| 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 | 39.8 | Very low | 70.3 | Confident | 235 Ų | 235 | 94.7 Ų | 94.7 | 100% | 1.158 | 51% | 0.506 | S | S | * | . | 0 | 118.3 | 0 | -66.1 | 169.4 | 168.5 | 0 | 0 | 106.9 | S3 | M1-S3 PolarHBondContact O-N 3.08Š| |||
| 2 | I | 43.7 | Very low | 71.5 | Confident | 111 Ų | 111 | 94.7 Ų | 94.7 | 57% | 0.569 | 50% | 0.502 | S | S | * | . | trans | -78.9 | 100.6 | 173.5 | -65.2 | 170 | 0 | 0 | 0 | 105.7 | L4 | I2-L4 PolarHBondContact O-N 3.49Š| ||
| 3 | S | 50.6 | Low | 72.9 | Confident | 107 Ų | 107 | 89.9 Ų | 89.9 | 75% | 0.748 | 49% | 0.49 | S | S | * | . | trans | -68.5 | 100.8 | 172.3 | -61.9 | 0 | 0 | 0 | 0 | 108 | M1 T5 | M1-S3 PolarHBondContact O-N 3.08Å; S3-T5 PolarHBondContact O-N 3.4Å | ||
| 4 | L | 62.4 | Low | 74.3 | Confident | 62 Ų | 62 | 86.4 Ų | 86.4 | 33% | 0.325 | 47% | 0.47 | S | S | . | . | trans | -61.4 | 125.9 | 167.2 | -70.8 | 169.2 | 0 | 0 | 0 | 107.8 | I2 Q8 K9 M12 F108 | I2-L4 PolarHBondContact O-N 3.49Å; L4-Q8 HydrophobicContact CD2-CB 4.39Å; L4-K9 HydrophobicContact CB-CG 4.44Å; L4-M12 HydrophobicContact CD1-CE 3.77Å; L4-F108 HydrophobicContact CD2-CE1 4.42Å | ||
| 5 | T | 77.4 | Confident | 75.4 | Confident | 78 Ų | 78 | 82.3 Ų | 82.3 | 48% | 0.479 | 45% | 0.449 | S | S | . | . | trans | -66.4 | 150.4 | 175.2 | 56.3 | 0 | 0 | 0 | 0 | 109.6 | S3 T7 Q8 K9 | S3-T5 PolarHBondContact O-N 3.4Å; T5-T7 PolarHBondContact O-N 3.4Å; T5-T7 VanDerWaalsContact O-N 3.14Å; T5-Q8 WeakPolarHBondContact O-CA 3.4Å; T5-Q8 WeakPolarHBondContact O-CB 3.45Å; T5-Q8 PolarHBondContact O-N 3.21Å; T5-Q8 WeakPolarHBondContact OG1-CG 3.27Å; T5-Q8 PolarHBondContact OG1-OE1 3.15Å; T5-K9 PolarHBondContact O-N 3.1Å | ||
| 6 | D | 82 | Confident | 76.4 | Confident | 111 Ų | 111 | 79.8 Ų | 79.8 | 59% | 0.594 | 45% | 0.448 | S | S | * | . | H | α-helix | trans | -58.5 | -30.3 | -179.5 | -61.2 | -67.3 | 0 | 0 | 0 | 112 | Q8 K9 I10 | D6-Q8 PolarHBondContact O-N 3.35Å; D6-K9 PolarHBondContact O-N 3.23Å; D6-K9 IonicContact OD1-NZ 3.65Å; D6-K9 PolarHBondContact OD1-NZ 3.48Å; D6-I10 WeakPolarHBondContact O-CG1 3.12Å; D6-I10 PolarHBondContact O-N 3.41Å |
