| 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 | 49.3 | Very low | 78.4 | Confident | 188 Ų | 188 | 78.3 Ų | 78.3 | 93% | 0.926 | 44% | 0.444 | S | S | * | . | 0 | 122.2 | 0 | -71.1 | -168.1 | 128.5 | 0 | 0 | 106.2 | G3 I32 | M1-G3 PolarHBondContact O-N 2.9Å; M1-I32 HydrophobicContact SD-CG2 4.44Å | |||
| 2 | D | 60.8 | Low | 79.7 | Confident | 149 Ų | 149 | 72.5 Ų | 72.5 | 80% | 0.797 | 41% | 0.411 | S | S | * | . | trans | -56.1 | 132.7 | 166.9 | -51.6 | -59 | 0 | 0 | 0 | 106.6 | Q36 | D2-Q36 PolarHBondContact O-OE1 3.35Š| ||
| 3 | G | 64.2 | Low | 80.8 | Confident | 38 Ų | 38 | 67.1 Ų | 67.1 | 39% | 0.392 | 38% | 0.38 | S | S | . | . | trans | -60.5 | -156.7 | -175.8 | 0 | 0 | 0 | 0 | 0 | 113.2 | M1 G5 R7 | M1-G3 PolarHBondContact O-N 2.9Å; G3-G5 PolarHBondContact O-N 3.06Å; G3-R7 PolarHBondContact O-NH2 2.89Å | ||
| 4 | L | 64.2 | Low | 81.7 | Confident | 6 Ų | 6 | 66.6 Ų | 66.6 | 3% | 0.031 | 38% | 0.383 | C | S | . | . | S | Bend | trans | -51.6 | -29.9 | 177.7 | -82.4 | 157.2 | 0 | 0 | 0 | 113.7 | D6 R7 P9 L12 I37 W64 | L4-D6 PolarHBondContact O-N 2.79Å; L4-R7 WeakPolarHBondContact CD2-O 3.45Å; L4-R7 VanDerWaalsContact O-CB 3.27Å; L4-R7 WeakPolarHBondContact O-CB 3.2Å; L4-R7 PolarHBondContact O-N 2.93Å; L4-R7 PolarHBondContact O-NE 3.03Å; L4-P9 HydrophobicContact CD1-CG 4.3Å; L4-P9 HydrophobicContact CD2-CG 4.36Å; L4-L12 HydrophobicContact CD2-CB 3.89Å; L4-L12 HydrophobicContact CD2-CD2 3.72Å; L4-L12 HydrophobicContact CD2-CG 4.41Å; L4-L12 HydrophobicContact CG-CD2 4.32Å; L4-I37 HydrophobicContact CD1-CD1 3.75Å; L4-I37 HydrophobicContact CD2-CD1 4.25Å; L4-I37 HydrophobicContact CG-CD1 4.28Å; L4-W64 HydrophobicContact CB-CH2 4.24Å; L4-W64 HydrophobicContact CB-CZ3 4.46Å; L4-W64 HydrophobicContact CD1-CE3 3.72Å; L4-W64 HydrophobicContact CD1-CH2 3.89Å; L4-W64 HydrophobicContact CD1-CZ3 3.29Å |
| 5 | G | 78 | Confident | 82.4 | Confident | 59 Ų | 59 | 68.2 Ų | 68.2 | 61% | 0.608 | 39% | 0.386 | S | S | * | . | T | Hydrogen-bonded Turn | trans | 57.8 | -127.2 | -175.3 | 0 | 0 | 0 | 0 | 0 | 109.1 | G3 | G3-G5 PolarHBondContact O-N 3.06Š|
| 6 | D | 82 | Confident | 83 | Confident | 174 Ų | 174 | 65.3 Ų | 65.3 | 93% | 0.93 | 37% | 0.368 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -88.3 | -1.6 | 174.5 | -61.1 | -34.8 | 0 | 0 | 0 | 113.6 | L4 | L4-D6 PolarHBondContact O-N 2.79Š|
| 7 | R | 87.8 | Confident | 83.6 | Confident | 84 Ų | 84 | 63.1 Ų | 63.1 | 32% | 0.317 | 36% | 0.355 | S | S | . | . | trans | -80.3 | 146.3 | -176.7 | -63.7 | 171.5 | -75 | -173.8 | -4.2 | 111.1 | G3 L4 Q11 E15 | G3-R7 PolarHBondContact O-NH2 2.89Å; L4-R7 WeakPolarHBondContact CD2-O 3.45Å; L4-R7 VanDerWaalsContact O-CB 3.27Å; L4-R7 WeakPolarHBondContact O-CB 3.2Å; L4-R7 PolarHBondContact O-N 2.93Å; L4-R7 PolarHBondContact O-NE 3.03Å; R7-Q11 HydrophobicContact CB-CB 4.34Å; R7-E15 WeakPolarHBondContact CD-OE1 3.15Å; R7-E15 IonicContact CZ-OE2 3.77Å; R7-E15 IonicContact NH1-OE2 2.71Å; R7-E15 PolarHBondContact NH1-OE2 2.73Å | ||
| 8 | T | 92.7 | Very high | 84.1 | Confident | 39 Ų | 39 | 64.2 Ų | 64.2 | 24% | 0.239 | 37% | 0.373 | C | S | . | . | trans | -80.9 | 153.9 | 167.4 | 72.6 | 0 | 0 | 0 | 0 | 110.9 | S10 Q11 L12 D61 | T8-S10 PolarHBondContact O-N 2.67Å; T8-Q11 WeakPolarHBondContact O-CB 3.38Å; T8-Q11 PolarHBondContact O-N 2.66Å; T8-Q11 WeakPolarHBondContact OG1-CG 3.38Å; T8-Q11 PolarHBondContact OG1-N 2.74Å; T8-L12 PolarHBondContact O-N 3.04Å; T8-D61 WeakPolarHBondContact CB-OD1 3.43Å | ||
| 9 | P | 94.6 | Very high | 84.4 | Confident | 0 Ų | 0 | 68.5 Ų | 68.5 | 0% | 0 | 39% | 0.394 | C | S | . | . | H | α-helix | trans | -46.4 | -40.9 | 170.9 | -28.5 | 30.8 | 0 | 0 | 0 | 114.7 | L4 L12 M13 F33 I37 A60 D61 W64 | L4-P9 HydrophobicContact CD1-CG 4.3Å; L4-P9 HydrophobicContact CD2-CG 4.36Å; P9-L12 PolarHBondContact O-N 2.57Å; P9-M13 WeakPolarHBondContact O-CB 3.05Å; P9-M13 PolarHBondContact O-N 3.24Å; P9-F33 HydrophobicContact CB-CE2 4.47Å; P9-F33 HydrophobicContact CB-CZ 4.07Å; P9-F33 WeakPolarHBondContact O-CE2 3.36Å; P9-I37 HydrophobicContact CB-CD1 3.99Å; P9-I37 HydrophobicContact CG-CD1 4.07Å; P9-A60 HydrophobicContact CB-CB 3.59Å; P9-A60 HydrophobicContact CG-CB 3.97Å; P9-D61 WeakPolarHBondContact CA-OD1 3.45Å; P9-D61 VanDerWaalsContact CB-OD1 3.26Å; P9-D61 WeakPolarHBondContact CB-OD1 3.46Å; P9-D61 WeakPolarHBondContact CD-OD1 3.27Å; P9-D61 WeakPolarHBondContact CG-OD1 3.23Å; P9-W64 HydrophobicContact CG-CB 4.17Å; P9-W64 HydrophobicContact CG-CG 4.37Å |
| 10 | S | 94.3 | Very high | 84.6 | Confident | 26 Ų | 26 | 66.7 Ų | 66.7 | 18% | 0.182 | 38% | 0.382 | C | S | . | . | H | α-helix | trans | -66.6 | -36.8 | 175.8 | -63.7 | 0 | 0 | 0 | 0 | 114.3 | T8 M13 S14 D61 | T8-S10 PolarHBondContact O-N 2.67Å; S10-M13 PolarHBondContact O-N 2.75Å; S10-S14 WeakPolarHBondContact O-CB 3.44Å; S10-S14 PolarHBondContact O-N 2.99Å; S10-S14 PolarHBondContact O-OG 3.05Å; S10-D61 WeakPolarHBondContact CB-OD2 3.48Å; S10-D61 PolarHBondContact N-OD1 3.37Å; S10-D61 PolarHBondContact OG-OD2 2.85Å |
| 11 | Q | 94.7 | Very high | 84.6 | Confident | 98 Ų | 98 | 71.2 Ų | 71.2 | 46% | 0.458 | 41% | 0.406 | S | S | . | . | H | α-helix | trans | -66.4 | -47.4 | 175 | -71.5 | 171.9 | -25.6 | 0 | 0 | 110.4 | R7 T8 M13 S14 E15 | R7-Q11 HydrophobicContact CB-CB 4.34Å; T8-Q11 WeakPolarHBondContact O-CB 3.38Å; T8-Q11 PolarHBondContact O-N 2.66Å; T8-Q11 WeakPolarHBondContact OG1-CG 3.38Å; T8-Q11 PolarHBondContact OG1-N 2.74Å; Q11-M13 VanDerWaalsContact C-N 3.3Å; Q11-M13 PolarHBondContact O-N 3.16Å; Q11-S14 WeakPolarHBondContact O-CB 3.2Å; Q11-S14 PolarHBondContact O-N 3.36Å; Q11-S14 VanDerWaalsContact O-N 3.11Å; Q11-E15 PolarHBondContact O-N 3.12Å |
| 12 | L | 94.1 | Very high | 86.3 | Confident | 9 Ų | 9 | 66 Ų | 66 | 5% | 0.047 | 40% | 0.4 | C | S | . | . | H | α-helix | trans | -56 | -46.3 | 174.8 | 175.3 | 67.7 | 0 | 0 | 0 | 111.2 | L4 T8 P9 S14 E15 M16 F33 Q36 I37 | L4-L12 HydrophobicContact CD2-CB 3.89Å; L4-L12 HydrophobicContact CD2-CD2 3.72Å; L4-L12 HydrophobicContact CD2-CG 4.41Å; L4-L12 HydrophobicContact CG-CD2 4.32Å; T8-L12 PolarHBondContact O-N 3.04Å; P9-L12 PolarHBondContact O-N 2.57Å; L12-S14 VanDerWaalsContact C-N 3.29Å; L12-S14 PolarHBondContact O-N 3.08Å; L12-E15 PolarHBondContact O-N 2.6Å; L12-M16 HydrophobicContact CD1-CG 4.26Å; L12-M16 HydrophobicContact CD1-SD 4.29Å; L12-M16 HydrophobicContact CG-CG 4.43Å; L12-M16 HydrophobicContact CG-SD 4.09Å; L12-M16 WeakPolarHBondContact O-CB 3.34Å; L12-M16 VanDerWaalsContact O-CG 3.29Å; L12-M16 WeakPolarHBondContact O-CG 3.39Å; L12-M16 PolarHBondContact O-N 3.03Å; L12-F33 HydrophobicContact CD2-CD2 3.92Å; L12-F33 HydrophobicContact CD2-CE2 4.03Å; L12-F33 HydrophobicContact CG-CD2 4.24Å; L12-F33 HydrophobicContact CG-CE2 4.36Å; L12-Q36 HydrophobicContact CD1-CG 4.47Å; L12-Q36 HydrophobicContact CD2-CB 3.42Å; L12-Q36 VanDerWaalsContact CD2-CB 3.42Å; L12-Q36 HydrophobicContact CD2-CG 3.91Å; L12-I37 HydrophobicContact CD2-CD1 4.34Å |
| 13 | M | 94.1 | Very high | 87.5 | Confident | 2 Ų | 2 | 64.4 Ų | 64.4 | 1% | 0.01 | 39% | 0.387 | C | S | . | . | H | α-helix | trans | -61.5 | -39.8 | 178.4 | -174.6 | 58.4 | 77.5 | 0 | 0 | 112.1 | P9 S10 Q11 M16 L17 F29 F33 P53 A57 | P9-M13 WeakPolarHBondContact O-CB 3.05Å; P9-M13 PolarHBondContact O-N 3.24Å; S10-M13 PolarHBondContact O-N 2.75Å; Q11-M13 VanDerWaalsContact C-N 3.3Å; Q11-M13 PolarHBondContact O-N 3.16Å; M13-M16 PolarHBondContact O-N 2.71Å; M13-L17 HydrophobicContact CG-CD1 4.14Å; M13-L17 HydrophobicContact CG-CG 4.38Å; M13-L17 WeakPolarHBondContact O-CB 3.43Å; M13-L17 VanDerWaalsContact O-CG 3.24Å; M13-L17 WeakPolarHBondContact O-CG 3.34Å; M13-L17 PolarHBondContact O-N 2.8Å; M13-L17 HydrophobicContact SD-CG 4.34Å; M13-F29 HydrophobicContact CE-CE1 4.36Å; M13-F29 HydrophobicContact SD-CE1 3.49Å; M13-F29 WeakPolarHBondContact SD-CE1 3.29Å; M13-F29 HydrophobicContact SD-CZ 3.74Å; M13-F33 HydrophobicContact CB-CD2 4.41Å; M13-F33 HydrophobicContact CB-CE2 3.96Å; M13-F33 HydrophobicContact CE-CB 4.06Å; M13-F33 HydrophobicContact CE-CD1 3.54Å; M13-F33 HydrophobicContact CE-CD2 3.35Å; M13-F33 HydrophobicContact CE-CE1 3.7Å; M13-F33 HydrophobicContact CE-CE2 3.52Å; M13-F33 HydrophobicContact CE-CG 3.35Å; M13-F33 HydrophobicContact CE-CZ 3.68Å; M13-F33 HydrophobicContact SD-CD2 4.2Å; M13-F33 HydrophobicContact SD-CE2 4.5Å; M13-P53 HydrophobicContact CE-CB 3.91Å; M13-P53 WeakPolarHBondContact CE-O 3.26Å; M13-P53 HydrophobicContact CG-CB 4.5Å; M13-P53 HydrophobicContact SD-CB 3.74Å; M13-A57 HydrophobicContact CB-CB 3.39Å; M13-A57 HydrophobicContact CE-CB 4.19Å; M13-A57 HydrophobicContact CG-CB 3.69Å |
