486 | 49% | 0.488 | S | S | . | . | H | α-helix | trans | -64.3 | -42.9 | 177.3 | -71.3 | 0 | 0 | 0 | 0 | 111 | I26 E27 F33 C34 | I26-C30 WeakPolarHBondContact O-CB 3.2Å; I26-C30 PolarHBondContact O-N 3.21Å; I26-C30 PolarHBondContact O-SG 3.42Å; E27-C30 PolarHBondContact O-N 2.85Å; C30-F33 PolarHBondContact O-N 3.22Å; C30-C34 WeakPolarHBondContact O-CB 3.41Å; C30-C34 PolarHBondContact O-N 3.28Å; C30-C34 PolarHBondContact O-SG 2.96Å |
| 31 | L | 96.3 | Very high | 94.3 | Very high | 89 Ų | 89 | 93.6 Ų | 93.6 | 47% | 0.466 | 49% | 0.487 | S | S | . | . | H | α-helix | trans | -64.3 | -46.9 | 177.1 | -175.6 | 63.8 | 0 | 0 | 0 | 111.4 | E27 D28 F33 C34 F35 | E27-L31 WeakPolarHBondContact O-CB 3.5Å; E27-L31 PolarHBondContact O-N 3.46Å; D28-L31 PolarHBondContact O-N 3.36Å; L31-F33 PolarHBondContact O-N 2.93Å; L31-C34 WeakPolarHBondContact O-CB 3.42Å; L31-C34 PolarHBondContact O-N 3.48Å; L31-F35 HydrophobicContact CD1-CD2 4.42Å; L31-F35 HydrophobicContact CD1-CE1 4.34Å; L31-F35 HydrophobicContact CD1-CE2 3.7Å; L31-F35 HydrophobicContact CD1-CZ 3.64Å; L31-F35 HydrophobicContact CD2-CE2 4.05Å; L31-F35 HydrophobicContact CG-CD2 4.14Å; L31-F35 HydrophobicContact CG-CE2 3.56Å; L31-F35 HydrophobicContact CG-CZ 4.06Å; L31-F35 WeakPolarHBondContact O-CD2 3.4Å; L31-F35 PolarHBondContact O-N 2.91Å |
| 32 | G | 95.9 | Very high | 93.7 | Very high | 38 Ų | 38 | 93.8 Ų | 93.8 | 39% | 0.392 | 48% | 0.484 | S | S | . | . | H | α-helix | trans | -57.6 | -46.8 | 176.2 | 0 | 0 | 0 | 0 | 0 | 112.2 | D28 S29 C34 F35 E36 | D28-G32 PolarHBondContact O-N 3.43Å; S29-G32 PolarHBondContact O-N 3.28Å; G32-C34 PolarHBondContact O-N 3.49Å; G32-F35 PolarHBondContact O-N 3.45Å; G32-E36 PolarHBondContact O-N 3.48Å |
| 33 | F | 94.7 | Very high | 93 | Very high | 136 Ų | 136 | 90.8 Ų | 90.8 | 60% | 0.596 | 48% | 0.482 | S | S | * | . | H | α-helix | trans | -63.1 | -41.8 | 176.2 | -177.1 | -106.4 | 0 | 0 | 0 | 112.3 | S29 C30 L31 F35 E36 V37 | S29-F33 WeakPolarHBondContact O-CB 3.37Å; S29-F33 PolarHBondContact O-N 3.02Å; C30-F33 PolarHBondContact O-N 3.22Å; L31-F33 PolarHBondContact O-N 2.93Å; F33-F35 VanDerWaalsContact C-N 3.3Å; F33-F35 PolarHBondContact O-N 2.92Å; F33-E36 PolarHBondContact O-N 3.43Å; F33-V37 HydrophobicContact CD1-CG2 4.1Å; F33-V37 HydrophobicContact CD2-CG2 4.32Å; F33-V37 HydrophobicContact CE1-CG2 3.64Å; F33-V37 HydrophobicContact CE2-CG2 3.88Å; F33-V37 HydrophobicContact CG-CG2 4.42Å; F33-V37 HydrophobicContact CZ-CG2 3.52Å; F33-V37 WeakPolarHBondContact O-CG2 3.19Å; F33-V37 PolarHBondContact O-N 3.15Å |
| 34 | C | 94 | Very high | 92.2 | Very high | 77 Ų | 77 | 88.8 Ų | 88.8 | 52% | 0.52 | 48% | 0.475 | S | S | . | . | H | α-helix | trans | -59.9 | -40.8 | 176.5 | -72.6 | 0 | 0 | 0 | 0 | 111.8 | C30 L31 G32 H38 | C30-C34 WeakPolarHBondContact O-CB 3.41Å; C30-C34 PolarHBondContact O-N 3.28Å; C30-C34 PolarHBondContact O-SG 2.96Å; L31-C34 WeakPolarHBondContact O-CB 3.42Å; L31-C34 PolarHBondContact O-N 3.48Å; G32-C34 PolarHBondContact O-N 3.49Å; C34-H38 WeakPolarHBondContact O-CB 3.15Å; C34-H38 PolarHBondContact O-N 2.88Å |