| 7 | T | 79.4 | Confident | 77.4 | Confident | 72 Ų | 72 | 82.4 Ų | 82.4 | 44% | 0.442 | 45% | 0.454 | S | S | . | . | H | α-helix | trans | -59.6 | -41.2 | 169.8 | -44.3 | 0 | 0 | 0 | 0 | 113.2 | T5 I10 G11 F48 | T5-T7 PolarHBondContact O-N 3.4Å; T5-T7 VanDerWaalsContact O-N 3.14Å; T7-I10 PolarHBondContact O-N 3.34Å; T7-G11 PolarHBondContact O-N 3.5Å; T7-F48 HydrophobicContact CG2-CB 4.27Å; T7-F48 HydrophobicContact CG2-CD1 3.4Å; T7-F48 HydrophobicContact CG2-CE1 4.1Å; T7-F48 HydrophobicContact CG2-CG 4.2Å |
| 8 | Q | 80.8 | Confident | 78.3 | Confident | 50 Ų | 50 | 77.8 Ų | 77.8 | 23% | 0.234 | 43% | 0.429 | C | S | . | . | H | α-helix | trans | -70 | -34.1 | 177.9 | -73.4 | 178.1 | -46.3 | 0 | 0 | 112.2 | L4 T5 D6 G11 M12 V49 | L4-Q8 HydrophobicContact CD2-CB 4.39Å; T5-Q8 WeakPolarHBondContact O-CA 3.4Å; T5-Q8 WeakPolarHBondContact O-CB 3.45Å; T5-Q8 PolarHBondContact O-N 3.21Å; T5-Q8 WeakPolarHBondContact OG1-CG 3.27Å; T5-Q8 PolarHBondContact OG1-OE1 3.15Å; D6-Q8 PolarHBondContact O-N 3.35Å; Q8-G11 PolarHBondContact O-N 3.23Å; Q8-M12 WeakPolarHBondContact O-CG 3.48Å; Q8-M12 PolarHBondContact O-N 3.01Å; Q8-V49 PolarHBondContact NE2-O 3Å |
| 9 | K | 82.8 | Confident | 79 | Confident | 115 Ų | 115 | 77.7 Ų | 77.7 | 50% | 0.5 | 43% | 0.43 | S | S | . | . | H | α-helix | trans | -65.1 | -45.9 | 174.1 | -65.6 | 176.5 | -172.7 | 162.9 | 0 | 111.2 | L4 T5 D6 G11 M12 G13 | L4-K9 HydrophobicContact CB-CG 4.44Å; T5-K9 PolarHBondContact O-N 3.1Å; D6-K9 PolarHBondContact O-N 3.23Å; D6-K9 IonicContact OD1-NZ 3.65Å; D6-K9 PolarHBondContact OD1-NZ 3.48Å; K9-G11 VanDerWaalsContact C-N 3.32Å; K9-G11 PolarHBondContact O-N 2.95Å; K9-M12 HydrophobicContact CG-CE 4.46Å; K9-M12 PolarHBondContact O-N 3.34Å; K9-G13 PolarHBondContact O-N 3.23Å; K9-G13 VanDerWaalsContact O-N 3.11Å |
| 10 | I | 87.4 | Confident | 79.7 | Confident | 101 Ų | 101 | 79.6 Ų | 79.6 | 52% | 0.518 | 43% | 0.434 | S | S | . | . | H | α-helix | trans | -59.3 | -46.4 | 173.7 | -68.8 | 165.8 | 0 | 0 | 0 | 109.9 | D6 T7 M12 G13 L14 | D6-I10 WeakPolarHBondContact O-CG1 3.12Å; D6-I10 PolarHBondContact O-N 3.41Å; T7-I10 PolarHBondContact O-N 3.34Å; I10-M12 PolarHBondContact O-N 3.3Å; I10-G13 WeakPolarHBondContact O-CA 3.48Å; I10-G13 PolarHBondContact O-N 3.11Å; I10-G13 VanDerWaalsContact O-N 3.12Å; I10-L14 HydrophobicContact CG2-CD1 3.48Å; I10-L14 VanDerWaalsContact CG2-CD1 3.48Å; I10-L14 WeakPolarHBondContact O-CD1 3.38Å; I10-L14 PolarHBondContact O-N 3.47Å |