| 14 | S | 93.2 | Very high | 88.7 | Confident | 61 Ų | 61 | 69.9 Ų | 69.9 | 43% | 0.427 | 40% | 0.403 | S | S | . | . | H | α-helix | trans | -65.7 | -40.7 | 179.1 | -59.6 | 0 | 0 | 0 | 0 | 111.9 | S10 Q11 L12 L17 A18 | S10-S14 WeakPolarHBondContact O-CB 3.44Å; S10-S14 PolarHBondContact O-N 2.99Å; S10-S14 PolarHBondContact O-OG 3.05Å; Q11-S14 WeakPolarHBondContact O-CB 3.2Å; Q11-S14 PolarHBondContact O-N 3.36Å; Q11-S14 VanDerWaalsContact O-N 3.11Å; L12-S14 VanDerWaalsContact C-N 3.29Å; L12-S14 PolarHBondContact O-N 3.08Å; S14-L17 PolarHBondContact O-N 3.48Å; S14-A18 PolarHBondContact O-N 3.08Å; S14-A18 VanDerWaalsContact O-N 3.08Å |
| 15 | E | 92.4 | Very high | 89.7 | Confident | 90 Ų | 90 | 71.8 Ų | 71.8 | 42% | 0.421 | 42% | 0.415 | S | S | . | . | H | α-helix | trans | -63.9 | -46.4 | 173.6 | -70.7 | 172.3 | -166.5 | 0 | 0 | 111.5 | R7 Q11 L12 L17 A18 L19 | R7-E15 WeakPolarHBondContact CD-OE1 3.15Å; R7-E15 IonicContact CZ-OE2 3.77Å; R7-E15 IonicContact NH1-OE2 2.71Å; R7-E15 PolarHBondContact NH1-OE2 2.73Å; Q11-E15 PolarHBondContact O-N 3.12Å; L12-E15 PolarHBondContact O-N 2.6Å; E15-L17 VanDerWaalsContact C-N 3.33Å; E15-L17 PolarHBondContact O-N 3.3Å; E15-A18 WeakPolarHBondContact O-CB 2.84Å; E15-A18 PolarHBondContact O-N 3.11Å; E15-L19 PolarHBondContact O-N 3Å |
| 16 | M | 92.3 | Very high | 90.1 | Very high | 21 Ų | 21 | 71.6 Ų | 71.6 | 10% | 0.103 | 40% | 0.404 | C | S | . | . | H | α-helix | trans | -60.5 | -43.4 | 177.6 | -71.4 | -176.9 | 62.3 | 0 | 0 | 111.5 | L12 M13 A18 L19 F29 I32 F33 | L12-M16 HydrophobicContact CD1-CG 4.26Å; L12-M16 HydrophobicContact CD1-SD 4.29Å; L12-M16 HydrophobicContact CG-CG 4.43Å; L12-M16 HydrophobicContact CG-SD 4.09Å; L12-M16 WeakPolarHBondContact O-CB 3.34Å; L12-M16 VanDerWaalsContact O-CG 3.29Å; L12-M16 WeakPolarHBondContact O-CG 3.39Å; L12-M16 PolarHBondContact O-N 3.03Å; M13-M16 PolarHBondContact O-N 2.71Å; M16-A18 VanDerWaalsContact C-N 3.3Å; M16-A18 PolarHBondContact O-N 2.71Å; M16-L19 WeakPolarHBondContact O-CB 3.41Å; M16-L19 PolarHBondContact O-N 2.65Å; M16-L19 VanDerWaalsContact O-N 3.14Å; M16-F29 HydrophobicContact CB-CE2 3.52Å; M16-F29 HydrophobicContact CB-CZ 3.55Å; M16-F29 HydrophobicContact CE-CD2 4.01Å; M16-F29 HydrophobicContact CE-CE1 4.45Å; M16-F29 HydrophobicContact CE-CE2 3.88Å; M16-F29 HydrophobicContact CE-CG 4.37Å; M16-F29 HydrophobicContact CE-CZ 4.09Å; M16-F29 WeakPolarHBondContact CE-O 3.45Å; M16-F29 WeakPolarHBondContact O-CE2 3.01Å; M16-I32 HydrophobicContact CE-CB 4.01Å; M16-I32 HydrophobicContact CE-CG2 3.73Å; M16-F33 HydrophobicContact CE-CB 3.82Å; M16-F33 HydrophobicContact SD-CB 3.81Å; M16-F33 HydrophobicContact SD-CD2 3.9Å; M16-F33 HydrophobicContact SD-CG 4.37Å |
| 17 | L | 92.8 | Very high | 90.4 | Very high | 29 Ų | 29 | 71.4 Ų | 71.4 | 15% | 0.152 | 40% | 0.395 | C | S | . | . | H | α-helix | trans | -63.7 | -34.1 | 176.9 | -73.2 | 174.2 | 0 | 0 | 0 | 112.5 | M13 S14 E15 L19 L20 P25 F29 P53 R54 | M13-L17 HydrophobicContact CG-CD1 4.14Å; M13-L17 HydrophobicContact CG-CG 4.38Å; M13-L17 WeakPolarHBondContact O-CB 3.43Å; M13-L17 VanDerWaalsContact O-CG 3.24Å; M13-L17 WeakPolarHBondContact O-CG 3.34Å; M13-L17 PolarHBondContact O-N 2.8Å; M13-L17 HydrophobicContact SD-CG 4.34Å; S14-L17 PolarHBondContact O-N 3.48Å; E15-L17 VanDerWaalsContact C-N 3.33Å; E15-L17 PolarHBondContact O-N 3.3Å; L17-L19 PolarHBondContact O-N 2.72Å; L17-L20 HydrophobicContact CD2-CD1 3.68Å; L17-L20 PolarHBondContact O-N 2.6Å; L17-P25 HydrophobicContact CD2-CG 4.03Å; L17-F29 HydrophobicContact CD2-CE1 4.08Å; L17-F29 HydrophobicContact CD2-CE2 4.47Å; L17-F29 HydrophobicContact CD2-CZ 3.68Å; L17-F29 HydrophobicContact CG-CZ 3.97Å; L17-P53 HydrophobicContact CD2-CG 4.01Å; L17-R54 HydrophobicContact CD1-CG 3.75Å |
| 18 | A | 92 | Very high | 90.5 | Very high | 82 Ų | 82 | 72.7 Ų | 72.7 | 68% | 0.678 | 41% | 0.408 | S | S | * | . | H | α-helix | trans | -65.7 | -24.9 | 175.9 | 0 | 0 | 0 | 0 | 0 | 112.8 | S14 E15 M16 | S14-A18 PolarHBondContact O-N 3.08Å; S14-A18 VanDerWaalsContact O-N 3.08Å; E15-A18 WeakPolarHBondContact O-CB 2.84Å; E15-A18 PolarHBondContact O-N 3.11Å; M16-A18 VanDerWaalsContact C-N 3.3Å; M16-A18 PolarHBondContact O-N 2.71Å |
| 19 | L | 90.7 | Very high | 90.4 | Very high | 147 Ų | 147 | 71.5 Ų | 71.5 | 77% | 0.77 | 40% | 0.4 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -81.6 | -13.3 | 177.5 | -63.7 | 174 | 0 | 0 | 0 | 113.8 | E15 M16 L17 D21 | E15-L19 PolarHBondContact O-N 3Å; M16-L19 WeakPolarHBondContact O-CB 3.41Å; M16-L19 PolarHBondContact O-N 2.65Å; M16-L19 VanDerWaalsContact O-N 3.14Å; L17-L19 PolarHBondContact O-N 2.72Å; L19-D21 VanDerWaalsContact C-N 3.27Å; L19-D21 PolarHBondContact O-N 2.75Å |
| 20 | L | 89 | Confident | 90.1 | Very high | 31 Ų | 31 | 75 Ų | 75 | 16% | 0.162 | 41% | 0.413 | C | S | . | . | T | Hydrogen-bonded Turn | trans | -73 | -17.5 | -176.8 | -79.4 | 168.9 | 0 | 0 | 0 | 113.5 | L17 G22 H23 P25 F29 | L17-L20 HydrophobicContact CD2-CD1 3.68Å; L17-L20 PolarHBondContact O-N 2.6Å; L20-G22 PolarHBondContact O-N 3.49Å; L20-G22 VanDerWaalsContact O-N 3.1Å; L20-H23 HydrophobicContact CB-CB 4.37Å; L20-H23 WeakPolarHBondContact CB-O 3.4Å; L20-H23 WeakPolarHBondContact CD1-O 3.27Å; L20-H23 HydrophobicContact CD2-CB 4.11Å; L20-H23 WeakPolarHBondContact O-CB 3.31Å; L20-H23 PolarHBondContact O-N 3.17Å; L20-P25 HydrophobicContact CD1-CB 4.39Å; L20-P25 HydrophobicContact CD1-CG 4.2Å; L20-F29 HydrophobicContact CD1-CD2 3.76Å; L20-F29 HydrophobicContact CD1-CE2 3.49Å; L20-F29 VanDerWaalsContact CD1-CE2 3.49Å; L20-F29 HydrophobicContact CD1-CG 4.37Å; L20-F29 HydrophobicContact CD1-CZ 3.94Å; L20-F29 HydrophobicContact CD2-CD2 3.75Å; L20-F29 HydrophobicContact CD2-CE2 4.17Å; L20-F29 HydrophobicContact CD2-CG 4.49Å; L20-F29 HydrophobicContact CG-CD2 3.86Å; L20-F29 HydrophobicContact CG-CE2 3.73Å |
| 21 | D | 84.3 | Confident | 89.9 | Confident | 162 Ų | 162 | 77.3 Ų | 77.3 | 87% | 0.866 | 42% | 0.421 | S | S | * | . | T | Hydrogen-bonded Turn | trans | 45.5 | 43.6 | 177.9 | -162.7 | 35 | 0 | 0 | 0 | 114 | L19 | L19-D21 VanDerWaalsContact C-N 3.27Å; L19-D21 PolarHBondContact O-N 2.75Å |
| 22 | G | 83.8 | Confident | 89.8 | Confident | 78 Ų | 78 | 75.3 Ų | 75.3 | 80% | 0.804 | 41% | 0.413 | S | S | * | . | T | Hydrogen-bonded Turn | trans | 87.7 | -1.6 | -178.9 | 0 | 0 | 0 | 0 | 0 | 115.6 | L20 | L20-G22 PolarHBondContact O-N 3.49Å; L20-G22 VanDerWaalsContact O-N 3.1Å |
| 23 | H | 87.5 | Confident | 89.7 | Confident | 116 Ų | 116 | 74.9 Ų | 74.9 | 54% | 0.537 | 41% | 0.41 | S | S | . | . | trans | -73.8 | 134.5 | 169.6 | -171.6 | -80.2 | 0 | 0 | 0 | 110.9 | L20 | L20-H23 HydrophobicContact CB-CB 4.37Å; L20-H23 WeakPolarHBondContact CB-O 3.4Å; L20-H23 WeakPolarHBondContact CD1-O 3.27Å; L20-H23 HydrophobicContact CD2-CB 4.11Å; L20-H23 WeakPolarHBondContact O-CB 3.31Å; L20-H23 PolarHBondContact O-N 3.17Å | ||
| 24 | E | 87.4 | Confident | 89.5 | Confident | 154 Ų | 154 | 75.8 Ų | 75.8 | 72% | 0.72 | 42% | 0.415 | S | S | * | . | trans | -69.5 | 146.9 | 177.9 | -76.1 | -69.4 | 110.7 | 0 | 0 | 111.7 | C26 | E24-C26 PolarHBondContact O-N 2.65Š| ||
| 25 | P | 86.5 | Confident | 89.5 | Confident | 45 Ų | 45 | 78.1 Ų | 78.1 | 29% | 0.292 | 42% | 0.419 | S | S | . | . | trans | -60.6 | 108.1 | 179.8 | -14.3 | 24.7 | 0 | 0 | 0 | 111.4 | L17 L20 F29 P53 | L17-P25 HydrophobicContact CD2-CG 4.03Å; L20-P25 HydrophobicContact CD1-CB 4.39Å; L20-P25 HydrophobicContact CD1-CG 4.2Å; P25-F29 HydrophobicContact CB-CD1 3.72Å; P25-F29 HydrophobicContact CB-CE1 4.07Å; P25-F29 HydrophobicContact CB-CG 4.27Å; P25-P53 HydrophobicContact CB-CB 4.46Å; P25-P53 HydrophobicContact CB-CG 4.01Å; P25-P53 HydrophobicContact CG-CG 3.63Å | ||