| 35 | F | 92.8 | Very high | 91.1 | Very high | 130 Ų | 130 | 92.6 Ų | 92.6 | 57% | 0.57 | 49% | 0.485 | S | S | * | . | H | α-helix | trans | -69.2 | -38.2 | 175.2 | -68.1 | -38.5 | 0 | 0 | 0 | 113.1 | L31 G32 F33 H38 R39 | L31-F35 HydrophobicContact CD1-CD2 4.42Å; L31-F35 HydrophobicContact CD1-CE1 4.34Å; L31-F35 HydrophobicContact CD1-CE2 3.7Å; L31-F35 HydrophobicContact CD1-CZ 3.64Å; L31-F35 HydrophobicContact CD2-CE2 4.05Å; L31-F35 HydrophobicContact CG-CD2 4.14Å; L31-F35 HydrophobicContact CG-CE2 3.56Å; L31-F35 HydrophobicContact CG-CZ 4.06Å; L31-F35 WeakPolarHBondContact O-CD2 3.4Å; L31-F35 PolarHBondContact O-N 2.91Å; G32-F35 PolarHBondContact O-N 3.45Å; F33-F35 VanDerWaalsContact C-N 3.3Å; F33-F35 PolarHBondContact O-N 2.92Å; F35-H38 PolarHBondContact O-N 3.11Å; F35-R39 WeakPolarHBondContact O-CB 3.29Å; F35-R39 PolarHBondContact O-N 3.28Å |
| 36 | E | 92.7 | Very high | 89.3 | Confident | 124 Ų | 124 | 93.7 Ų | 93.7 | 58% | 0.579 | 49% | 0.485 | S | S | * | . | H | α-helix | trans | -64.9 | -45.4 | 176.4 | -173.1 | 166.7 | -169.5 | 0 | 0 | 111.5 | G32 F33 R39 A40 | G32-E36 PolarHBondContact O-N 3.48Å; F33-E36 PolarHBondContact O-N 3.43Å; E36-R39 PolarHBondContact O-N 3.34Å; E36-A40 VanDerWaalsContact O-CB 3.29Å; E36-A40 WeakPolarHBondContact O-CB 3.42Å; E36-A40 PolarHBondContact O-N 3.46Å |
| 37 | V | 89.6 | Confident | 87.3 | Confident | 48 Ų | 48 | 98 Ų | 98 | 29% | 0.291 | 50% | 0.496 | S | S | . | . | H | α-helix | trans | -62.5 | -46.5 | 174.3 | 172.6 | 0 | 0 | 0 | 0 | 110.7 | F33 R39 A40 V41 F46 | F33-V37 HydrophobicContact CD1-CG2 4.1Å; F33-V37 HydrophobicContact CD2-CG2 4.32Å; F33-V37 HydrophobicContact CE1-CG2 3.64Å; F33-V37 HydrophobicContact CE2-CG2 3.88Å; F33-V37 HydrophobicContact CG-CG2 4.42Å; F33-V37 HydrophobicContact CZ-CG2 3.52Å; F33-V37 WeakPolarHBondContact O-CG2 3.19Å; F33-V37 PolarHBondContact O-N 3.15Å; V37-R39 VanDerWaalsContact C-N 3.33Å; V37-R39 PolarHBondContact O-N 2.82Å; V37-A40 PolarHBondContact O-N 3.44Å; V37-A40 VanDerWaalsContact O-N 3.15Å; V37-V41 HydrophobicContact CG1-CG2 4.41Å; V37-V41 WeakPolarHBondContact O-CG2 3.36Å; V37-V41 PolarHBondContact O-N 2.91Å; V37-F46 HydrophobicContact CG1-CE2 4.07Å; V37-F46 HydrophobicContact CG1-CZ 4.5Å |
| 38 | H | 89.6 | Confident | 85.2 | Confident | 89 Ų | 89 | 98.5 Ų | 98.5 | 41% | 0.412 | 50% | 0.502 | S | S | . | . | H | α-helix | trans | -58.8 | -44.9 | 177 | -178 | 92.5 | 0 | 0 | 0 | 111.7 | C34 F35 A40 V41 K42 | C34-H38 WeakPolarHBondContact O-CB 3.15Å; C34-H38 PolarHBondContact O-N 2.88Å; F35-H38 PolarHBondContact O-N 3.11Å; H38-A40 VanDerWaalsContact C-N 3.35Å; H38-V41 PolarHBondContact O-N 2.8Å; H38-K42 WeakPolarHBondContact O-CB 3.21Å; H38-K42 PolarHBondContact O-N 2.88Å |
| 39 | R | 87.6 | Confident | 83 | Confident | 155 Ų | 155 | 101.3 Ų | 101.3 | 59% | 0.585 | 51% | 0.511 | S | S | * | . | H | α-helix | trans | -61.7 | -43.4 | 174.7 | 175.8 | 179.5 | 168.8 | -121.4 | -1.2 | 111.1 | F35 E36 V37 K42 C43 | F35-R39 WeakPolarHBondContact O-CB 3.29Å; F35-R39 PolarHBondContact O-N 3.28Å; E36-R39 PolarHBondContact O-N 3.34Å; V37-R39 VanDerWaalsContact C-N 3.33Å; V37-R39 PolarHBondContact O-N 2.82Å; R39-K42 PolarHBondContact O-N 3.41Å; R39-C43 WeakPolarHBondContact O-CB 3.05Å; R39-C43 PolarHBondContact O-N 2.88Å; R39-C43 PolarHBondContact O-SG 3.23Å |