| 11 | G | 86.8 | Confident | 80.4 | Confident | 0 Ų | 0 | 78.7 Ų | 78.7 | 0% | 0 | 43% | 0.426 | C | S | . | . | H | α-helix | trans | -57.2 | -44.9 | 176.8 | 0 | 0 | 0 | 0 | 0 | 113.3 | T7 Q8 K9 G13 L14 T15 G45 F48 | T7-G11 PolarHBondContact O-N 3.5Å; Q8-G11 PolarHBondContact O-N 3.23Å; K9-G11 VanDerWaalsContact C-N 3.32Å; K9-G11 PolarHBondContact O-N 2.95Å; G11-G13 VanDerWaalsContact C-N 3.3Å; G11-G13 PolarHBondContact O-N 3.02Å; G11-L14 PolarHBondContact O-N 2.75Å; G11-T15 PolarHBondContact O-N 3.46Å; G11-T15 PolarHBondContact O-OG1 3.36Å; G11-G45 WeakPolarHBondContact O-CA 3.5Å; G11-F48 VanDerWaalsContact CA-CB 3.49Å |
| 12 | M | 85.1 | Confident | 82.8 | Confident | 94 Ų | 94 | 68.4 Ų | 68.4 | 46% | 0.463 | 38% | 0.375 | S | S | . | . | H | α-helix | trans | -61.5 | -39.8 | 176.2 | -76 | -172.2 | -70.8 | 0 | 0 | 111.8 | L4 Q8 K9 I10 G16 V49 | L4-M12 HydrophobicContact CD1-CE 3.77Å; Q8-M12 WeakPolarHBondContact O-CG 3.48Å; Q8-M12 PolarHBondContact O-N 3.01Å; K9-M12 HydrophobicContact CG-CE 4.46Å; K9-M12 PolarHBondContact O-N 3.34Å; I10-M12 PolarHBondContact O-N 3.3Å; M12-G16 PolarHBondContact O-N 3.41Å; M12-V49 HydrophobicContact CB-CG2 4.49Å; M12-V49 HydrophobicContact CG-CG2 3.9Å |
| 13 | G | 89.9 | Confident | 85.1 | Confident | 33 Ų | 33 | 68.9 Ų | 68.9 | 34% | 0.34 | 37% | 0.374 | S | S | . | . | H | α-helix | trans | -60.3 | -50.6 | 172.8 | 0 | 0 | 0 | 0 | 0 | 112.1 | K9 I10 G11 T15 G16 F17 | K9-G13 PolarHBondContact O-N 3.23Å; K9-G13 VanDerWaalsContact O-N 3.11Å; I10-G13 WeakPolarHBondContact O-CA 3.48Å; I10-G13 PolarHBondContact O-N 3.11Å; I10-G13 VanDerWaalsContact O-N 3.12Å; G11-G13 VanDerWaalsContact C-N 3.3Å; G11-G13 PolarHBondContact O-N 3.02Å; G13-T15 PolarHBondContact O-N 3.41Å; G13-G16 PolarHBondContact O-N 2.88Å; G13-F17 WeakPolarHBondContact O-CD2 3.38Å; G13-F17 PolarHBondContact O-N 2.96Å |
| 14 | L | 92.6 | Very high | 87.2 | Confident | 40 Ų | 40 | 67.9 Ų | 67.9 | 21% | 0.209 | 36% | 0.356 | C | S | . | . | H | α-helix | trans | -59.8 | -44.7 | 178 | -92.9 | 126.7 | 0 | 0 | 0 | 112.8 | I10 G11 G16 F17 G18 L41 A44 F48 | I10-L14 HydrophobicContact CG2-CD1 3.48Å; I10-L14 VanDerWaalsContact CG2-CD1 3.48Å; I10-L14 WeakPolarHBondContact O-CD1 3.38Å; I10-L14 PolarHBondContact O-N 3.47Å; G11-L14 