| 26 | C | 87.1 | Confident | 89.4 | Confident | 56 Ų | 56 | 75 Ų | 75 | 38% | 0.378 | 40% | 0.404 | S | S | . | . | trans | -89.7 | 176 | -179.4 | 67.3 | 0 | 0 | 0 | 0 | 112.6 | E24 L28 F29 R30 | E24-C26 PolarHBondContact O-N 2.65Å; C26-L28 VanDerWaalsContact C-N 3.26Å; C26-L28 PolarHBondContact O-N 3.42Å; C26-F29 VanDerWaalsContact O-CB 3.31Å; C26-F29 WeakPolarHBondContact O-CB 3.27Å; C26-F29 PolarHBondContact O-N 3.35Å; C26-F29 VanDerWaalsContact O-N 3.1Å; C26-R30 PolarHBondContact O-N 3.16Å; C26-R30 VanDerWaalsContact O-N 3.11Å | ||
| 27 | F | 87.6 | Confident | 89.4 | Confident | 169 Ų | 169 | 74.2 Ų | 74.2 | 74% | 0.741 | 40% | 0.401 | S | S | * | . | H | α-helix | trans | -55.8 | -42 | 176.8 | 178.9 | -93.6 | 0 | 0 | 0 | 112.4 | F29 R30 Q31 | F27-F29 VanDerWaalsContact C-N 3.33Å; F27-F29 PolarHBondContact O-N 2.74Å; F27-R30 PolarHBondContact O-N 3Å; F27-Q31 PolarHBondContact O-N 2.78Å |
| 28 | L | 89.2 | Confident | 89.3 | Confident | 111 Ų | 111 | 74.5 Ų | 74.5 | 58% | 0.581 | 41% | 0.405 | S | S | * | . | H | α-helix | trans | -62.5 | -41.3 | 177.4 | 178.5 | 61.7 | 0 | 0 | 0 | 111.5 | C26 R30 Q31 I32 | C26-L28 VanDerWaalsContact C-N 3.26Å; C26-L28 PolarHBondContact O-N 3.42Å; L28-R30 VanDerWaalsContact C-N 3.34Å; L28-R30 PolarHBondContact O-N 2.94Å; L28-Q31 PolarHBondContact O-N 3.26Å; L28-Q31 VanDerWaalsContact O-N 3.16Å; L28-I32 HydrophobicContact CD1-CD1 4.08Å; L28-I32 HydrophobicContact CD1-CG1 4.12Å; L28-I32 HydrophobicContact CD2-CD1 4.48Å; L28-I32 HydrophobicContact CG-CD1 3.84Å; L28-I32 HydrophobicContact CG-CG1 4.34Å; L28-I32 VanDerWaalsContact O-CG1 3.31Å; L28-I32 WeakPolarHBondContact O-CG1 3.43Å; L28-I32 PolarHBondContact O-N 3.41Å |
| 29 | F | 90.2 | Very high | 89.2 | Confident | 15 Ų | 15 | 74.7 Ų | 74.7 | 7% | 0.066 | 40% | 0.397 | C | S | . | . | H | α-helix | trans | -57.6 | -47.6 | 175.7 | 177.6 | -88.4 | 0 | 0 | 0 | 111.5 | M13 M16 L17 L20 P25 C26 F27 Q31 I32 F33 P53 | M13-F29 HydrophobicContact CE-CE1 4.36Å; M13-F29 HydrophobicContact SD-CE1 3.49Å; M13-F29 WeakPolarHBondContact SD-CE1 3.29Å; M13-F29 HydrophobicContact SD-CZ 3.74Å; M16-F29 HydrophobicContact CB-CE2 3.52Å; M16-F29 HydrophobicContact CB-CZ 3.55Å; M16-F29 HydrophobicContact CE-CD2 4.01Å; M16-F29 HydrophobicContact CE-CE1 4.45Å; M16-F29 HydrophobicContact CE-CE2 3.88Å; M16-F29 HydrophobicContact CE-CG 4.37Å; M16-F29 HydrophobicContact CE-CZ 4.09Å; M16-F29 WeakPolarHBondContact CE-O 3.45Å; M16-F29 WeakPolarHBondContact O-CE2 3.01Å; L17-F29 HydrophobicContact CD2-CE1 4.08Å; L17-F29 HydrophobicContact CD2-CE2 4.47Å; L17-F29 HydrophobicContact CD2-CZ 3.68Å; L17-F29 HydrophobicContact CG-CZ 3.97Å; L20-F29 HydrophobicContact CD1-CD2 3.76Å; L20-F29 HydrophobicContact CD1-CE2 3.49Å; L20-F29 VanDerWaalsContact CD1-CE2 3.49Å; L20-F29 HydrophobicContact CD1-CG 4.37Å; L20-F29 HydrophobicContact CD1-CZ 3.94Å; L20-F29 HydrophobicContact CD2-CD2 3.75Å; L20-F29 HydrophobicContact CD2-CE2 4.17Å; L20-F29 HydrophobicContact CD2-CG 4.49Å; L20-F29 HydrophobicContact CG-CD2 3.86Å; L20-F29 HydrophobicContact CG-CE2 3.73Å; P25-F29 HydrophobicContact CB-CD1 3.72Å; P25-F29 HydrophobicContact CB-CE1 4.07Å; P25-F29 HydrophobicContact CB-CG 4.27Å; C26-F29 VanDerWaalsContact O-CB 3.31Å; C26-F29 WeakPolarHBondContact O-CB 3.27Å; C26-F29 PolarHBondContact O-N 3.35Å; C26-F29 VanDerWaalsContact O-N 3.1Å; F27-F29 VanDerWaalsContact C-N 3.33Å; F27-F29 PolarHBondContact O-N 2.74Å; F29-Q31 VanDerWaalsContact C-N 3.32Å; F29-Q31 PolarHBondContact O-N 3.43Å; F29-I32 PolarHBondContact O-N 3.45Å; F29-F33 PolarHBondContact O-N 2.95Å; F29-P53 HydrophobicContact CE1-CB 4.16Å |
| 30 | R | 89.1 | Confident | 89.1 | Confident | 74 Ų | 74 | 71 Ų | 71 | 28% | 0.279 | 38% | 0.378 | S | S | . | . | H | α-helix | trans | -61.4 | -41.9 | 175.5 | -177.1 | 176.9 | 179.9 | 175.9 | 2.5 | 111.5 | C26 F27 L28 F33 L34 I48 L56 | C26-R30 PolarHBondContact O-N 3.16Å; C26-R30 VanDerWaalsContact O-N 3.11Å; F27-R30 PolarHBondContact O-N 3Å; L28-R30 VanDerWaalsContact C-N 3.34Å; L28-R30 PolarHBondContact O-N 2.94Å; R30-F33 WeakPolarHBondContact O-CB 3.21Å; R30-F33 PolarHBondContact O-N 3.48Å; R30-L34 HydrophobicContact CG-CD1 4.16Å; R30-L34 HydrophobicContact CG-CG 4.44Å; R30-L34 VanDerWaalsContact O-CG 3.31Å; R30-L34 WeakPolarHBondContact O-CG 3.49Å; R30-L34 PolarHBondContact O-N 3.17Å; R30-I48 PolarHBondContact NH2-O 3.43Å; R30-L56 HydrophobicContact CG-CD2 4.12Å |
| 31 | Q | 90.6 | Very high | 89.2 | Confident | 74 Ų | 74 | 69.7 Ų | 69.7 | 35% | 0.346 | 37% | 0.371 | S | S | . | . | H | α-helix | trans | -64.2 | -46 | 179.7 | -178.5 | 66.1 | -6 | 0 | 0 | 111.8 | F27 L28 F29 F33 L34 E35 | F27-Q31 PolarHBondContact O-N 2.78Å; L28-Q31 PolarHBondContact O-N 3.26Å; L28-Q31 VanDerWaalsContact O-N 3.16Å; F29-Q31 VanDerWaalsContact C-N 3.32Å; F29-Q31 PolarHBondContact O-N 3.43Å; Q31-F33 VanDerWaalsContact C-N 3.26Å; Q31-F33 PolarHBondContact O-N 3.12Å; Q31-L34 PolarHBondContact O-N 3.27Å; Q31-L34 VanDerWaalsContact O-N 3.16Å; Q31-E35 PolarHBondContact NE2-OE1 3Å; Q31-E35 WeakPolarHBondContact O-CG 3.49Å; Q31-E35 PolarHBondContact O-N 3.32Å |
| 32 | I | 91.8 | Very high | 89.5 | Confident | 56 Ų | 56 | 65.9 Ų | 65.9 | 29% | 0.287 | 35% | 0.345 | S | S | . | . | H | α-helix | trans | -58 | -43.2 | 175.9 | -68.3 | 166.7 | 0 | 0 | 0 | 110.1 | M1 M16 L28 F29 E35 Q36 | M1-I32 HydrophobicContact SD-CG2 4.44Å; M16-I32 HydrophobicContact CE-CB 4.01Å; M16-I32 HydrophobicContact CE-CG2 3.73Å; L28-I32 HydrophobicContact CD1-CD1 4.08Å; L28-I32 HydrophobicContact CD1-CG1 4.12Å; L28-I32 HydrophobicContact CD2-CD1 4.48Å; L28-I32 HydrophobicContact CG-CD1 3.84Å; L28-I32 HydrophobicContact CG-CG1 4.34Å; L28-I32 VanDerWaalsContact O-CG1 3.31Å; L28-I32 WeakPolarHBondContact O-CG1 3.43Å; L28-I32 PolarHBondContact O-N 3.41Å; F29-I32 PolarHBondContact O-N 3.45Å; I32-E35 PolarHBondContact O-N 2.99Å; I32-Q36 WeakPolarHBondContact O-CG 3.41Å; I32-Q36 PolarHBondContact O-N 2.91Å |
| 33 | F | 91.8 | Very high | 89.8 | Confident | 0 Ų | 0 | 67.7 Ų | 67.7 | 0% | 0 | 34% | 0.335 | C | S | . | . | H | α-helix | trans | -58.8 | -51.7 | 176.2 | 173.7 | -103.4 | 0 | 0 | 0 | 110.9 | P9 L12 M13 M16 F29 R30 Q31 E35 Q36 I37 L56 A57 A60 | P9-F33 HydrophobicContact CB-CE2 4.47Å; P9-F33 HydrophobicContact CB-CZ 4.07Å; P9-F33 WeakPolarHBondContact O-CE2 3.36Å; L12-F33 HydrophobicContact CD2-CD2 3.92Å; L12-F33 HydrophobicContact CD2-CE2 4.03Å; L12-F33 HydrophobicContact CG-CD2 4.24Å; L12-F33 HydrophobicContact CG-CE2 4.36Å; M13-F33 HydrophobicContact CB-CD2 4.41Å; M13-F33 HydrophobicContact CB-CE2 3.96Å; M13-F33 HydrophobicContact CE-CB 4.06Å; M13-F33 HydrophobicContact CE-CD1 3.54Å; M13-F33 HydrophobicContact CE-CD2 3.35Å; M13-F33 HydrophobicContact CE-CE1 3.7Å; M13-F33 HydrophobicContact CE-CE2 3.52Å; M13-F33 HydrophobicContact CE-CG 3.35Å; M13-F33 HydrophobicContact CE-CZ 3.68Å; M13-F33 HydrophobicContact SD-CD2 4.2Å; M13-F33 HydrophobicContact SD-CE2 4.5Å; M16-F33 HydrophobicContact CE-CB 3.82Å; M16-F33 HydrophobicContact SD-CB 3.81Å; M16-F33 HydrophobicContact SD-CD2 3.9Å; M16-F33 HydrophobicContact SD-CG 4.37Å; F29-F33 PolarHBondContact O-N 2.95Å; R30-F33 WeakPolarHBondContact O-CB 3.21Å; R30-F33 PolarHBondContact O-N 3.48Å; Q31-F33 VanDerWaalsContact C-N 3.26Å; Q31-F33 PolarHBondContact O-N 3.12Å; F33-E35 PolarHBondContact O-N 2.99Å; F33-Q36 WeakPolarHBondContact O-CB 3.41Å; F33-Q36 PolarHBondContact O-N 3.27Å; F33-I37 HydrophobicContact CD1-CG1 4.35Å; F33-I37 HydrophobicContact CE1-CD1 4.19Å; F33-I37 HydrophobicContact CE1-CG1 4.01Å; F33-I37 HydrophobicContact CE2-CD1 4Å; F33-I37 HydrophobicContact CZ-CD1 3.79Å; F33-I37 HydrophobicContact CZ-CG1 4.15Å; F33-I37 WeakPolarHBondContact O-CG1 3.42Å; F33-I37 PolarHBondContact O-N 2.88Å; F33-L56 HydrophobicContact CD1-CD2 3.98Å; F33-L56 HydrophobicContact CE1-CD2 4.03Å; F33-L56 HydrophobicContact CE1-CG 4.12Å; F33-A57 HydrophobicContact CE2-CB 4.43Å; F33-A57 HydrophobicContact CZ-CB 4.02Å; F33-A60 HydrophobicContact CZ-CB 4.47Å |