| 40 | A | 87.1 | Confident | 80.5 | Confident | 15 Ų | 15 | 107 Ų | 107 | 12% | 0.124 | 53% | 0.528 | C | S | . | . | H | α-helix | trans | -65.8 | -40 | -179.7 | 0 | 0 | 0 | 0 | 0 | 112.3 | E36 V37 H38 G44 Y45 F46 | E36-A40 VanDerWaalsContact O-CB 3.29Å; E36-A40 WeakPolarHBondContact O-CB 3.42Å; E36-A40 PolarHBondContact O-N 3.46Å; V37-A40 PolarHBondContact O-N 3.44Å; V37-A40 VanDerWaalsContact O-N 3.15Å; H38-A40 VanDerWaalsContact C-N 3.35Å; A40-G44 PolarHBondContact O-N 2.81Å; A40-G44 VanDerWaalsContact O-N 3.16Å; A40-Y45 PolarHBondContact O-N 2.72Å; A40-F46 HydrophobicContact CB-CD2 3.66Å; A40-F46 HydrophobicContact CB-CE2 3.22Å; A40-F46 HydrophobicContact CB-CZ 3.94Å |
| 41 | V | 83.4 | Confident | 77.9 | Confident | 93 Ų | 93 | 106.3 Ų | 106.3 | 56% | 0.564 | 53% | 0.527 | S | S | * | . | H | α-helix | trans | -63.8 | -47.1 | 171 | 173 | 0 | 0 | 0 | 0 | 110.7 | V37 H38 C43 G44 F46 | V37-V41 HydrophobicContact CG1-CG2 4.41Å; V37-V41 WeakPolarHBondContact O-CG2 3.36Å; V37-V41 PolarHBondContact O-N 2.91Å; H38-V41 PolarHBondContact O-N 2.8Å; V41-C43 VanDerWaalsContact C-N 3.32Å; V41-C43 PolarHBondContact O-N 3.38Å; V41-G44 PolarHBondContact O-N 2.86Å; V41-G44 VanDerWaalsContact O-N 3.07Å; V41-F46 HydrophobicContact CB-CD2 4.45Å; V41-F46 HydrophobicContact CG2-CD2 3.6Å; V41-F46 HydrophobicContact CG2-CE2 4.07Å |
| 42 | K | 84.5 | Confident | 75.3 | Confident | 103 Ų | 103 | 109 Ų | 109 | 45% | 0.448 | 54% | 0.538 | S | S | . | . | H | α-helix | trans | -62.2 | -36.3 | -178 | -176 | 166.2 | -173.6 | -178.9 | 0 | 113.3 | H38 R39 G44 L74 C75 | H38-K42 WeakPolarHBondContact O-CB 3.21Å; H38-K42 PolarHBondContact O-N 2.88Å; R39-K42 PolarHBondContact O-N 3.41Å; K42-G44 VanDerWaalsContact C-N 3.35Å; K42-L74 VanDerWaalsContact CE-O 3.32Å; K42-L74 WeakPolarHBondContact CE-O 3.09Å; K42-L74 WeakPolarHBondContact CG-O 2.95Å; K42-C75 WeakPolarHBondContact CE-SG 3.37Å; K42-C75 HydrophobicContact CG-CB 4.31Å; K42-C75 WeakPolarHBondContact CG-SG 2.99Å |
| 43 | C | 83.5 | Confident | 72.8 | Confident | 73 Ų | 73 | 114.6 Ų | 114.6 | 49% | 0.493 | 56% | 0.564 | S | S | . | * | T | Hydrogen-bonded Turn | trans | -89 | -0.2 | 177 | -67.2 | 0 | 0 | 0 | 0 | 113.4 | R39 V41 Y45 | R39-C43 WeakPolarHBondContact O-CB 3.05Å; R39-C43 PolarHBondContact O-N 2.88Å; R39-C43 PolarHBondContact O-SG 3.23Å; V41-C43 VanDerWaalsContact C-N 3.32Å; V41-C43 PolarHBondContact O-N 3.38Å; C43-Y45 VanDerWaalsContact C-N 3.34Å; C43-Y45 HydrophobicContact CB-CD2 3.35Å; C43-Y45 HydrophobicContact CB-CE2 3.18Å; C43-Y45 HydrophobicContact CB-CG 4.45Å; C43-Y45 PolarHBondContact O-N 3.43Å |
| 44 | G | 81.7 | Confident | 70.3 | Confident | 26 Ų | 26 | 112 Ų | 112 | 27% | 0.268 | 58% | 0.576 | S | S | . | * | T | Hydrogen-bonded Turn | trans | 73.1 | 18.7 | 179.9 | 0 | 0 | 0 | 0 | 0 | 114.8 | A40 V41 K42 F46 Y47 | A40-G44 PolarHBondContact O-N 2.81Å; A40-G44 VanDerWaalsContact O-N 3.16Å; V41-G44 PolarHBondContact O-N 2.86Å; V41-G44 VanDerWaalsContact O-N 3.07Å; K42-G44 VanDerWaalsContact C-N 3.35Å; G44-F46 VanDerWaalsContact C-N 3.27Å; G44-F46 PolarHBondContact O-N 3.07Å; G44-Y47 WeakPolarHBondContact O-CD2 3.32Å; G44-Y47 WeakPolarHBondContact O-CE2 3.32Å |
| 45 | Y | 72.8 | Confident | 67.8 | Low | 164 Ų | 164 | 112.4 Ų | 112.4 | 64% | 0.643 | 58% | 0.579 | S | S | * | * | trans | -70.4 | -23.1 | 177.7 | -68.2 | -70.4 | 0 | 0 | 0 | 113.1 | A40 C43 Y47 | A40-Y45 PolarHBondContact O-N 2.72Å; C43-Y45 VanDerWaalsContact C-N 3.34Å; C43-Y45 HydrophobicContact CB-CD2 3.35Å; C43-Y45 HydrophobicContact CB-CE2 3.18Å; C43-Y45 HydrophobicContact CB-CG 4.45Å; C43-Y45 PolarHBondContact O-N 3.43Å; Y45-Y47 VanDerWaalsContact C-N 3.35Å; Y45-Y47 PolarHBondContact O-N 3.18Å | ||