PolarHBondContact O-N 2.75Å; L14-G16 VanDerWaalsContact C-N 3.33Å; L14-G16 PolarHBondContact O-N 3.25Å; L14-F17 PolarHBondContact O-N 3.37Å; L14-G18 PolarHBondContact O-N 2.89Å; L14-L41 HydrophobicContact CD2-CD2 3.67Å; L14-A44 HydrophobicContact CD2-CB 4.13Å; L14-F48 HydrophobicContact CD1-CD2 4.19Å; L14-F48 HydrophobicContact CD1-CE2 4.49Å |
| 15 | T | 90.4 | Very high | 88.6 | Confident | 26 Ų | 26 | 65 Ų | 65 | 16% | 0.16 | 34% | 0.341 | C | S | . | . | H | α-helix | trans | -62.2 | -42.3 | 176 | -60.4 | 0 | 0 | 0 | 0 | 110.9 | G11 G13 G18 V19 F42 G45 L46 | G11-T15 PolarHBondContact O-N 3.46Å; G11-T15 PolarHBondContact O-OG1 3.36Å; G13-T15 PolarHBondContact O-N 3.41Å; T15-G18 PolarHBondContact O-N 2.92Å; T15-V19 WeakPolarHBondContact O-CG2 3.24Å; T15-V19 PolarHBondContact O-N 3.32Å; T15-F42 HydrophobicContact CG2-CD2 3.79Å; T15-F42 HydrophobicContact CG2-CE2 3.74Å; T15-G45 VanDerWaalsContact OG1-CA 3.3Å; T15-G45 WeakPolarHBondContact OG1-CA 3.42Å; T15-L46 HydrophobicContact CG2-CD2 4.47Å; T15-L46 PolarHBondContact OG1-N 3.47Å |
| 16 | G | 92.1 | Very high | 89.1 | Confident | 42 Ų | 42 | 64.4 Ų | 64.4 | 43% | 0.433 | 33% | 0.334 | S | S | . | . | H | α-helix | trans | -61.5 | -47 | 176.1 | 0 | 0 | 0 | 0 | 0 | 112.7 | M12 G13 L14 G18 V19 F20 | M12-G16 PolarHBondContact O-N 3.41Å; G13-G16 PolarHBondContact O-N 2.88Å; L14-G16 VanDerWaalsContact C-N 3.33Å; L14-G16 PolarHBondContact O-N 3.25Å; G16-G18 VanDerWaalsContact C-N 3.35Å; G16-G18 PolarHBondContact O-N 2.81Å; G16-V19 PolarHBondContact O-N 3.37Å; G16-F20 WeakPolarHBondContact O-CB 3.12Å; G16-F20 PolarHBondContact O-N 3.26Å |
| 17 | F | 92.9 | Very high | 89.7 | Confident | 124 Ų | 124 | 63.8 Ų | 63.8 | 54% | 0.544 | 33% | 0.329 | S | S | . | . | H | α-helix | trans | -62.7 | -40.3 | 174.5 | -82.3 | -67.2 | 0 | 0 | 0 | 112.3 | G13 L14 F20 F21 L41 | G13-F17 WeakPolarHBondContact O-CD2 3.38Å; G13-F17 PolarHBondContact O-N 2.96Å; L14-F17 PolarHBondContact O-N 3.37Å; F17-F20 WeakPolarHBondContact O-CB 3.43Å; F17-F20 PolarHBondContact O-N 3.44Å; F17-F21 HydrophobicContact CD1-CE2 4.33Å; F17-F21 WeakPolarHBondContact O-CD2 3.16Å; F17-F21 PolarHBondContact O-N 3.13Å; F17-L41 HydrophobicContact CB-CD1 4.37Å |