| 34 | L | 91.1 | Very high | 89.9 | Confident | 21 Ų | 21 | 67.2 Ų | 67.2 | 11% | 0.11 | 34% | 0.336 | C | S | . | . | H | α-helix | trans | -63.2 | -28 | 179.6 | -68.1 | 176.8 | 0 | 0 | 0 | 113.1 | R30 Q31 Q36 I37 R42 L45 | R30-L34 HydrophobicContact CG-CD1 4.16Å; R30-L34 HydrophobicContact CG-CG 4.44Å; R30-L34 VanDerWaalsContact O-CG 3.31Å; R30-L34 WeakPolarHBondContact O-CG 3.49Å; R30-L34 PolarHBondContact O-N 3.17Å; Q31-L34 PolarHBondContact O-N 3.27Å; Q31-L34 VanDerWaalsContact O-N 3.16Å; L34-Q36 VanDerWaalsContact C-N 3.29Å; L34-Q36 PolarHBondContact O-N 2.96Å; L34-I37 PolarHBondContact O-N 3.42Å; L34-R42 HydrophobicContact CB-CG 4.4Å; L34-R42 HydrophobicContact CD2-CG 4.31Å; L34-R42 VanDerWaalsContact O-CD 3.31Å; L34-R42 WeakPolarHBondContact O-CD 3.01Å; L34-R42 PolarHBondContact O-NH1 3.37Å; L34-L45 HydrophobicContact CD2-CD1 4.03Å |
| 35 | E | 92 | Very high | 89.9 | Confident | 109 Ų | 109 | 60 Ų | 60 | 51% | 0.509 | 30% | 0.302 | S | S | . | . | H | α-helix | trans | -68.3 | -27.5 | 174.1 | -77 | 176 | -172.6 | 0 | 0 | 113.1 | Q31 I32 F33 | Q31-E35 PolarHBondContact NE2-OE1 3Å; Q31-E35 WeakPolarHBondContact O-CG 3.49Å; Q31-E35 PolarHBondContact O-N 3.32Å; I32-E35 PolarHBondContact O-N 2.99Å; F33-E35 PolarHBondContact O-N 2.99Å |
| 36 | Q | 91.6 | Very high | 89.4 | Confident | 24 Ų | 24 | 62.8 Ų | 62.8 | 11% | 0.112 | 32% | 0.319 | C | S | . | . | H | α-helix | trans | -80.9 | -18.4 | 174.7 | -56.8 | -47.1 | -55.1 | 0 | 0 | 113.3 | D2 L12 I32 F33 L34 | D2-Q36 PolarHBondContact O-OE1 3.35Å; L12-Q36 HydrophobicContact CD1-CG 4.47Å; L12-Q36 HydrophobicContact CD2-CB 3.42Å; L12-Q36 VanDerWaalsContact CD2-CB 3.42Å; L12-Q36 HydrophobicContact CD2-CG 3.91Å; I32-Q36 WeakPolarHBondContact O-CG 3.41Å; I32-Q36 PolarHBondContact O-N 2.91Å; F33-Q36 WeakPolarHBondContact O-CB 3.41Å; F33-Q36 PolarHBondContact O-N 3.27Å; L34-Q36 VanDerWaalsContact C-N 3.29Å; L34-Q36 PolarHBondContact O-N 2.96Å |
| 37 | I | 90.9 | Very high | 88.6 | Confident | 5 Ų | 5 | 67.4 Ų | 67.4 | 3% | 0.026 | 34% | 0.34 | C | S | . | . | S | Bend | trans | -83.4 | 140.4 | 179 | -52.6 | -51.1 | 0 | 0 | 0 | 110.1 | L4 P9 L12 F33 L34 I41 L45 | L4-I37 HydrophobicContact CD1-CD1 3.75Å; L4-I37 HydrophobicContact CD2-CD1 4.25Å; L4-I37 HydrophobicContact CG-CD1 4.28Å; P9-I37 HydrophobicContact CB-CD1 3.99Å; P9-I37 HydrophobicContact CG-CD1 4.07Å; L12-I37 HydrophobicContact CD2-CD1 4.34Å; F33-I37 HydrophobicContact CD1-CG1 4.35Å; F33-I37 HydrophobicContact CE1-CD1 4.19Å; F33-I37 HydrophobicContact CE1-CG1 4.01Å; F33-I37 HydrophobicContact CE2-CD1 4Å; F33-I37 HydrophobicContact CZ-CD1 3.79Å; F33-I37 HydrophobicContact CZ-CG1 4.15Å; F33-I37 WeakPolarHBondContact O-CG1 3.42Å; F33-I37 PolarHBondContact O-N 2.88Å; L34-I37 PolarHBondContact O-N 3.42Å; I37-I41 HydrophobicContact CG2-CB 3.78Å; I37-I41 HydrophobicContact CG2-CG2 3.62Å; I37-L45 HydrophobicContact CG2-CD1 4.46Å |
| 38 | P | 90.3 | Very high | 87.7 | Confident | 36 Ų | 36 | 61.3 Ų | 61.3 | 23% | 0.234 | 32% | 0.315 | C | S | . | . | trans | -56.3 | 146.5 | 172.9 | -27.5 | 35.3 | 0 | 0 | 0 | 112.6 | D40 I41 R42 W64 | P38-D40 VanDerWaalsContact C-N 3.28Å; P38-D40 WeakPolarHBondContact CB-OD1 3.31Å; P38-D40 PolarHBondContact O-N 3.38Å; P38-I41 HydrophobicContact CG-CD1 4.34Å; P38-I41 PolarHBondContact O-N 3.25Å; P38-I41 VanDerWaalsContact O-N 3.17Å; P38-R42 WeakPolarHBondContact O-CB 3.48Å; P38-R42 PolarHBondContact O-N 2.99Å; P38-W64 VanDerWaalsContact CD-CZ3 3.5Å; P38-W64 HydrophobicContact CG-CE3 4.11Å; P38-W64 HydrophobicContact CG-CH2 4.2Å; P38-W64 HydrophobicContact CG-CZ3 3.33Å | ||
| 39 | V | 90.6 | Very high | 86.7 | Confident | 86 Ų | 86 | 61.1 Ų | 61.1 | 52% | 0.521 | 32% | 0.322 | S | S | . | . | H | α-helix | trans | -58.2 | -39.6 | -174.5 | 64.7 | 0 | 0 | 0 | 0 | 112.9 | R42 L43 | V39-R42 PolarHBondContact O-N 2.82Å; V39-L43 HydrophobicContact CG2-CD1 4.45Å; V39-L43 VanDerWaalsContact O-CG 3.27Å; V39-L43 WeakPolarHBondContact O-CG 3.31Å; V39-L43 PolarHBondContact O-N 3.47Å |
| 40 | D | 89.4 | Confident | 85.5 | Confident | 68 Ų | 68 | 62.2 Ų | 62.2 | 36% | 0.364 | 33% | 0.329 | S | S | . | . | H | α-helix | trans | -63.3 | -41.3 | 179.6 | 52.4 | -46.7 | 0 | 0 | 0 | 112.2 | P38 K67 | P38-D40 VanDerWaalsContact C-N 3.28Å; P38-D40 WeakPolarHBondContact CB-OD1 3.31Å; P38-D40 PolarHBondContact O-N 3.38Å; D40-K67 WeakPolarHBondContact OD2-CD 3.47Å; D40-K67 WeakPolarHBondContact OD2-CE 3.46Å |
| 41 | I | 90.8 | Very high | 84.9 | Confident | 4 Ų | 4 | 68.5 Ų | 68.5 | 2% | 0.021 | 36% | 0.358 | C | S | . | . | H | α-helix | trans | -74.5 | -40.8 | 175.2 | -65.1 | 169.3 | 0 | 0 | 0 | 110.3 | I37 P38 L43 L44 L45 L63 W64 K67 | I37-I41 HydrophobicContact CG2-CB 3.78Å; I37-I41 HydrophobicContact CG2-CG2 3.62Å; P38-I41 HydrophobicContact CG-CD1 4.34Å; P38-I41 PolarHBondContact O-N 3.25Å; P38-I41 VanDerWaalsContact O-N 3.17Å; I41-L43 VanDerWaalsContact C-N 3.28Å; I41-L43 PolarHBondContact O-N 3.41Å; I41-L44 WeakPolarHBondContact O-CB 3.41Å; I41-L44 PolarHBondContact O-N 2.92Å; I41-L45 HydrophobicContact CG2-CD1 4.24Å; I41-L45 PolarHBondContact O-N 3.49Å; I41-L63 HydrophobicContact CG2-CB 3.91Å; I41-L63 HydrophobicContact CG2-CD1 4.08Å; I41-W64 HydrophobicContact CD1-CB 3.97Å; I41-W64 HydrophobicContact CD1-CD2 4.07Å; I41-W64 HydrophobicContact CD1-CE3 3.34Å; I41-W64 HydrophobicContact CD1-CG 4.38Å; I41-W64 HydrophobicContact CD1-CZ3 4.16Å; I41-K67 HydrophobicContact CD1-CD 3.97Å; I41-K67 HydrophobicContact CG1-CD 4.26Å |
| 42 | R | 91 | Very high | 84.8 | Confident | 83 Ų | 83 | 67.7 Ų | 67.7 | 31% | 0.313 | 36% | 0.356 | S | S | . | . | H | α-helix | trans | -59.1 | -38.5 | 179.7 | 179 | 168.4 | 64.4 | -161.6 | 6.3 | 112.7 | L34 P38 V39 L44 L45 | L34-R42 HydrophobicContact CB-CG 4.4Å; L34-R42 HydrophobicContact CD2-CG 4.31Å; L34-R42 VanDerWaalsContact O-CD 3.31Å; L34-R42 WeakPolarHBondContact O-CD 3.01Å; L34-R42 PolarHBondContact O-NH1 3.37Å; P38-R42 WeakPolarHBondContact O-CB 3.48Å; P38-R42 PolarHBondContact O-N 2.99Å; V39-R42 PolarHBondContact O-N 2.82Å; R42-L44 PolarHBondContact O-N 3.05Å; R42-L45 PolarHBondContact O-N 3.35Å |
| 43 | L | 89.4 | Confident | 84.6 | Confident | 116 Ų | 116 | 66 Ų | 66 | 61% | 0.607 | 35% | 0.349 | S | S | * | . | H | α-helix | trans | -61.5 | -28.1 | 176.1 | -73.7 | 169.8 | 0 | 0 | 0 | 112.9 | V39 I41 T46 | V39-L43 HydrophobicContact CG2-CD1 4.45Å; V39-L43 VanDerWaalsContact O-CG 3.27Å; V39-L43 WeakPolarHBondContact O-CG 3.31Å; V39-L43 PolarHBondContact O-N 3.47Å; I41-L43 VanDerWaalsContact C-N 3.28Å; I41-L43 PolarHBondContact O-N 3.41Å; L43-T46 PolarHBondContact O-OG1 3.22Å |
| 44 | L | 88.4 | Confident | 84.6 | Confident | 105 Ų | 105 | 72.6 Ų | 72.6 | 55% | 0.55 | 37% | 0.374 | S | S | . | . | H | α-helix | trans | -84.8 | -11.8 | 177.4 | -59.1 | 175.6 | 0 | 0 | 0 | 112.7 | I41 R42 L63 | I41-L44 WeakPolarHBondContact O-CB 3.41Å; I41-L44 PolarHBondContact O-N 2.92Å; R42-L44 PolarHBondContact O-N 3.05Å; L44-L63 HydrophobicContact CB-CD1 3.64Å; L44-L63 HydrophobicContact CB-CD2 4.36Å; L44-L63 HydrophobicContact CD1-CD1 4.35Å; L44-L63 HydrophobicContact CD1-CD2 3.86Å |
| 45 | L | 87.5 | Confident | 84.6 | Confident | 2 Ų | 2 | 76.3 Ų | 76.3 | 1% | 0.01 | 39% | 0.391 | C | S | . | . | H | α-helix | trans | -92.6 | -10.2 | 178.7 | -65.6 | 174.3 | 0 | 0 | 0 | 113.6 | L34 I37 I41 R42 D47 I48 L56 H59 A60 L63 | L34-L45 HydrophobicContact CD2-CD1 4.03Å; I37-L45 HydrophobicContact CG2-CD1 4.46Å; I41-L45 HydrophobicContact CG2-CD1 4.24Å; I41-L45 PolarHBondContact O-N 3.49Å; R42-L45 PolarHBondContact O-N 3.35Å; L45-D47 VanDerWaalsContact C-N 3.32Å; L45-D47 PolarHBondContact O-N 3.5Å; L45-I48 PolarHBondContact O-N 3.28Å; L45-L56 HydrophobicContact CB-CD1 4.37Å; L45-L56 HydrophobicContact CD2-CD1 4.14Å; L45-H59 HydrophobicContact CD2-CB 4.49Å; L45-H59 WeakPolarHBondContact CD2-ND1 3.38Å; L45-A60 HydrophobicContact CD1-CB 3.81Å; L45-A60 HydrophobicContact CD2-CB 4.19Å; L45-L63 HydrophobicContact CD2-CD1 3.83Å; L45-L63 HydrophobicContact CG-CD1 4.17Å |
| 46 | T | 76 | Confident | 84.6 | Confident | 105 Ų | 105 | 71.3 Ų | 71.3 | 64% | 0.644 | 37% | 0.367 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -68.9 | -27.7 | -174.2 | 47.4 | 0 | 0 | 0 | 0 | 114 | L43 I48 | L43-T46 PolarHBondContact O-OG1 3.22Å; T46-I48 VanDerWaalsContact C-N 3.26Å; T46-I48 PolarHBondContact O-N 3.42Å |