| 46 | F | 61.6 | Low | 65.6 | Low | 125 Ų | 125 | 112.7 Ų | 112.7 | 55% | 0.548 | 59% | 0.592 | S | S | . | * | trans | -85.8 | 82.3 | 165 | -63.4 | -71 | 0 | 0 | 0 | 108.9 | V37 A40 V41 G44 L48 | V37-F46 HydrophobicContact CG1-CE2 4.07Å; V37-F46 HydrophobicContact CG1-CZ 4.5Å; A40-F46 HydrophobicContact CB-CD2 3.66Å; A40-F46 HydrophobicContact CB-CE2 3.22Å; A40-F46 HydrophobicContact CB-CZ 3.94Å; V41-F46 HydrophobicContact CB-CD2 4.45Å; V41-F46 HydrophobicContact CG2-CD2 3.6Å; V41-F46 HydrophobicContact CG2-CE2 4.07Å; G44-F46 VanDerWaalsContact C-N 3.27Å; G44-F46 PolarHBondContact O-N 3.07Å; F46-L48 PolarHBondContact O-N 3.37Å | ||
| 47 | Y | 54.8 | Low | 63.4 | Low | 194 Ų | 194 | 114.3 Ų | 114.3 | 76% | 0.761 | 60% | 0.597 | S | S | * | * | trans | -70.3 | 126.3 | 158 | -77.2 | -85.7 | 0 | 0 | 0 | 107.1 | G44 Y45 E49 | G44-Y47 WeakPolarHBondContact O-CD2 3.32Å; G44-Y47 WeakPolarHBondContact O-CE2 3.32Å; Y45-Y47 VanDerWaalsContact C-N 3.35Å; Y45-Y47 PolarHBondContact O-N 3.18Å; Y47-E49 PolarHBondContact O-N 3.16Å | ||
| 48 | L | 55.3 | Low | 61.3 | Low | 134 Ų | 134 | 118.6 Ų | 118.6 | 70% | 0.702 | 62% | 0.618 | S | S | * | * | trans | -66.3 | 68.1 | 170.4 | -164.8 | 72.2 | 0 | 0 | 0 | 107.6 | F46 F50 A51 | F46-L48 PolarHBondContact O-N 3.37Å; L48-F50 PolarHBondContact O-N 3.47Å; L48-A51 HydrophobicContact CB-CB 4.13Å; L48-A51 HydrophobicContact CD2-CB 3.42Å; L48-A51 VanDerWaalsContact CD2-CB 3.42Å; L48-A51 HydrophobicContact CG-CB 3.63Å; L48-A51 WeakPolarHBondContact O-CA 3.35Å; L48-A51 WeakPolarHBondContact O-CB 3.48Å; L48-A51 PolarHBondContact O-N 3.01Å | ||
| 49 | E | 50.2 | Low | 59.2 | Low | 173 Ų | 173 | 122.4 Ų | 122.4 | 81% | 0.808 | 63% | 0.634 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -71.3 | -2.7 | 174 | -140.1 | 177.5 | -176.5 | 0 | 0 | 110.8 | Y47 | Y47-E49 PolarHBondContact O-N 3.16Š|
| 50 | F | 44.3 | Very low | 56.7 | Low | 190 Ų | 190 | 117.7 Ų | 117.7 | 83% | 0.833 | 63% | 0.634 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -94.5 | 3.4 | 161.5 | -69.8 | -75.4 | 0 | 0 | 0 | 114.4 | L48 E52 | L48-F50 PolarHBondContact O-N 3.47Å; F50-E52 PolarHBondContact O-N 3.22Å |
| 51 | A | 43.9 | Very low | 54.5 | Low | 57 Ų | 57 | 124.4 Ų | 124.4 | 47% | 0.471 | 67% | 0.666 | S | S | . | * | trans | -78.9 | 57.7 | 151.4 | 0 | 0 | 0 | 0 | 0 | 107.7 | L48 T53 | L48-A51 HydrophobicContact CB-CB 4.13Å; L48-A51 HydrophobicContact CD2-CB 3.42Å; L48-A51 VanDerWaalsContact CD2-CB 3.42Å; L48-A51 HydrophobicContact CG-CB 3.63Å; L48-A51 WeakPolarHBondContact O-CA 3.35Å; L48-A51 WeakPolarHBondContact O-CB 3.48Å; L48-A51 PolarHBondContact O-N 3.01Å; A51-T53 PolarHBondContact O-N 2.81Å | ||
| 52 | E | 42.1 | Very low | 52.5 | Low | 146 Ų | 146 | 127.6 Ų | 127.6 | 68% | 0.682 | 67% | 0.674 | S | S | * | * | trans | -49.8 | 117.9 | 149.5 | -78.2 | -173.3 | 159.9 | 0 | 0 | 106.2 | F50 G54 S55 | F50-E52 PolarHBondContact O-N 3.22Å; E52-G54 VanDerWaalsContact C-N 3.28Å; E52-G54 PolarHBondContact O-N 2.75Å; E52-S55 PolarHBondContact O-N 3.01Å | ||
| 53 | T | 43.2 | Very low | 50.7 | Low | 154 Ų | 154 | 128.2 Ų | 128.2 | 95% | 0.945 | 69% | 0.689 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -42.2 | 87 | 172.8 | -37.2 | 0 | 0 | 0 | 0 | 109.5 | A51 | A51-T53 PolarHBondContact O-N 2.81Š|