| 18 | G | 93.4 | Very high | 90.3 | Very high | 0 Ų | 0 | 64.3 Ų | 64.3 | 0% | 0 | 33% | 0.329 | C | S | . | . | H | α-helix | trans | -58.9 | -48.4 | 175.5 | 0 | 0 | 0 | 0 | 0 | 112.4 | L14 T15 G16 F20 F21 L22 G38 | L14-G18 PolarHBondContact O-N 2.89Å; T15-G18 PolarHBondContact O-N 2.92Å; G16-G18 VanDerWaalsContact C-N 3.35Å; G16-G18 PolarHBondContact O-N 2.81Å; G18-F20 VanDerWaalsContact C-N 3.33Å; G18-F20 PolarHBondContact O-N 2.82Å; G18-F21 PolarHBondContact O-N 2.96Å; G18-L22 WeakPolarHBondContact O-CB 3.18Å; G18-L22 VanDerWaalsContact O-CG 3.3Å; G18-L22 WeakPolarHBondContact O-CG 3.48Å; G18-L22 PolarHBondContact O-N 2.87Å; G18-G38 VanDerWaalsContact CA-O 3.29Å; G18-G38 WeakPolarHBondContact CA-O 3.48Å; G18-G38 WeakPolarHBondContact O-CA 3.43Å |
| 19 | V | 91.7 | Very high | 90.6 | Very high | 76 Ų | 76 | 71.3 Ų | 71.3 | 46% | 0.461 | 36% | 0.359 | S | S | . | . | H | α-helix | trans | -61.8 | -40.7 | 175.4 | 174 | 0 | 0 | 0 | 0 | 111.5 | T15 G16 L22 F23 F42 | T15-V19 WeakPolarHBondContact O-CG2 3.24Å; T15-V19 PolarHBondContact O-N 3.32Å; G16-V19 PolarHBondContact O-N 3.37Å; V19-L22 PolarHBondContact O-N 3.19Å; V19-F23 WeakPolarHBondContact O-CB 3.32Å; V19-F23 PolarHBondContact O-N 2.96Å; V19-F42 HydrophobicContact CG2-CD2 3.83Å; V19-F42 HydrophobicContact CG2-CE2 3.76Å |
| 20 | F | 93.6 | Very high | 90.7 | Very high | 114 Ų | 114 | 69.1 Ų | 69.1 | 50% | 0.5 | 35% | 0.35 | S | S | . | . | H | α-helix | trans | -60.2 | -50.6 | 176.6 | 173 | -97.2 | 0 | 0 | 0 | 111.9 | G16 F17 G18 L22 F23 F24 | G16-F20 WeakPolarHBondContact O-CB 3.12Å; G16-F20 PolarHBondContact O-N 3.26Å; F17-F20 WeakPolarHBondContact O-CB 3.43Å; F17-F20 PolarHBondContact O-N 3.44Å; G18-F20 VanDerWaalsContact C-N 3.33Å; G18-F20 PolarHBondContact O-N 2.82Å; F20-L22 VanDerWaalsContact C-N 3.32Å; F20-L22 PolarHBondContact O-N 3Å; F20-F23 PolarHBondContact O-N 3.23Å; F20-F24 VanDerWaalsContact O-CB 3.25Å; F20-F24 WeakPolarHBondContact O-CB 3.32Å; F20-F24 PolarHBondContact O-N 3.09Å |
| 21 | F | 92.6 | Very high | 90.9 | Very high | 61 Ų | 61 | 67.4 Ų | 67.4 | 27% | 0.268 | 34% | 0.341 | S | S | . | . | H | α-helix | trans | -66.9 | -33.2 | 178.9 | -77.2 | -63.6 | 0 | 0 | 0 | 112.7 | F17 G18 G25 L34 I37 L41 | F17-F21 HydrophobicContact CD1-CE2 4.33Å; F17-F21 WeakPolarHBondContact O-CD2 3.16Å; F17-F21 PolarHBondContact O-N 3.13Å; G18-F21 PolarHBondContact O-N 2.96Å; F21-G25 PolarHBondContact O-N 3.06Å; F21-L34 HydrophobicContact CD1-CG 4.25Å; F21-I37 HydrophobicContact CD2-CG2 4.38Å; F21-L41 HydrophobicContact CD2-CD1 3.5Å; F21-L41 VanDerWaalsContact CD2-CD1 3.5Å; F21-L41 HydrophobicContact CE2-CD1 3.81Å |