| 47 | D | 71.3 | Confident | 84.7 | Confident | 152 Ų | 152 | 70.2 Ų | 70.2 | 81% | 0.813 | 36% | 0.362 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -75.1 | -17.8 | -177.6 | -165.3 | 36.6 | 0 | 0 | 0 | 112.7 | L45 S49 | L45-D47 VanDerWaalsContact C-N 3.32Å; L45-D47 PolarHBondContact O-N 3.5Å; D47-S49 PolarHBondContact O-N 3.01Å |
| 48 | I | 68.5 | Low | 84.8 | Confident | 42 Ų | 42 | 75.1 Ų | 75.1 | 22% | 0.215 | 39% | 0.388 | C | S | . | . | trans | -99 | 107 | -168.6 | -29.9 | 179.6 | 0 | 0 | 0 | 110.1 | R30 L45 T46 L50 H59 | R30-I48 PolarHBondContact NH2-O 3.43Å; L45-I48 PolarHBondContact O-N 3.28Å; T46-I48 VanDerWaalsContact C-N 3.26Å; T46-I48 PolarHBondContact O-N 3.42Å; I48-L50 HydrophobicContact CB-CD1 4.26Å; I48-L50 HydrophobicContact CB-CG 4.06Å; I48-L50 HydrophobicContact CG2-CD1 3.76Å; I48-L50 HydrophobicContact CG2-CD2 3.63Å; I48-L50 HydrophobicContact CG2-CG 3.37Å; I48-L50 PolarHBondContact O-N 3.33Å; I48-H59 WeakPolarHBondContact CD1-CE1 3.41Å; I48-H59 VanDerWaalsContact CD1-ND1 3.27Å; I48-H59 WeakPolarHBondContact CD1-ND1 3.39Å | ||
| 49 | S | 67.8 | Low | 84.9 | Confident | 106 Ų | 106 | 76.9 Ų | 76.9 | 74% | 0.741 | 39% | 0.393 | S | S | * | . | trans | -78 | 64.1 | 168.5 | 179.6 | 0 | 0 | 0 | 0 | 110.5 | D47 K51 | D47-S49 PolarHBondContact O-N 3.01Å; S49-K51 PolarHBondContact O-N 3.26Å | ||
| 50 | L | 65.7 | Low | 85 | Confident | 39 Ų | 39 | 72.8 Ų | 72.8 | 20% | 0.204 | 37% | 0.368 | C | S | . | . | trans | -77.6 | 111.5 | 171.9 | -61.6 | 172.6 | 0 | 0 | 0 | 108.5 | I48 Q55 L56 | I48-L50 HydrophobicContact CB-CD1 4.26Å; I48-L50 HydrophobicContact CB-CG 4.06Å; I48-L50 HydrophobicContact CG2-CD1 3.76Å; I48-L50 HydrophobicContact CG2-CD2 3.63Å; I48-L50 HydrophobicContact CG2-CG 3.37Å; I48-L50 PolarHBondContact O-N 3.33Å; L50-Q55 HydrophobicContact CD1-CB 4.08Å; L50-Q55 HydrophobicContact CD2-CB 4.32Å; L50-L56 HydrophobicContact CB-CB 4.3Å; L50-L56 VanDerWaalsContact CD1-CA 3.48Å; L50-L56 HydrophobicContact CD1-CB 4.12Å; L50-L56 HydrophobicContact CD1-CD1 4.34Å | ||
| 51 | K | 77.5 | Confident | 85.2 | Confident | 205 Ų | 205 | 70.6 Ų | 70.6 | 89% | 0.891 | 36% | 0.356 | S | S | * | . | S | Bend | trans | -64.2 | -34.8 | 170.5 | -77.8 | -177.5 | 173.7 | -179.4 | 0 | 111.2 | S49 | S49-K51 PolarHBondContact O-N 3.26Š|
| 52 | D | 86.9 | Confident | 85.3 | Confident | 58 Ų | 58 | 73.1 Ų | 73.1 | 31% | 0.31 | 38% | 0.377 | S | S | . | . | S | Bend | trans | -87.4 | 116.5 | -179.5 | -178.2 | 2.1 | 0 | 0 | 0 | 110.5 | R54 Q55 L56 | D52-R54 PolarHBondContact O-N 3.16Å; D52-R54 WeakPolarHBondContact OD1-CB 3.44Å; D52-R54 PolarHBondContact OD1-N 2.97Å; D52-Q55 HydrophobicContact CB-CB 4.26Å; D52-Q55 HydrophobicContact CB-CG 4.05Å; D52-Q55 PolarHBondContact O-N 2.87Å; D52-Q55 WeakPolarHBondContact OD2-CG 3.45Å; D52-Q55 PolarHBondContact OD2-NE2 3.42Å; D52-L56 PolarHBondContact O-N 2.86Å |
| 53 | P | 88.8 | Confident | 85.4 | Confident | 20 Ų | 20 | 71 Ų | 71 | 13% | 0.13 | 37% | 0.372 | C | S | . | . | H | α-helix | trans | -62.8 | -27.6 | 178.1 | 29.6 | -39.3 | 0 | 0 | 0 | 112.7 | M13 L17 P25 F29 L56 A57 | M13-P53 HydrophobicContact CE-CB 3.91Å; M13-P53 WeakPolarHBondContact CE-O 3.26Å; M13-P53 HydrophobicContact CG-CB 4.5Å; M13-P53 HydrophobicContact SD-CB 3.74Å; L17-P53 HydrophobicContact CD2-CG 4.01Å; P25-P53 HydrophobicContact CB-CB 4.46Å; P25-P53 HydrophobicContact CB-CG 4.01Å; P25-P53 HydrophobicContact CG-CG 3.63Å; F29-P53 HydrophobicContact CE1-CB 4.16Å; P53-L56 WeakPolarHBondContact O-CB 3.29Å; P53-L56 PolarHBondContact O-N 3.27Å; P53-A57 PolarHBondContact O-N 2.88Å |
| 54 | R | 91.1 | Very high | 85.5 | Confident | 138 Ų | 138 | 67.2 Ų | 67.2 | 52% | 0.521 | 35% | 0.349 | S | S | . | . | H | α-helix | trans | -67.6 | -41.1 | 178.7 | -64.8 | -178.3 | -176.6 | -94.6 | 0.6 | 111.1 | L17 D52 L56 A57 I58 | L17-R54 HydrophobicContact CD1-CG 3.75Å; D52-R54 PolarHBondContact O-N 3.16Å; D52-R54 WeakPolarHBondContact OD1-CB 3.44Å; D52-R54 PolarHBondContact OD1-N 2.97Å; R54-L56 VanDerWaalsContact C-N 3.31Å; R54-L56 PolarHBondContact O-N 3.35Å; R54-A57 PolarHBondContact O-N 3.35Å; R54-I58 WeakPolarHBondContact O-CG1 3.41Å; R54-I58 PolarHBondContact O-N 3.42Å |
| 55 | Q | 91.3 | Very high | 85.7 | Confident | 100 Ų | 100 | 67 Ų | 67 | 47% | 0.467 | 35% | 0.346 | S | S | . | . | H | α-helix | trans | -64.1 | -38.8 | 175.1 | -68.9 | 176.2 | 35.6 | 0 | 0 | 111.5 | L50 D52 A57 I58 H59 | L50-Q55 HydrophobicContact CD1-CB 4.08Å; L50-Q55 HydrophobicContact CD2-CB 4.32Å; D52-Q55 HydrophobicContact CB-CB 4.26Å; D52-Q55 HydrophobicContact CB-CG 4.05Å; D52-Q55 PolarHBondContact O-N 2.87Å; D52-Q55 WeakPolarHBondContact OD2-CG 3.45Å; D52-Q55 PolarHBondContact OD2-NE2 3.42Å; Q55-A57 VanDerWaalsContact C-N 3.28Å; Q55-A57 PolarHBondContact O-N 3.32Å; Q55-I58 PolarHBondContact O-N 2.71Å; Q55-H59 PolarHBondContact O-N 2.97Å |
| 56 | L | 91.4 | Very high | 85.8 | Confident | 3 Ų | 3 | 69 Ų | 69 | 2% | 0.016 | 36% | 0.363 | C | S | . | . | H | α-helix | trans | -58.9 | -42.7 | 175 | -179.8 | 68.8 | 0 | 0 | 0 | 111.5 | R30 F33 L45 L50 D52 P53 R54 H59 A60 | R30-L56 HydrophobicContact CG-CD2 4.12Å; F33-L56 HydrophobicContact CD1-CD2 3.98Å; F33-L56 HydrophobicContact CE1-CD2 4.03Å; F33-L56 HydrophobicContact CE1-CG 4.12Å; L45-L56 HydrophobicContact CB-CD1 4.37Å; L45-L56 HydrophobicContact CD2-CD1 4.14Å; L50-L56 HydrophobicContact CB-CB 4.3Å; L50-L56 VanDerWaalsContact CD1-CA 3.48Å; L50-L56 HydrophobicContact CD1-CB 4.12Å; L50-L56 HydrophobicContact CD1-CD1 4.34Å; D52-L56 PolarHBondContact O-N 2.86Å; P53-L56 WeakPolarHBondContact O-CB 3.29Å; P53-L56 PolarHBondContact O-N 3.27Å; R54-L56 VanDerWaalsContact C-N 3.31Å; R54-L56 PolarHBondContact O-N 3.35Å; L56-H59 PolarHBondContact O-N 3.02Å; L56-A60 WeakPolarHBondContact O-CB 3.39Å; L56-A60 PolarHBondContact O-N 3.46Å |
| 57 | A | 93.5 | Very high | 86.3 | Confident | 1 Ų | 1 | 67.4 Ų | 67.4 | 1% | 0.008 | 35% | 0.347 | C | S | . | . | H | α-helix | trans | -70.1 | -40.2 | 180 | 0 | 0 | 0 | 0 | 0 | 112.9 | M13 F33 P53 R54 Q55 H59 A60 D61 | M13-A57 HydrophobicContact CB-CB 3.39Å; M13-A57 HydrophobicContact CE-CB 4.19Å; M13-A57 HydrophobicContact CG-CB 3.69Å; F33-A57 HydrophobicContact CE2-CB 4.43Å; F33-A57 HydrophobicContact CZ-CB 4.02Å; P53-A57 PolarHBondContact O-N 2.88Å; R54-A57 PolarHBondContact O-N 3.35Å; Q55-A57 VanDerWaalsContact C-N 3.28Å; Q55-A57 PolarHBondContact O-N 3.32Å; A57-H59 VanDerWaalsContact C-N 3.29Å; A57-H59 PolarHBondContact O-N 3.07Å; A57-A60 WeakPolarHBondContact O-CB 3.43Å; A57-A60 PolarHBondContact O-N 3.3Å; A57-D61 PolarHBondContact O-N 3.02Å |
| 58 | I | 93.7 | Very high | 86.9 | Confident | 109 Ų | 109 | 65 Ų | 65 | 56% | 0.559 | 33% | 0.331 | S | S | * | . | H | α-helix | trans | -60.9 | -41.2 | 174.5 | -68 | 165 | 0 | 0 | 0 | 110.9 | R54 Q55 D61 A62 | R54-I58 WeakPolarHBondContact O-CG1 3.41Å; R54-I58 PolarHBondContact O-N 3.42Å; Q55-I58 PolarHBondContact O-N 2.71Å; I58-D61 WeakPolarHBondContact O-CB 3.47Å; I58-D61 PolarHBondContact O-N 3.39Å; I58-A62 PolarHBondContact O-N 3.34Å |
| 59 | H | 91.8 | Very high | 87.7 | Confident | 73 Ų | 73 | 68.9 Ų | 68.9 | 34% | 0.338 | 35% | 0.348 | S | S | . | . | H | α-helix | trans | -67.7 | -40.1 | 176.6 | -168.1 | -91.6 | 0 | 0 | 0 | 111.9 | L45 I48 Q55 L56 A57 D61 A62 L63 | L45-H59 HydrophobicContact CD2-CB 4.49Å; L45-H59 WeakPolarHBondContact CD2-ND1 3.38Å; I48-H59 WeakPolarHBondContact CD1-CE1 3.41Å; I48-H59 VanDerWaalsContact CD1-ND1 3.27Å; I48-H59 WeakPolarHBondContact CD1-ND1 3.39Å; Q55-H59 PolarHBondContact O-N 2.97Å; L56-H59 PolarHBondContact O-N 3.02Å; A57-H59 VanDerWaalsContact C-N 3.29Å; A57-H59 PolarHBondContact O-N 3.07Å; H59-D61 VanDerWaalsContact C-N 3.3Å; H59-D61 PolarHBondContact O-N 2.89Å; H59-A62 PolarHBondContact O-N 3.45Å; H59-L63 PolarHBondContact O-N 3.38Å |