| 54 | G | 41.6 | Very low | 49 | Very low | 82 Ų | 82 | 130.8 Ų | 130.8 | 85% | 0.845 | 70% | 0.702 | S | S | * | * | T | Hydrogen-bonded Turn | trans | 137.9 | -4.9 | 177.5 | 0 | 0 | 0 | 0 | 0 | 118.5 | E52 | E52-G54 VanDerWaalsContact C-N 3.28Å; E52-G54 PolarHBondContact O-N 2.75Å |
| 55 | S | 41.2 | Very low | 47.3 | Very low | 85 Ų | 85 | 138.2 Ų | 138.2 | 59% | 0.594 | 73% | 0.73 | S | S | * | * | trans | -113.4 | 45.6 | -177.3 | 175.3 | 0 | 0 | 0 | 0 | 113.3 | E52 K57 | E52-S55 PolarHBondContact O-N 3.01Å; S55-K57 VanDerWaalsContact C-N 3.28Å; S55-K57 PolarHBondContact O-N 3.04Å | ||
| 56 | V | 46.3 | Very low | 46 | Very low | 136 Ų | 136 | 136.6 Ų | 136.6 | 82% | 0.824 | 73% | 0.732 | S | S | * | * | trans | -75.2 | 91.3 | 160.2 | -175.8 | 0 | 0 | 0 | 0 | 106.1 | D58 | V56-D58 PolarHBondContact O-N 3.01Š| ||
| 57 | K | 48.2 | Very low | 44.8 | Very low | 159 Ų | 159 | 140.6 Ų | 140.6 | 69% | 0.691 | 75% | 0.75 | S | S | * | * | trans | -62.7 | 99.9 | 159 | -90.4 | -178 | 175.1 | 177.8 | 0 | 106.1 | S55 F59 | S55-K57 VanDerWaalsContact C-N 3.28Å; S55-K57 PolarHBondContact O-N 3.04Å; K57-F59 HydrophobicContact CB-CD2 3.89Å; K57-F59 HydrophobicContact CB-CE2 3.51Å; K57-F59 HydrophobicContact CB-CZ 4.12Å; K57-F59 HydrophobicContact CD-CE2 4.07Å; K57-F59 HydrophobicContact CD-CZ 3.96Å; K57-F59 HydrophobicContact CG-CE2 4.42Å; K57-F59 VanDerWaalsContact O-CD2 3.23Å; K57-F59 WeakPolarHBondContact O-CD2 3.28Å; K57-F59 PolarHBondContact O-N 3.29Å | ||
| 58 | D | 44.4 | Very low | 43.8 | Very low | 137 Ų | 137 | 134.1 Ų | 134.1 | 73% | 0.733 | 74% | 0.742 | S | S | * | * | trans | -56.3 | 84.7 | 168.7 | -179.6 | 30.3 | 0 | 0 | 0 | 108.8 | V56 G60 | V56-D58 PolarHBondContact O-N 3.01Å; D58-G60 PolarHBondContact O-N 2.81Å; D58-G60 VanDerWaalsContact O-N 3.15Å; D58-G60 PolarHBondContact OD1-N 2.79Å | ||
| 59 | F | 45.5 | Very low | 43.1 | Very low | 169 Ų | 169 | 131 Ų | 131 | 74% | 0.741 | 74% | 0.736 | S | S | * | * | trans | -83.9 | 53.1 | 167.6 | -70.5 | -75.4 | 0 | 0 | 0 | 109.3 | K57 I61 | K57-F59 HydrophobicContact CB-CD2 3.89Å; K57-F59 HydrophobicContact CB-CE2 3.51Å; K57-F59 HydrophobicContact CB-CZ 4.12Å; K57-F59 HydrophobicContact CD-CE2 4.07Å; K57-F59 HydrophobicContact CD-CZ 3.96Å; K57-F59 HydrophobicContact CG-CE2 4.42Å; K57-F59 VanDerWaalsContact O-CD2 3.23Å; K57-F59 WeakPolarHBondContact O-CD2 3.28Å; K57-F59 PolarHBondContact O-N 3.29Å; F59-I61 PolarHBondContact O-N 2.91Å | ||
| 60 | G | 36 | Very low | 42.6 | Very low | 57 Ų | 57 | 128.9 Ų | 128.9 | 59% | 0.588 | 74% | 0.739 | S | S | * | * | trans | 51.4 | 29.1 | 158.3 | 0 | 0 | 0 | 0 | 0 | 116.7 | D58 Q62 | D58-G60 PolarHBondContact O-N 2.81Å; D58-G60 VanDerWaalsContact O-N 3.15Å; D58-G60 PolarHBondContact OD1-N 2.79Å; G60-Q62 PolarHBondContact O-N 2.88Å | ||
| 61 | I | 40.2 | Very low | 42.4 | Very low | 156 Ų | 156 | 129.8 Ų | 129.8 | 80% | 0.8 | 74% | 0.736 | S | S | * | * | trans | -79.7 | 86.1 | 167.7 | -54 | -171.2 | 0 | 0 | 0 | 105.7 | F59 | F59-I61 PolarHBondContact O-N 2.91Š| ||
| 62 | Q | 42.1 | Very low | 42.4 | Very low | 159 Ų | 159 | 133.8 Ų | 133.8 | 74% | 0.743 | 75% | 0.749 | S | S | * | * | trans | -43.5 | 130.5 | 170.2 | -72.4 | -103.6 | 41.3 | 0 | 0 | 108.9 | G60 V64 | G60-Q62 PolarHBondContact O-N 2.88Å; Q62-V64 VanDerWaalsContact C-N 3.31Å; Q62-V64 PolarHBondContact O-N 2.96Å | ||