| 22 | L | 91.9 | Very high | 90.9 | Very high | 19 Ų | 19 | 73 Ų | 73 | 10% | 0.099 | 37% | 0.366 | C | S | . | . | H | α-helix | trans | -63.7 | -48.4 | 172.6 | -77.7 | 167.9 | 0 | 0 | 0 | 111.9 | G18 V19 F20 G25 M26 L35 N39 F42 M87 | G18-L22 WeakPolarHBondContact O-CB 3.18Å; G18-L22 VanDerWaalsContact O-CG 3.3Å; G18-L22 WeakPolarHBondContact O-CG 3.48Å; G18-L22 PolarHBondContact O-N 2.87Å; V19-L22 PolarHBondContact O-N 3.19Å; F20-L22 VanDerWaalsContact C-N 3.32Å; F20-L22 PolarHBondContact O-N 3Å; L22-G25 PolarHBondContact O-N 3.3Å; L22-M26 WeakPolarHBondContact O-CG 3.49Å; L22-M26 PolarHBondContact O-N 2.81Å; L22-L35 HydrophobicContact CD2-CD2 3.91Å; L22-L35 WeakPolarHBondContact O-CD2 3.39Å; L22-N39 WeakPolarHBondContact CD1-OD1 3.42Å; L22-N39 WeakPolarHBondContact CD2-OD1 3.34Å; L22-F42 HydrophobicContact CD1-CB 4.29Å; L22-F42 HydrophobicContact CD1-CG 4.43Å; L22-M87 HydrophobicContact CD2-CE 4.24Å; L22-M87 HydrophobicContact CD2-SD 3.92Å |
| 23 | F | 92.1 | Very high | 91.1 | Very high | 122 Ų | 122 | 71.2 Ų | 71.2 | 54% | 0.535 | 37% | 0.366 | S | S | . | . | H | α-helix | trans | -63.3 | -45.6 | 178.1 | -178.8 | -106.8 | 0 | 0 | 0 | 111.9 | V19 F20 G25 M26 I27 | V19-F23 WeakPolarHBondContact O-CB 3.32Å; V19-F23 PolarHBondContact O-N 2.96Å; F20-F23 PolarHBondContact O-N 3.23Å; F23-G25 PolarHBondContact O-N 3.34Å; F23-M26 HydrophobicContact CB-CE 4.49Å; F23-M26 HydrophobicContact CD2-CE 4.11Å; F23-M26 WeakPolarHBondContact O-CB 3.48Å; F23-M26 PolarHBondContact O-N 3.14Å; F23-I27 HydrophobicContact CD1-CD1 3.87Å; F23-I27 HydrophobicContact CE1-CD1 3.31Å; F23-I27 HydrophobicContact CE1-CG1 4.38Å; F23-I27 HydrophobicContact CE2-CD1 4.35Å; F23-I27 HydrophobicContact CZ-CD1 3.6Å; F23-I27 HydrophobicContact CZ-CG1 4.39Å; F23-I27 PolarHBondContact O-N 3.43Å; F23-I27 VanDerWaalsContact O-N 3.1Å |