| 60 | A | 93.2 | Very high | 88.3 | Confident | 0 Ų | 0 | 69.6 Ų | 69.6 | 0% | 0 | 34% | 0.344 | C | S | . | . | H | α-helix | trans | -61.8 | -37.5 | 173.7 | 0 | 0 | 0 | 0 | 0 | 112.1 | P9 F33 L45 L56 A57 A62 L63 W64 | P9-A60 HydrophobicContact CB-CB 3.59Å; P9-A60 HydrophobicContact CG-CB 3.97Å; F33-A60 HydrophobicContact CZ-CB 4.47Å; L45-A60 HydrophobicContact CD1-CB 3.81Å; L45-A60 HydrophobicContact CD2-CB 4.19Å; L56-A60 WeakPolarHBondContact O-CB 3.39Å; L56-A60 PolarHBondContact O-N 3.46Å; A57-A60 WeakPolarHBondContact O-CB 3.43Å; A57-A60 PolarHBondContact O-N 3.3Å; A60-A62 VanDerWaalsContact C-N 3.35Å; A60-A62 PolarHBondContact O-N 3.19Å; A60-L63 PolarHBondContact O-N 2.88Å; A60-W64 WeakPolarHBondContact O-CB 3.45Å; A60-W64 PolarHBondContact O-N 3.41Å |
| 61 | D | 94.5 | Very high | 88.7 | Confident | 22 Ų | 22 | 72.5 Ų | 72.5 | 12% | 0.118 | 36% | 0.359 | C | S | . | . | H | α-helix | trans | -60.4 | -43 | 173.7 | -85.5 | 5.1 | 0 | 0 | 0 | 111.8 | T8 P9 S10 A57 I58 H59 L63 W64 Q65 | T8-D61 WeakPolarHBondContact CB-OD1 3.43Å; P9-D61 WeakPolarHBondContact CA-OD1 3.45Å; P9-D61 VanDerWaalsContact CB-OD1 3.26Å; P9-D61 WeakPolarHBondContact CB-OD1 3.46Å; P9-D61 WeakPolarHBondContact CD-OD1 3.27Å; P9-D61 WeakPolarHBondContact CG-OD1 3.23Å; S10-D61 WeakPolarHBondContact CB-OD2 3.48Å; S10-D61 PolarHBondContact N-OD1 3.37Å; S10-D61 PolarHBondContact OG-OD2 2.85Å; A57-D61 PolarHBondContact O-N 3.02Å; I58-D61 WeakPolarHBondContact O-CB 3.47Å; I58-D61 PolarHBondContact O-N 3.39Å; H59-D61 VanDerWaalsContact C-N 3.3Å; H59-D61 PolarHBondContact O-N 2.89Å; D61-L63 PolarHBondContact O-N 3.49Å; D61-W64 PolarHBondContact O-N 3.19Å; D61-Q65 WeakPolarHBondContact O-CB 3.5Å; D61-Q65 VanDerWaalsContact O-CG 3.29Å; D61-Q65 WeakPolarHBondContact O-CG 3.49Å; D61-Q65 PolarHBondContact O-N 3.22Å |
| 62 | A | 93.2 | Very high | 88.5 | Confident | 56 Ų | 56 | 66.8 Ų | 66.8 | 46% | 0.463 | 35% | 0.349 | S | S | . | . | H | α-helix | trans | -61.3 | -45.2 | 178.8 | 0 | 0 | 0 | 0 | 0 | 111.5 | I58 H59 A60 Q65 A66 | I58-A62 PolarHBondContact O-N 3.34Å; H59-A62 PolarHBondContact O-N 3.45Å; A60-A62 VanDerWaalsContact C-N 3.35Å; A60-A62 PolarHBondContact O-N 3.19Å; A62-Q65 PolarHBondContact O-N 3.19Å; A62-A66 WeakPolarHBondContact O-CB 3.29Å; A62-A66 PolarHBondContact O-N 3.44Å |
| 63 | L | 92.4 | Very high | 87.6 | Confident | 38 Ų | 38 | 68.6 Ų | 68.6 | 20% | 0.199 | 36% | 0.363 | C | S | . | . | H | α-helix | trans | -64.9 | -40.5 | 175.8 | -65.6 | 174.4 | 0 | 0 | 0 | 112 | I41 L44 L45 H59 A60 D61 A66 K67 | I41-L63 HydrophobicContact CG2-CB 3.91Å; I41-L63 HydrophobicContact CG2-CD1 4.08Å; L44-L63 HydrophobicContact CB-CD1 3.64Å; L44-L63 HydrophobicContact CB-CD2 4.36Å; L44-L63 HydrophobicContact CD1-CD1 4.35Å; L44-L63 HydrophobicContact CD1-CD2 3.86Å; L45-L63 HydrophobicContact CD2-CD1 3.83Å; L45-L63 HydrophobicContact CG-CD1 4.17Å; H59-L63 PolarHBondContact O-N 3.38Å; A60-L63 PolarHBondContact O-N 2.88Å; D61-L63 PolarHBondContact O-N 3.49Å; L63-A66 PolarHBondContact O-N 3.33Å; L63-K67 WeakPolarHBondContact O-CB 3.04Å; L63-K67 PolarHBondContact O-N 3.05Å |
| 64 | W | 91.9 | Very high | 86.1 | Confident | 37 Ų | 37 | 73 Ų | 73 | 14% | 0.14 | 38% | 0.384 | C | S | . | . | H | α-helix | trans | -63.7 | -45.6 | 177.7 | -179.4 | -86.6 | 0 | 0 | 0 | 112 | L4 P9 P38 I41 A60 D61 K67 Q68 | L4-W64 HydrophobicContact CB-CH2 4.24Å; L4-W64 HydrophobicContact CB-CZ3 4.46Å; L4-W64 HydrophobicContact CD1-CE3 3.72Å; L4-W64 HydrophobicContact CD1-CH2 3.89Å; L4-W64 HydrophobicContact CD1-CZ3 3.29Å; P9-W64 HydrophobicContact CG-CB 4.17Å; P9-W64 HydrophobicContact CG-CG 4.37Å; P38-W64 VanDerWaalsContact CD-CZ3 3.5Å; P38-W64 HydrophobicContact CG-CE3 4.11Å; P38-W64 HydrophobicContact CG-CH2 4.2Å; P38-W64 HydrophobicContact CG-CZ3 3.33Å; I41-W64 HydrophobicContact CD1-CB 3.97Å; I41-W64 HydrophobicContact CD1-CD2 4.07Å; I41-W64 HydrophobicContact CD1-CE3 3.34Å; I41-W64 HydrophobicContact CD1-CG 4.38Å; I41-W64 HydrophobicContact CD1-CZ3 4.16Å; A60-W64 WeakPolarHBondContact O-CB 3.45Å; A60-W64 PolarHBondContact O-N 3.41Å; D61-W64 PolarHBondContact O-N 3.19Å; W64-K67 PolarHBondContact O-N 3.47Å; W64-Q68 WeakPolarHBondContact O-CG 3.44Å; W64-Q68 PolarHBondContact O-N 3.45Å |
| 65 | Q | 91.3 | Very high | 84.6 | Confident | 101 Ų | 101 | 72.4 Ų | 72.4 | 47% | 0.472 | 39% | 0.391 | S | S | . | . | H | α-helix | trans | -64.3 | -43.6 | 176.4 | -72.8 | 176.3 | 19.5 | 0 | 0 | 111.7 | D61 A62 K67 Q68 Q69 | D61-Q65 WeakPolarHBondContact O-CB 3.5Å; D61-Q65 VanDerWaalsContact O-CG 3.29Å; D61-Q65 WeakPolarHBondContact O-CG 3.49Å; D61-Q65 PolarHBondContact O-N 3.22Å; A62-Q65 PolarHBondContact O-N 3.19Å; Q65-K67 VanDerWaalsContact C-N 3.31Å; Q65-K67 PolarHBondContact O-N 3.24Å; Q65-Q68 PolarHBondContact O-N 2.97Å; Q65-Q68 VanDerWaalsContact O-N 3.16Å; Q65-Q69 WeakPolarHBondContact O-CG 3.49Å; Q65-Q69 PolarHBondContact O-N 3.16Å |
| 66 | A | 89.4 | Confident | 83.1 | Confident | 45 Ų | 45 | 72.5 Ų | 72.5 | 37% | 0.372 | 40% | 0.4 | S | S | . | . | H | α-helix | trans | -58.1 | -45.1 | 176 | 0 | 0 | 0 | 0 | 0 | 111.4 | A62 L63 Q68 Q69 D70 | A62-A66 WeakPolarHBondContact O-CB 3.29Å; A62-A66 PolarHBondContact O-N 3.44Å; L63-A66 PolarHBondContact O-N 3.33Å; A66-Q68 PolarHBondContact O-N 3.45Å; A66-Q69 PolarHBondContact O-N 3.1Å; A66-D70 PolarHBondContact O-N 3.3Å |
| 67 | K | 86.4 | Confident | 81.5 | Confident | 70 Ų | 70 | 78.4 Ų | 78.4 | 30% | 0.304 | 44% | 0.436 | S | S | . | . | H | α-helix | trans | -60.1 | -43 | 174.7 | 177.9 | -179 | -178.9 | -77.1 | 0 | 112.6 | D40 I41 L63 W64 Q65 Q69 D70 L71 | D40-K67 WeakPolarHBondContact OD2-CD 3.47Å; D40-K67 WeakPolarHBondContact OD2-CE 3.46Å; I41-K67 HydrophobicContact CD1-CD 3.97Å; I41-K67 HydrophobicContact CG1-CD 4.26Å; L63-K67 WeakPolarHBondContact O-CB 3.04Å; L63-K67 PolarHBondContact O-N 3.05Å; W64-K67 PolarHBondContact O-N 3.47Å; Q65-K67 VanDerWaalsContact C-N 3.31Å; Q65-K67 PolarHBondContact O-N 3.24Å; K67-Q69 VanDerWaalsContact C-N 3.33Å; K67-D70 PolarHBondContact O-N 3.11Å; K67-L71 HydrophobicContact CG-CD1 4.45Å; K67-L71 WeakPolarHBondContact O-CG 3.24Å; K67-L71 PolarHBondContact O-N 3.27Å; K67-L71 VanDerWaalsContact O-N 3.12Å |
| 68 | Q | 85.2 | Confident | 79.6 | Confident | 103 Ų | 103 | 87.2 Ų | 87.2 | 48% | 0.481 | 47% | 0.469 | S | S | . | . | H | α-helix | trans | -64.6 | -38.7 | 177.4 | -72.8 | -172.3 | -8.5 | 0 | 0 | 111.9 | W64 Q65 A66 L71 A72 | W64-Q68 WeakPolarHBondContact O-CG 3.44Å; W64-Q68 PolarHBondContact O-N 3.45Å; Q65-Q68 PolarHBondContact O-N 2.97Å; Q65-Q68 VanDerWaalsContact O-N 3.16Å; A66-Q68 PolarHBondContact O-N 3.45Å; Q68-L71 PolarHBondContact O-N 3.46Å; Q68-A72 WeakPolarHBondContact O-CB 3.41Å; Q68-A72 PolarHBondContact O-N 3.02Å |
| 69 | Q | 84 | Confident | 77.9 | Confident | 122 Ų | 122 | 87.9 Ų | 87.9 | 57% | 0.57 | 48% | 0.479 | S | S | * | . | H | α-helix | trans | -65.4 | -40.9 | 176.1 | -71.9 | 175.1 | 2.3 | 0 | 0 | 111.9 | Q65 A66 K67 L71 A72 T73 | Q65-Q69 WeakPolarHBondContact O-CG 3.49Å; Q65-Q69 PolarHBondContact O-N 3.16Å; A66-Q69 PolarHBondContact O-N 3.1Å; K67-Q69 VanDerWaalsContact C-N 3.33Å; Q69-L71 VanDerWaalsContact C-N 3.32Å; Q69-L71 PolarHBondContact O-N 2.92Å; Q69-A72 PolarHBondContact O-N 2.96Å; Q69-T73 WeakPolarHBondContact O-CB 3.34Å; Q69-T73 PolarHBondContact O-N 3.42Å; Q69-T73 PolarHBondContact O-OG1 3.46Å |
| 70 | D | 80.4 | Confident | 75.8 | Confident | 122 Ų | 122 | 89.4 Ų | 89.4 | 65% | 0.652 | 49% | 0.486 | S | S | * | . | H | α-helix | trans | -61 | -41.7 | 175 | -82.7 | -10.6 | 0 | 0 | 0 | 111.6 | A66 K67 T73 I74 | A66-D70 PolarHBondContact O-N 3.3Å; K67-D70 PolarHBondContact O-N 3.11Å; D70-T73 CarbonylContact O-C 3.57Å; D70-T73 PolarHBondContact O-N 3.4Å; D70-I74 VanDerWaalsContact O-CG1 3.29Å; D70-I74 WeakPolarHBondContact O-CG1 3.31Å; D70-I74 PolarHBondContact O-N 3.17Å |
| 71 | L | 74.7 | Confident | 73.8 | Confident | 100 Ų | 100 | 100 Ų | 100 | 52% | 0.524 | 53% | 0.526 | S | S | . | . | H | α-helix | trans | -67.3 | -37.8 | 176.2 | -67.1 | 173.7 | 0 | 0 | 0 | 112.6 | K67 Q68 Q69 I74 | K67-L71 HydrophobicContact CG-CD1 4.45Å; K67-L71 WeakPolarHBondContact O-CG 3.24Å; K67-L71 PolarHBondContact O-N 3.27Å; K67-L71 VanDerWaalsContact O-N 3.12Å; Q68-L71 PolarHBondContact O-N 3.46Å; Q69-L71 VanDerWaalsContact C-N 3.32Å; Q69-L71 PolarHBondContact O-N 2.92Å; L71-I74 HydrophobicContact CD2-CD1 4.15Å; L71-I74 WeakPolarHBondContact O-CG1 3.49Å |