| 63 | P | 46.7 | Very low | 42.5 | Very low | 116 Ų | 116 | 132 Ų | 132 | 75% | 0.753 | 75% | 0.75 | S | S | * | * | trans | -63.5 | 98.2 | 174.7 | 23.6 | -27.7 | 0 | 0 | 0 | 107.9 | E65 | P63-E65 PolarHBondContact O-N 3.07Å; P63-E65 VanDerWaalsContact O-N 3.15Å | ||
| 64 | V | 47.2 | Very low | 42.8 | Very low | 128 Ų | 128 | 128.5 Ų | 128.5 | 78% | 0.776 | 73% | 0.725 | S | S | * | * | trans | -64.3 | 114.1 | 167.4 | 162.6 | 0 | 0 | 0 | 0 | 106.3 | Q62 D66 | Q62-V64 VanDerWaalsContact C-N 3.31Å; Q62-V64 PolarHBondContact O-N 2.96Å; V64-D66 PolarHBondContact O-N 2.9Å | ||
| 65 | E | 45.2 | Very low | 42.6 | Very low | 182 Ų | 182 | 128 Ų | 128 | 85% | 0.85 | 71% | 0.708 | S | S | * | * | trans | -47.3 | 122.6 | 166.4 | -62.2 | 177.3 | 107.8 | 0 | 0 | 108.7 | P63 K67 | P63-E65 PolarHBondContact O-N 3.07Å; P63-E65 VanDerWaalsContact O-N 3.15Å; E65-K67 PolarHBondContact O-N 2.86Å | ||
| 66 | D | 45.5 | Very low | 42.6 | Very low | 129 Ų | 129 | 129.4 Ų | 129.4 | 69% | 0.69 | 72% | 0.718 | S | S | * | * | trans | -46.6 | 118.7 | -168.9 | 178.4 | 43.4 | 0 | 0 | 0 | 114 | V64 G68 | V64-D66 PolarHBondContact O-N 2.9Å; D66-G68 PolarHBondContact OD1-N 2.98Å | ||
| 67 | K | 36.9 | Very low | 42.5 | Very low | 209 Ų | 209 | 129.8 Ų | 129.8 | 91% | 0.909 | 71% | 0.714 | S | S | * | * | S | Bend | trans | -136.1 | 75.9 | 145.9 | -81.9 | -168.4 | 175.4 | -179.7 | 0 | 108.6 | E65 | E65-K67 PolarHBondContact O-N 2.86Š|
| 68 | G | 34.3 | Very low | 42.1 | Very low | 59 Ų | 59 | 128.4 Ų | 128.4 | 61% | 0.608 | 72% | 0.722 | S | S | * | * | S | Bend | trans | 100 | 87.5 | 169.4 | 0 | 0 | 0 | 0 | 0 | 110.9 | D66 C70 | D66-G68 PolarHBondContact OD1-N 2.98Å; G68-C70 PolarHBondContact O-N 3.43Å |
| 69 | A | 40 | Very low | 42 | Very low | 68 Ų | 68 | 125 Ų | 125 | 56% | 0.562 | 72% | 0.72 | S | S | * | * | trans | -38.3 | 107.7 | 161.8 | 0 | 0 | 0 | 0 | 0 | 111.4 | R71 | A69-R71 HydrophobicContact CB-CB 4.1Å; A69-R71 HydrophobicContact CB-CG 3.73Å; A69-R71 PolarHBondContact O-N 3.15Å | ||
| 70 | C | 40.2 | Very low | 42 | Very low | 129 Ų | 129 | 125.7 Ų | 125.7 | 87% | 0.872 | 73% | 0.725 | S | S | * | * | trans | -73.1 | 48.2 | 149.5 | -70.6 | 0 | 0 | 0 | 0 | 108.9 | G68 L72 | G68-C70 PolarHBondContact O-N 3.43Å; C70-L72 VanDerWaalsContact C-N 3.26Å; C70-L72 PolarHBondContact O-N 2.88Å | ||
| 71 | R | 40.7 | Very low | 42.5 | Very low | 209 Ų | 209 | 128.7 Ų | 128.7 | 79% | 0.789 | 73% | 0.734 | S | S | * | * | trans | -59.3 | 105.1 | 145.8 | -73.7 | -98.3 | -167.2 | -162.1 | 1.4 | 102 | A69 P73 | A69-R71 HydrophobicContact CB-CB 4.1Å; A69-R71 HydrophobicContact CB-CG 3.73Å; A69-R71 PolarHBondContact O-N 3.15Å; R71-P73 VanDerWaalsContact C-N 3.34Å; R71-P73 WeakPolarHBondContact O-CD 3.23Å | ||
| 72 | L | 43.3 | Very low | 42.5 | Very low | 140 Ų | 140 | 124.8 Ų | 124.8 | 73% | 0.733 | 73% | 0.732 | S | S | * | * | trans | -52.3 | 109.5 | 166.1 | -74.1 | 176.1 | 0 | 0 | 0 | 105.3 | C70 L74 | C70-L72 VanDerWaalsContact C-N 3.26Å; C70-L72 PolarHBondContact O-N 2.88Å; L72-L74 HydrophobicContact CB-CB 4.44Å; L72-L74 HydrophobicContact CB-CD1 4.07Å; L72-L74 HydrophobicContact CB-CG 4.2Å; L72-L74 HydrophobicContact CD1-CD1 4.29Å; L72-L74 HydrophobicContact CD2-CD1 4.3Å; L72-L74 HydrophobicContact CG-CD1 4.46Å; L72-L74 PolarHBondContact O-N 2.86Å | ||