| 24 | F | 93.2 | Very high | 91.3 | Very high | 86 Ų | 86 | 71.3 Ų | 71.3 | 38% | 0.377 | 36% | 0.358 | S | S | . | . | H | α-helix | trans | -65.2 | -39.3 | 178.4 | -167 | -122.6 | 0 | 0 | 0 | 111.8 | F20 M26 I27 L28 L34 | F20-F24 VanDerWaalsContact O-CB 3.25Å; F20-F24 WeakPolarHBondContact O-CB 3.32Å; F20-F24 PolarHBondContact O-N 3.09Å; F24-M26 VanDerWaalsContact C-N 3.33Å; F24-M26 PolarHBondContact O-N 3.49Å; F24-I27 PolarHBondContact O-N 2.91Å; F24-L28 HydrophobicContact CD1-CD1 4.11Å; F24-L28 HydrophobicContact CE1-CD1 3.58Å; F24-L28 HydrophobicContact CE1-CG 4.44Å; F24-L28 HydrophobicContact CE2-CD1 4.43Å; F24-L28 HydrophobicContact CZ-CD1 3.76Å; F24-L28 HydrophobicContact CZ-CG 4.3Å; F24-L28 PolarHBondContact O-N 3.34Å; F24-L34 HydrophobicContact CB-CD2 4.37Å; F24-L34 HydrophobicContact CD1-CD2 3.26Å; F24-L34 HydrophobicContact CD1-CG 4.44Å; F24-L34 HydrophobicContact CE1-CD2 3.81Å; F24-L34 HydrophobicContact CG-CD2 4.14Å |
| 25 | G | 91.6 | Very high | 91.2 | Very high | 0 Ų | 0 | 69.4 Ų | 69.4 | 0% | 0 | 35% | 0.349 | C | S | . | . | H | α-helix | trans | -63 | -35.8 | 173.7 | 0 | 0 | 0 | 0 | 0 | 113.2 | F21 L22 F23 F30 D31 | F21-G25 PolarHBondContact O-N 3.06Å; L22-G25 PolarHBondContact O-N 3.3Å; F23-G25 PolarHBondContact O-N 3.34Å; G25-F30 CarbonylContact O-C 3.57Å; G25-F30 WeakPolarHBondContact O-CA 3.4Å; G25-F30 PolarHBondContact O-N 2.81Å; G25-D31 PolarHBondContact O-N 3.46Å |
| 26 | M | 89.6 | Confident | 91.2 | Very high | 67 Ų | 67 | 69.1 Ų | 69.1 | 33% | 0.33 | 35% | 0.348 | S | S | . | . | H | α-helix | trans | -66.1 | -42.8 | 172.6 | -71.6 | -171.2 | -68 | 0 | 0 | 112.3 | L22 F23 F24 L28 F29 F30 L35 M87 | L22-M26 WeakPolarHBondContact O-CG 3.49Å; L22-M26 PolarHBondContact O-N 2.81Å; F23-M26 HydrophobicContact CB-CE 4.49Å; F23-M26 HydrophobicContact CD2-CE 4.11Å; F23-M26 WeakPolarHBondContact O-CB 3.48Å; F23-M26 PolarHBondContact O-N 3.14Å; F24-M26 VanDerWaalsContact C-N 3.33Å; F24-M26 PolarHBondContact O-N 3.49Å; M26-L28 VanDerWaalsContact C-N 3.33Å; M26-L28 PolarHBondContact O-N 2.92Å; M26-F29 PolarHBondContact O-N 3.14Å; M26-F30 HydrophobicContact CG-CD1 4.36Å; M26-F30 HydrophobicContact CG-CE1 3.97Å; M26-L35 HydrophobicContact CG-CD2 4.09Å; M26-M87 HydrophobicContact CE-CE 4.22Å; M26-M87 HydrophobicContact CG-CE 3.82Å; M26-M87 HydrophobicContact SD-CE 3.48Å; M26-M87 WeakPolarHBondContact SD-CE 3.4Å |