| 72 | A | 73 | Confident | 71.4 | Confident | 84 Ų | 84 | 107.5 Ų | 107.5 | 69% | 0.694 | 55% | 0.553 | S | S | * | * | H | α-helix | trans | -73.1 | -31.8 | 176.5 | 0 | 0 | 0 | 0 | 0 | 112.6 | Q68 Q69 I74 | Q68-A72 WeakPolarHBondContact O-CB 3.41Å; Q68-A72 PolarHBondContact O-N 3.02Å; Q69-A72 PolarHBondContact O-N 2.96Å; A72-I74 VanDerWaalsContact C-N 3.27Å; A72-I74 PolarHBondContact O-N 3.32Å |
| 73 | T | 67.2 | Low | 69.1 | Low | 97 Ų | 97 | 111.8 Ų | 111.8 | 60% | 0.595 | 57% | 0.568 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -90.4 | 11.4 | -179.7 | -47.2 | 0 | 0 | 0 | 0 | 112 | Q69 D70 N75 | Q69-T73 WeakPolarHBondContact O-CB 3.34Å; Q69-T73 PolarHBondContact O-N 3.42Å; Q69-T73 PolarHBondContact O-OG1 3.46Å; D70-T73 CarbonylContact O-C 3.57Å; D70-T73 PolarHBondContact O-N 3.4Å; T73-N75 PolarHBondContact O-N 3.42Å |
| 74 | I | 59.2 | Low | 67 | Low | 111 Ų | 111 | 114.7 Ų | 114.7 | 57% | 0.569 | 58% | 0.583 | S | S | * | * | trans | -65.1 | 78.7 | 157.8 | -50.8 | 176.3 | 0 | 0 | 0 | 106.2 | D70 L71 A72 P76 | D70-I74 VanDerWaalsContact O-CG1 3.29Å; D70-I74 WeakPolarHBondContact O-CG1 3.31Å; D70-I74 PolarHBondContact O-N 3.17Å; L71-I74 HydrophobicContact CD2-CD1 4.15Å; L71-I74 WeakPolarHBondContact O-CG1 3.49Å; A72-I74 VanDerWaalsContact C-N 3.27Å; A72-I74 PolarHBondContact O-N 3.32Å; I74-P76 WeakPolarHBondContact O-CD 3.44Å | ||
| 75 | N | 59.1 | Low | 64.8 | Low | 127 Ų | 127 | 118.2 Ų | 118.2 | 68% | 0.679 | 61% | 0.613 | S | S | * | * | trans | -41.9 | 119.5 | 141.7 | -91.8 | -56.6 | 0 | 0 | 0 | 103.1 | T73 V77 | T73-N75 PolarHBondContact O-N 3.42Å; N75-V77 VanDerWaalsContact C-N 3.29Å; N75-V77 PolarHBondContact O-N 3.02Å | ||
| 76 | P | 59.8 | Low | 62.7 | Low | 101 Ų | 101 | 116.5 Ų | 116.5 | 66% | 0.656 | 62% | 0.616 | S | S | * | * | trans | -50.4 | 116.7 | 164.9 | 22.6 | -30 | 0 | 0 | 0 | 102.5 | I74 R78 | I74-P76 WeakPolarHBondContact O-CD 3.44Å; P76-R78 PolarHBondContact O-N 3.31Å | ||
| 77 | V | 58.1 | Low | 60.5 | Low | 127 Ų | 127 | 118.7 Ų | 118.7 | 77% | 0.77 | 63% | 0.627 | S | S | * | * | trans | -56.2 | 98.4 | 158.9 | 168.8 | 0 | 0 | 0 | 0 | 99.8 | N75 T79 | N75-V77 VanDerWaalsContact C-N 3.29Å; N75-V77 PolarHBondContact O-N 3.02Å; V77-T79 PolarHBondContact O-N 3.47Å | ||
| 78 | R | 53.6 | Low | 58.7 | Low | 186 Ų | 186 | 125 Ų | 125 | 70% | 0.702 | 66% | 0.657 | S | S | * | * | trans | -62.5 | 97 | 170.9 | -149.4 | -176.3 | 179.8 | -154.5 | 7.7 | 97.6 | P76 Q80 | P76-R78 PolarHBondContact O-N 3.31Å; R78-Q80 HydrophobicContact CB-CB 4.42Å; R78-Q80 HydrophobicContact CG-CB 4.28Å; R78-Q80 HydrophobicContact CG-CG 4.31Å; R78-Q80 VanDerWaalsContact NH1-CD 3.34Å; R78-Q80 PolarHBondContact O-N 3.08Å | ||
| 79 | T | 57.1 | Low | 56.9 | Low | 123 Ų | 123 | 130 Ų | 130 | 76% | 0.755 | 67% | 0.671 | S | S | * | * | trans | -56.8 | 64.3 | 131.4 | 42.3 | 0 | 0 | 0 | 0 | 105.3 | V77 R81 | V77-T79 PolarHBondContact O-N 3.47Å; T79-R81 PolarHBondContact O-N 3.11Å | ||
| 80 | Q | 48 | Very low | 55.1 | Low | 106 Ų | 106 | 129 Ų | 129 | 50% | 0.495 | 68% | 0.678 | S | S | . | * | -44.1 | 85.6 | 119.6 | -113 | 176 | -74.7 | 0 | 0 | 103.1 | R78 R82 | R78-Q80 HydrophobicContact CB-CB 4.42Å; R78-Q80 HydrophobicContact CG-CB 4.28Å; R78-Q80 HydrophobicContact CG-CG 4.31Å; R78-Q80 VanDerWaalsContact NH1-CD 3.34Å; R78-Q80 PolarHBondContact O-N 3.08Å; Q80-R82 HydrophobicContact CB-CG 4.15Å; Q80-R82 PolarHBondContact O-N 3.39Å | |||
| 81 | R | 50.7 | Low | 53.8 | Low | 222 Ų | 222 | 131 Ų | 131 | 84% | 0.838 | 69% | 0.688 | S | S | * | * | -34.1 | 84.9 | 112.2 | -74.8 | -170.4 | 177.1 | -168 | 0.6 | 104.1 | T79 N83 | T79-R81 PolarHBondContact O-N 3.11Å; R81-N83 PolarHBondContact O-N 3.02Å | |||
| 82 | R | 44.2 | Very low | 52.6 | Low | 179 Ų | 179 | 134.8 Ų | 134.8 | 68% | 0.675 | 70% | 0.7 | S | S | * | * | trans | -59.5 | 97 | 160.4 | -74.9 | -170.6 | -160.6 | 169.6 | 6 | 99.8 | Q80 I84 | Q80-R82 HydrophobicContact CB-CG 4.15Å; Q80-R82 PolarHBondContact O-N 3.39Å; R82-I84 HydrophobicContact CB-CB 4.22Å; R82-I84 HydrophobicContact CB-CD1 3.61Å; R82-I84 HydrophobicContact CB-CG1 3.69Å; R82-I84 HydrophobicContact CG-CD1 4.06Å; R82-I84 HydrophobicContact CG-CG1 4.32Å; R82-I84 PolarHBondContact O-N 2.92Å | ||
| 83 | N | 46 | Very low | 51.5 | Low | 147 Ų | 147 | 135.8 Ų | 135.8 | 79% | 0.786 | 70% | 0.698 | S | S | * | * | trans | -60.2 | 54.7 | 136.3 | -66.6 | -4.6 | 0 | 0 | 0 | 106.1 | R81 S85 | R81-N83 PolarHBondContact O-N 3.02Å; N83-S85 PolarHBondContact O-N 2.85Å; N83-S85 VanDerWaalsContact O-N 3.12Å | ||
| 84 | I | 48.3 | Very low | 50.8 | Low | 98 Ų | 98 | 136.6 Ų | 136.6 | 50% | 0.503 | 70% | 0.698 | S | S | . | * | -53.8 | 111 | 129.2 | -66.2 | 151.5 | 0 | 0 | 0 | 98.9 | R82 A86 | R82-I84 HydrophobicContact CB-CB 4.22Å; R82-I84 HydrophobicContact CB-CD1 3.61Å; R82-I84 HydrophobicContact CB-CG1 3.69Å; R82-I84 HydrophobicContact CG-CD1 4.06Å; R82-I84 HydrophobicContact CG-CG1 4.32Å; R82-I84 PolarHBondContact O-N 2.92Å; I84-A86 HydrophobicContact CG2-CB 4.04Å; I84-A86 PolarHBondContact O-N 3.36Å | |||
| 85 | S | 45.4 | Very low | 50.7 | Low | 112 Ų | 112 | 138.1 Ų | 138.1 | 78% | 0.783 | 71% | 0.707 | S | S | * | * | trans | -53.1 | 74.1 | 150.9 | -54.6 | 0 | 0 | 0 | 0 | 105.2 | N83 P87 | N83-S85 PolarHBondContact O-N 2.85Å; N83-S85 VanDerWaalsContact O-N 3.12Å; S85-P87 WeakPolarHBondContact O-CD 3.41Å; S85-P87 VanDerWaalsContact O-N 3.09Å | ||
| 86 | A | 46 | Very low | 50.7 | Low | 65 Ų | 65 | 137.8 Ų | 137.8 | 54% | 0.537 | 71% | 0.71 | S | S | . | * | trans | -67.4 | 113.9 | 172.1 | 0 | 0 | 0 | 0 | 0 | 98.6 | I84 Q88 | I84-A86 HydrophobicContact CG2-CB 4.04Å; I84-A86 PolarHBondContact O-N 3.36Å; A86-Q88 PolarHBondContact O-N 3.49Å | ||
| 87 | P | 44.5 | Very low | 50.9 | Low | 91 Ų | 91 | 141.7 Ų | 141.7 | 59% | 0.591 | 72% | 0.717 | S | S | * | * | trans | -46 | 130.1 | -176.2 | 19.3 | -30.6 | 0 | 0 | 0 | 105.1 | S85 R89 | S85-P87 WeakPolarHBondContact O-CD 3.41Å; S85-P87 VanDerWaalsContact O-N 3.09Å; P87-R89 HydrophobicContact CB-CG 4.49Å; P87-R89 PolarHBondContact O-N 3.4Å | ||
| 88 | Q | 47.7 | Very low | 51.7 | Low | 202 Ų | 202 | 144.6 Ų | 144.6 | 94% | 0.944 | 71% | 0.714 | S | S | * | * | trans | -61 | 62.6 | 172.5 | -71.6 | 169.7 | -101.5 | 0 | 0 | 108 | A86 S90 | A86-Q88 PolarHBondContact O-N 3.49Å; Q88-S90 PolarHBondContact O-N 2.56Å | ||
| 89 | R | 47 | Very low | 52.9 | Low | 207 Ų | 207 | 138.8 Ų | 138.8 | 78% | 0.781 | 70% | 0.701 | S | S | * | * | trans | -70.4 | 90.8 | 152.9 | -70.4 | -173.5 | -173.5 | 171.1 | 3.1 | 100.8 | P87 L91 | P87-R89 HydrophobicContact CB-CG 4.49Å; P87-R89 PolarHBondContact O-N 3.4Å; R89-L91 PolarHBondContact O-N 3.34Å | ||
| 90 | S | 46.5 | Very low | 53.7 | Low | 102 Ų | 102 | 139.2 Ų | 139.2 | 71% | 0.713 | 69% | 0.693 | S | S | * | * | trans | -20.2 | 108.1 | 150.2 | 172.3 | 0 | 0 | 0 | 0 | 106.5 | Q88 K92 | Q88-S90 PolarHBondContact O-N 2.56Å; S90-K92 PolarHBondContact O-N 3.14Å | ||
| 91 | L | 54 | Low | 54.8 | Low | 165 Ų | 165 | 142 Ų | 142 | 86% | 0.864 | 70% | 0.7 | S | S | * | * | trans | -64.3 | 83.5 | 168.1 | -75 | 170.2 | 0 | 0 | 0 | 103 | R89 V93 | R89-L91 PolarHBondContact O-N 3.34Å; L91-V93 PolarHBondContact O-N 3.38Å | ||
| 92 | K | 49.5 | Very low | 56 | Low | 179 Ų | 179 | 136.2 Ų | 136.2 | 78% | 0.778 | 68% | 0.682 | S | S | * | * | trans | -57.5 | 94.2 | 161.7 | -172.7 | 174.5 | -172.2 | 177.7 | 0 | 101.3 | S90 N94 | S90-K92 PolarHBondContact O-N 3.14Å; K92-N94 PolarHBondContact O-N 3.41Å; K92-N94 PolarHBondContact O-OD1 2.88Å | ||
| 93 | V | 50.6 | Low | 57.1 | Low | 105 Ų | 105 | 135.1 Ų | 135.1 | 64% | 0.636 | 69% | 0.685 | S | S | * | * | trans | -54.4 | 92 | 168.1 | 161.9 | 0 | 0 | 0 | 0 | 103.5 | L91 N95 | L91-V93 PolarHBondContact O-N 3.38Å; V93-N95 HydrophobicContact CG1-CB 4.46Å; V93-N95 WeakPolarHBondContact CG1-OD1 3.43Å; V93-N95 PolarHBondContact O-N 3Å | ||
| 94 | N | 51.8 | Low | 58.7 | Low | 114 Ų | 114 | 134 Ų | 134 | 61% | 0.61 | 67% | 0.673 | S | S | * | * | trans | -73.9 | 83.5 | 169.9 | 39.7 | -12 | 0 | 0 | 0 | 103.5 | K92 T96 K97 | K92-N94 PolarHBondContact O-N 3.41Å; K92-N94 PolarHBondContact O-OD1 2.88Å; N94-T96 PolarHBondContact O-N 3.37Å; N94-K97 PolarHBondContact O-N 3.23Å | ||