| 73 | P | 43 | Very low | 42.4 | Very low | 110 Ų | 110 | 125.8 Ų | 125.8 | 71% | 0.714 | 74% | 0.743 | S | S | * | * | trans | -82.4 | 60.3 | -178.2 | 32.6 | -24.5 | 0 | 0 | 0 | 105.6 | R71 | R71-P73 VanDerWaalsContact C-N 3.34Å; R71-P73 WeakPolarHBondContact O-CD 3.23Å | ||
| 74 | L | 50.7 | Low | 42.4 | Very low | 79 Ų | 79 | 122.6 Ų | 122.6 | 41% | 0.414 | 73% | 0.731 | S | S | . | * | S | Bend | trans | -106.6 | 22.1 | -174.8 | -71.3 | 175.5 | 0 | 0 | 0 | 111.3 | K42 L72 | K42-L74 VanDerWaalsContact CE-O 3.32Å; K42-L74 WeakPolarHBondContact CE-O 3.09Å; K42-L74 WeakPolarHBondContact CG-O 2.95Å; L72-L74 HydrophobicContact CB-CB 4.44Å; L72-L74 HydrophobicContact CB-CD1 4.07Å; L72-L74 HydrophobicContact CB-CG 4.2Å; L72-L74 HydrophobicContact CD1-CD1 4.29Å; L72-L74 HydrophobicContact CD2-CD1 4.3Å; L72-L74 HydrophobicContact CG-CD1 4.46Å; L72-L74 PolarHBondContact O-N 2.86Å |
| 75 | C | 37.9 | Very low | 42.3 | Very low | 71 Ų | 71 | 122.6 Ų | 122.6 | 48% | 0.48 | 73% | 0.734 | S | S | . | * | trans | 179.2 | 91.5 | 149.2 | -97.7 | 0 | 0 | 0 | 0 | 108.4 | K42 L77 | K42-C75 WeakPolarHBondContact CE-SG 3.37Å; K42-C75 HydrophobicContact CG-CB 4.31Å; K42-C75 WeakPolarHBondContact CG-SG 2.99Å; C75-L77 PolarHBondContact O-N 3.21Å | ||
| 76 | S | 39.7 | Very low | 42 | Very low | 115 Ų | 115 | 120.9 Ų | 120.9 | 80% | 0.804 | 73% | 0.73 | S | S | * | * | trans | -66.3 | 98.8 | 149.4 | -58.9 | 0 | 0 | 0 | 0 | 105.9 | ||||
| 77 | L | 45.5 | Very low | 42.1 | Very low | 144 Ų | 144 | 123.2 Ų | 123.2 | 75% | 0.754 | 74% | 0.737 | S | S | * | * | trans | -50.7 | 133.2 | 164.7 | -86 | 159 | 0 | 0 | 0 | 107.8 | C75 G79 | C75-L77 PolarHBondContact O-N 3.21Å; L77-G79 PolarHBondContact O-N 3.35Å | ||
| 78 | P | 40.2 | Very low | 42.3 | Very low | 130 Ų | 130 | 121 Ų | 121 | 84% | 0.844 | 73% | 0.73 | S | S | * | * | S | Bend | trans | -69.1 | 104.2 | 175.6 | 28.3 | -29.6 | 0 | 0 | 0 | 107.6 | ||
| 79 | G | 40.3 | Very low | 42.8 | Very low | 67 Ų | 67 | 124.9 Ų | 124.9 | 69% | 0.691 | 74% | 0.736 | S | S | * | * | trans | 105.9 | 82.8 | 167.4 | 0 | 0 | 0 | 0 | 0 | 114.9 | L77 | L77-G79 PolarHBondContact O-N 3.35Š| ||
| 80 | E | 46.5 | Very low | 42.9 | Very low | 183 Ų | 183 | 130 Ų | 130 | 86% | 0.855 | 75% | 0.748 | S | S | * | * | trans | -108.2 | 115.3 | 141.8 | -86 | -119 | 87.9 | 0 | 0 | 106.8 | G82 | E80-G82 PolarHBondContact O-N 2.94Š| ||
| 81 | P | 47.2 | Very low | 43.3 | Very low | 119 Ų | 119 | 134.7 Ų | 134.7 | 77% | 0.773 | 75% | 0.748 | S | S | * | * | trans | -68.8 | 117.2 | 177.6 | 27.3 | -28.6 | 0 | 0 | 0 | 108.3 | N83 | P81-N83 PolarHBondContact O-N 3.43Š| ||
| 82 | G | 40 | Very low | 44.2 | Very low | 74 Ų | 74 | 129.5 Ų | 129.5 | 76% | 0.763 | 74% | 0.743 | S | S | * | * | trans | -52.8 | 131 | 175.1 | 0 | 0 | 0 | 0 | 0 | 111.1 | E80 G84 | E80-G82 PolarHBondContact O-N 2.94Å; G82-G84 VanDerWaalsContact C-N 3.32Å; G82-G84 PolarHBondContact O-N 2.8Å | ||
| 83 | N | 39 | Very low | 45.2 | Very low | 180 Ų | 180 | 128 Ų | 128 | 96% | 0.963 | 74% | 0.742 | S | S | * | * | trans | -59.4 | 90.7 | 173.1 | -167.9 | 15.7 | 0 | 0 | 0 | 109.8 | P81 | P81-N83 PolarHBondContact O-N 3.43Š| ||
| 84 | G | 47.4 | Very low | 46.1 | Very low | 50 Ų | 50 | 127.9 Ų | 127.9 | 52% | 0.515 | 74% | 0.741 | S | S | . | * | trans | -132.2 | 141.1 | 170.9 | 0 | 0 | 0 | 0 | 0 | 108.4 | G82 D86 | G82-G84 VanDerWaalsContact C-N 3.32Å; G82-G84 PolarHBondContact O-N 2.8Å; G84-D86 PolarHBondContact O-N 3Å | ||
| 85 | P | 44.2 | Very low | 47 | Very low | 127 Ų | 127 | 133.5 Ų | 133.5 | 83% | 0.825 | 77% | 0.765 | S | S | * | * | S | Bend | trans | -68.1 | 133 | -175.4 | 29.6 | -32.4 | 0 | 0 | 0 | 110.2 | ||
| 86 | D | 38.8 | Very low | 48.3 | Very low | 146 Ų | 146 | 139.4 Ų | 139.4 | 78% | 0.781 | 78% | 0.783 | S | S | * | * | trans | 39.7 | 89 | 159.9 | -99.7 | -84.3 | 0 | 0 | 0 | 117.6 | G84 | G84-D86 PolarHBondContact O-N 3Š| ||
| 87 | Q | 47.7 | Very low | 49.7 | Very low | 179 Ų | 179 | 146.7 Ų | 146.7 | 84% | 0.836 | 81% | 0.805 | S | S | * | * | trans | -117.5 | 96.5 | 148 | -75.1 | -169.5 | 56.3 | 0 | 0 | 109.2 | L89 | Q87-L89 PolarHBondContact O-N 3.24Š| ||
| 88 | Q | 40.9 | Very low | 50 | Low | 163 Ų | 163 | 146.8 Ų | 146.8 | 76% | 0.762 | 81% | 0.807 | S | S | * | * | trans | -41.7 | 94.7 | 161.9 | -79.8 | -94.8 | 31.7 | 0 | 0 | 111.2 | ||||
| 89 | L | 45.7 | Very low | 50.5 | Low | 140 Ų | 140 | 147.7 Ų | 147.7 | 73% | 0.733 | 81% | 0.805 | S | S | * | * | trans | -107.5 | 82 | 164.4 | -78 | 166.5 | 0 | 0 | 0 | 107.8 | Q87 R91 | Q87-L89 PolarHBondContact O-N 3.24Å; L89-R91 VanDerWaalsContact C-N 3.3Å; L89-R91 PolarHBondContact O-N 3.24Å | ||
| 90 | Q | 41.5 | Very low | 51 | Low | 175 Ų | 175 | 152.2 Ų | 152.2 | 82% | 0.818 | 81% | 0.811 | S | S | * | * | trans | -58 | 96.8 | 157.2 | -83.2 | -158.8 | -44.4 | 0 | 0 | 108.2 | ||||
| 91 | R | 48.4 | Very low | 51.3 | Low | 228 Ų | 228 | 150.4 Ų | 150.4 | 86% | 0.86 | 81% | 0.809 | S | S | * | * | trans | -94.3 | 102.8 | 160.1 | -78.8 | -158.5 | -164.9 | -177.1 | 6.8 | 108.2 | L89 | L89-R91 VanDerWaalsContact C-N 3.3Å; L89-R91 PolarHBondContact O-N 3.24Å | ||
| 92 | S | 60.2 | Low | 51.6 | Low | 99 Ų | 99 | 152.3 Ų | 152.3 | 69% | 0.692 | 81% | 0.811 | S | S | * | * | P | Polyproline II helix | trans | -59.8 | 145.1 | 163.9 | -49.7 | 0 | 0 | 0 | 0 | 110 | ||
| 93 | P | 65.3 | Low | 52.3 | Low | 110 Ų | 110 | 157.5 Ų | 157.5 | 71% | 0.714 | 81% | 0.814 | S | S | * | * | P | Polyproline II helix | trans | -64.5 | 147.9 | 171.7 | -12 | 26.5 | 0 | 0 | 0 | 110.2 | E95 | P93-E95 PolarHBondContact O-N 3.15Š|
| 94 | P | 61.1 | Low | 53.3 | Low | 106 Ų | 106 | 155.9 Ų | 155.9 | 69% | 0.688 | 80% | 0.804 | S | S | * | * | P | Polyproline II helix | trans | -70.3 | 118.9 | 171.8 | 27.9 | -29.1 | 0 | 0 | 0 | 109.3 | F96 | P94-F96 HydrophobicContact CB-CE2 4.37Å; P94-F96 HydrophobicContact CG-CE2 4.28Å |
| 95 | E | 69.7 | Low | 53.7 | Low | 197 Ų | 197 | 164.1 Ų | 164.1 | 92% | 0.921 | 83% | 0.826 | S | S | * | * | P | Polyproline II helix | trans | -76.3 | 120.4 | 166 | -62.9 | -152.1 | 103.3 | 0 | 0 | 108.8 | P93 | P93-E95 PolarHBondContact O-N 3.15Š|
| 96 | F | 65.5 | Low | 54.5 | Low | 195 Ų | 195 | 167.2 Ų | 167.2 | 86% | 0.855 | 83% | 0.826 | S | S | * | * | P | Polyproline II helix | trans | -93.7 | 120.3 | 165.6 | -75.5 | -90.9 | 0 | 0 | 0 | 107.4 | P94 | P94-F96 HydrophobicContact CB-CE2 4.37Å; P94-F96 HydrophobicContact CG-CE2 4.28Å |
| 97 | Q | 69.6 | Low | 56 | Low | 268 Ų | 268 | 169.1 Ų | 169.1 | 100% | 1.252 | 83% | 0.83 | S | S | * | * | trans | -106.5 | 0 | 164.4 | -167.7 | 170.5 | -63.9 | 0 | 0 | 109.7 |
Retrieved 97 of 97 residues in 24.4 ms
(Link to these results)