| 95 | N | 56.6 | Low | 60 | Low | 142 Ų | 142 | 137.5 Ų | 137.5 | 76% | 0.759 | 68% | 0.68 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -55.5 | 8.9 | 176.2 | -100.8 | -15 | 0 | 0 | 0 | 114.2 | V93 | V93-N95 HydrophobicContact CG1-CB 4.46Å; V93-N95 WeakPolarHBondContact CG1-OD1 3.43Å; V93-N95 PolarHBondContact O-N 3Å |
| 96 | T | 59.7 | Low | 61 | Low | 121 Ų | 121 | 135.2 Ų | 135.2 | 74% | 0.742 | 66% | 0.663 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -106.5 | -4.2 | -176.3 | 42.2 | 0 | 0 | 0 | 0 | 114.2 | N94 | N94-T96 PolarHBondContact O-N 3.37Š|
| 97 | K | 63.2 | Low | 61.4 | Low | 182 Ų | 182 | 137.6 Ų | 137.6 | 79% | 0.791 | 67% | 0.673 | S | S | * | * | trans | -134 | 100.4 | 174.3 | -66.9 | -170.5 | -179.4 | -179.4 | 0 | 111.9 | N94 | N94-K97 PolarHBondContact O-N 3.23Š| ||
| 98 | W | 76.4 | Confident | 61.7 | Low | 189 Ų | 189 | 142.7 Ų | 142.7 | 72% | 0.716 | 68% | 0.681 | S | S | * | * | trans | -60.8 | 140.4 | 167.8 | -67 | 77.8 | 0 | 0 | 0 | 109.8 | H102 | W98-H102 HydrophobicContact CE3-CB 3.79Å; W98-H102 HydrophobicContact CZ3-CB 4.38Å | ||
| 99 | C | 77.3 | Confident | 61.9 | Low | 63 Ų | 63 | 139.3 Ų | 139.3 | 43% | 0.426 | 67% | 0.669 | S | S | . | * | trans | -72.9 | 154.1 | 174.4 | 81.3 | 0 | 0 | 0 | 0 | 110.5 | Y101 H102 Q103 | C99-Y101 PolarHBondContact O-N 3.47Å; C99-Y101 VanDerWaalsContact O-N 3.08Å; C99-H102 PolarHBondContact O-N 3.29Å; C99-H102 PolarHBondContact SG-ND1 3.06Å; C99-Q103 PolarHBondContact O-N 3.31Å; C99-Q103 VanDerWaalsContact O-N 3.08Å | ||
| 100 | F | 73.6 | Confident | 62.1 | Low | 132 Ų | 132 | 136.2 Ų | 136.2 | 58% | 0.579 | 66% | 0.663 | S | S | * | * | H | α-helix | trans | -48.2 | -40.3 | -174.4 | 177.9 | -98 | 0 | 0 | 0 | 114 | K104 | F100-K104 HydrophobicContact CE1-CD 4.16Å; F100-K104 HydrophobicContact CZ-CD 4.1Å; F100-K104 WeakPolarHBondContact O-CB 3.12Å; F100-K104 PolarHBondContact O-N 3.28Å; F100-K104 VanDerWaalsContact O-N 3.11Å |
| 101 | Y | 71.2 | Confident | 62.3 | Low | 166 Ų | 166 | 136.7 Ų | 136.7 | 65% | 0.651 | 66% | 0.661 | S | S | * | * | H | α-helix | trans | -72.4 | -41.4 | -179 | -71.6 | -82.8 | 0 | 0 | 0 | 113.2 | C99 Q103 K104 W105 | C99-Y101 PolarHBondContact O-N 3.47Å; C99-Y101 VanDerWaalsContact O-N 3.08Å; Y101-Q103 VanDerWaalsContact C-N 3.31Å; Y101-Q103 PolarHBondContact O-N 3.27Å; Y101-K104 PolarHBondContact O-N 3.02Å; Y101-W105 PolarHBondContact O-N 2.94Å |
| 102 | H | 76 | Confident | 62 | Low | 100 Ų | 100 | 131.6 Ų | 131.6 | 46% | 0.463 | 64% | 0.643 | S | S | . | * | H | α-helix | trans | -66.4 | -35.6 | 176.3 | -67.1 | 127 | 0 | 0 | 0 | 111.4 | W98 C99 C106 | W98-H102 HydrophobicContact CE3-CB 3.79Å; W98-H102 HydrophobicContact CZ3-CB 4.38Å; C99-H102 PolarHBondContact O-N 3.29Å; C99-H102 PolarHBondContact SG-ND1 3.06Å; H102-C106 WeakPolarHBondContact O-CB 3.45Å; H102-C106 PolarHBondContact O-N 3.41Å |
| 103 | Q | 68.6 | Low | 62 | Low | 155 Ų | 155 | 127.6 Ų | 127.6 | 72% | 0.724 | 64% | 0.644 | S | S | * | * | H | α-helix | trans | -67.6 | -36 | 175.3 | -172.6 | 176.8 | 4.9 | 0 | 0 | 112.6 | C99 Y101 | C99-Q103 PolarHBondContact O-N 3.31Å; C99-Q103 VanDerWaalsContact O-N 3.08Å; Y101-Q103 VanDerWaalsContact C-N 3.31Å; Y101-Q103 PolarHBondContact O-N 3.27Å |
| 104 | K | 78.3 | Confident | 61.9 | Low | 124 Ų | 124 | 130.1 Ų | 130.1 | 54% | 0.539 | 65% | 0.648 | S | S | . | * | H | α-helix | trans | -86.4 | -33.5 | -173.1 | -169.5 | 173.4 | -178 | -177.5 | 0 | 114.1 | F100 Y101 | F100-K104 HydrophobicContact CE1-CD 4.16Å; F100-K104 HydrophobicContact CZ-CD 4.1Å; F100-K104 WeakPolarHBondContact O-CB 3.12Å; F100-K104 PolarHBondContact O-N 3.28Å; F100-K104 VanDerWaalsContact O-N 3.11Å; Y101-K104 PolarHBondContact O-N 3.02Å |
| 105 | W | 75.8 | Confident | 61.8 | Low | 171 Ų | 171 | 131.4 Ų | 131.4 | 65% | 0.648 | 66% | 0.655 | S | S | * | * | H | α-helix | trans | -127.9 | 0.9 | -166.3 | -53.4 | 106.1 | 0 | 0 | 0 | 115.5 | Y101 P107 | Y101-W105 PolarHBondContact O-N 2.94Å; W105-P107 VanDerWaalsContact C-CD 3.5Å; W105-P107 WeakPolarHBondContact O-CD 3.33Å |
| 106 | C | 66.8 | Low | 61.2 | Low | 64 Ų | 64 | 128.8 Ų | 128.8 | 43% | 0.432 | 65% | 0.652 | S | S | . | * | trans | -102.7 | 92.5 | 172.3 | -74.2 | 0 | 0 | 0 | 0 | 110.1 | H102 R108 | H102-C106 WeakPolarHBondContact O-CB 3.45Å; H102-C106 PolarHBondContact O-N 3.41Å; C106-R108 PolarHBondContact O-N 2.97Å | ||
| 107 | P | 53.6 | Low | 60.4 | Low | 116 Ų | 116 | 128.3 Ų | 128.3 | 75% | 0.753 | 65% | 0.654 | S | S | * | * | trans | -58.6 | 113.3 | 163.2 | 2.2 | 4.1 | 0 | 0 | 0 | 108.3 | W105 L109 | W105-P107 VanDerWaalsContact C-CD 3.5Å; W105-P107 WeakPolarHBondContact O-CD 3.33Å; P107-L109 PolarHBondContact O-N 3.3Å; P107-L109 VanDerWaalsContact O-N 3.16Å | ||
| 108 | R | 51.9 | Low | 59.4 | Low | 197 Ų | 197 | 129.4 Ų | 129.4 | 74% | 0.743 | 67% | 0.667 | S | S | * | * | trans | 8.4 | 88.4 | 169.1 | -71.7 | 175 | -167.3 | -129.7 | 7.8 | 115.2 | C106 E110 | C106-R108 PolarHBondContact O-N 2.97Å; R108-E110 HydrophobicContact CB-CG 4.25Å; R108-E110 WeakPolarHBondContact CD-OE1 3.48Å; R108-E110 HydrophobicContact CG-CG 4.45Å; R108-E110 IonicContact CZ-OE1 3.71Å; R108-E110 IonicContact NE-OE1 3.93Å; R108-E110 IonicContact NH1-OE1 2.79Å; R108-E110 PolarHBondContact NH1-OE1 2.83Å; R108-E110 PolarHBondContact O-N 3.25Å | ||
| 109 | L | 52 | Low | 58.5 | Low | 132 Ų | 132 | 126.5 Ų | 126.5 | 69% | 0.691 | 66% | 0.664 | S | S | * | * | trans | -78.5 | 65.9 | 152.7 | -67.6 | 174.2 | 0 | 0 | 0 | 108.2 | P107 T111 A112 | P107-L109 PolarHBondContact O-N 3.3Å; P107-L109 VanDerWaalsContact O-N 3.16Å; L109-T111 PolarHBondContact O-N 3.2Å; L109-A112 HydrophobicContact CB-CB 4.24Å | ||
| 110 | E | 50.4 | Low | 57.5 | Low | 142 Ų | 142 | 129.8 Ų | 129.8 | 66% | 0.664 | 68% | 0.677 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -65.1 | -0 | 175.8 | -93.6 | 172 | -172.8 | 0 | 0 | 112.9 | R108 | R108-E110 HydrophobicContact CB-CG 4.25Å; R108-E110 WeakPolarHBondContact CD-OE1 3.48Å; R108-E110 HydrophobicContact CG-CG 4.45Å; R108-E110 IonicContact CZ-OE1 3.71Å; R108-E110 IonicContact NE-OE1 3.93Å; R108-E110 IonicContact NH1-OE1 2.79Å; R108-E110 PolarHBondContact NH1-OE1 2.83Å; R108-E110 PolarHBondContact O-N 3.25Å |
| 111 | T | 51.2 | Low | 56.6 | Low | 111 Ų | 111 | 129.7 Ų | 129.7 | 68% | 0.681 | 68% | 0.682 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -124.4 | 3.4 | -176.9 | 51.6 | 0 | 0 | 0 | 0 | 115.8 | L109 | L109-T111 PolarHBondContact O-N 3.2Š|
| 112 | A | 46.7 | Very low | 55.8 | Low | 58 Ų | 58 | 127.5 Ų | 127.5 | 48% | 0.479 | 68% | 0.684 | S | S | . | * | G | 310 helix | trans | -80.3 | -17.4 | -179.6 | 0 | 0 | 0 | 0 | 0 | 114.4 | L109 H114 | L109-A112 HydrophobicContact CB-CB 4.24Å; A112-H114 PolarHBondContact O-N 3.1Å |
| 113 | A | 50.4 | Low | 54.5 | Low | 96 Ų | 96 | 129.3 Ų | 129.3 | 79% | 0.793 | 70% | 0.698 | S | S | * | * | G | 310 helix | trans | -71.9 | -17.2 | 177.8 | 0 | 0 | 0 | 0 | 0 | 113.3 | ||
| 114 | H | 48.7 | Very low | 53.6 | Low | 157 Ų | 157 | 127.5 Ų | 127.5 | 73% | 0.727 | 70% | 0.696 | S | S | * | * | G | 310 helix | trans | -91.4 | -6.9 | -176.9 | -137 | -63.4 | 0 | 0 | 0 | 114.5 | A112 | A112-H114 PolarHBondContact O-N 3.1Š|
| 115 | L | 48.6 | Very low | 51.8 | Low | 142 Ų | 142 | 127.8 Ų | 127.8 | 74% | 0.743 | 71% | 0.707 | S | S | * | * | S | Bend | trans | -103.1 | 1.7 | -179.9 | -74.9 | 172.6 | 0 | 0 | 0 | 114.3 | ||
| 116 | A | 44.4 | Very low | 49.9 | Very low | 86 Ų | 86 | 124.5 Ų | 124.5 | 71% | 0.711 | 71% | 0.712 | S | S | * | * | S | Bend | trans | -98.9 | 20.8 | 173.9 | 0 | 0 | 0 | 0 | 0 | 113.3 | ||
| 117 | S | 43.1 | Very low | 48.5 | Very low | 111 Ų | 111 | 129.5 Ų | 129.5 | 78% | 0.776 | 74% | 0.735 | S | S | * | * | trans | -140.8 | 25.1 | 176.2 | -69.7 | 0 | 0 | 0 | 0 | 114.5 | ||||
| 118 | I | 41.4 | Very low | 48.1 | Very low | 206 Ų | 206 | 130.7 Ų | 130.7 | 100% | 1.056 | 73% | 0.733 | S | S | * | * | trans | -132.6 | 0 | 161.5 | -55.2 | 177.8 | 0 | 0 | 0 | 106.8 |
Retrieved 118 of 118 residues in 219.9 ms
(Link to these results)