| 27 | I | 92.9 | Very high | 91.3 | Very high | 97 Ų | 97 | 71.2 Ų | 71.2 | 50% | 0.497 | 35% | 0.349 | S | S | . | . | H | α-helix | trans | -63.6 | -39.7 | 178 | -69.5 | 173.7 | 0 | 0 | 0 | 111.1 | F23 F24 F29 | F23-I27 HydrophobicContact CD1-CD1 3.87Å; F23-I27 HydrophobicContact CE1-CD1 3.31Å; F23-I27 HydrophobicContact CE1-CG1 4.38Å; F23-I27 HydrophobicContact CE2-CD1 4.35Å; F23-I27 HydrophobicContact CZ-CD1 3.6Å; F23-I27 HydrophobicContact CZ-CG1 4.39Å; F23-I27 PolarHBondContact O-N 3.43Å; F23-I27 VanDerWaalsContact O-N 3.1Å; F24-I27 PolarHBondContact O-N 2.91Å; I27-F29 PolarHBondContact O-N 3.15Å |
| 28 | L | 92.1 | Very high | 91.3 | Very high | 83 Ų | 83 | 65.3 Ų | 65.3 | 44% | 0.435 | 32% | 0.323 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -78.8 | 43.1 | 176.5 | -67 | -177.8 | 0 | 0 | 0 | 112.9 | F24 M26 F30 D31 L34 | F24-L28 HydrophobicContact CD1-CD1 4.11Å; F24-L28 HydrophobicContact CE1-CD1 3.58Å; F24-L28 HydrophobicContact CE1-CG 4.44Å; F24-L28 HydrophobicContact CE2-CD1 4.43Å; F24-L28 HydrophobicContact CZ-CD1 3.76Å; F24-L28 HydrophobicContact CZ-CG 4.3Å; F24-L28 PolarHBondContact O-N 3.34Å; M26-L28 VanDerWaalsContact C-N 3.33Å; M26-L28 PolarHBondContact O-N 2.92Å; L28-F30 VanDerWaalsContact C-N 3.34Å; L28-F30 PolarHBondContact O-N 2.91Å; L28-D31 HydrophobicContact CB-CB 4.28Å; L28-D31 PolarHBondContact O-N 3.45Å; L28-L34 HydrophobicContact CD1-CD2 3.87Å |
| 29 | F | 87.4 | Confident | 91.2 | Very high | 198 Ų | 198 | 65.3 Ų | 65.3 | 87% | 0.868 | 32% | 0.323 | S | S | * | . | T | Hydrogen-bonded Turn | trans | 55.7 | 41.6 | 176.8 | -65.1 | -82.6 | 0 | 0 | 0 | 114.6 | M26 I27 | M26-F29 PolarHBondContact O-N 3.14Å; I27-F29 PolarHBondContact O-N 3.15Å |
| 30 | F | 86.1 | Confident | 91.2 | Very high | 69 Ų | 69 | 65.9 Ų | 65.9 | 30% | 0.303 | 33% | 0.327 | S | S | . | . | S | Bend | trans | 60.1 | 50.4 | -178.1 | -63.1 | -93 | 0 | 0 | 0 | 113.1 | G25 M26 L28 K32 L35 P83 L84 M87 | G25-F30 CarbonylContact O-C 3.57Å; G25-F30 WeakPolarHBondContact O-CA 3.4Å; G25-F30 PolarHBondContact O-N 2.81Å; M26-F30 HydrophobicContact CG-CD1 4.36Å; M26-F30 HydrophobicContact CG-CE1 3.97Å; L28-F30 VanDerWaalsContact C-N 3.34Å; L28-F30 PolarHBondContact O-N 2.91Å; F30-K32 PolarHBondContact O-N 3.22Å; F30-K32 VanDerWaalsContact O-N 3.13Å; F30-L35 HydrophobicContact CB-CD1 3.95Å; F30-L35 HydrophobicContact CD1-CD1 3.97Å; F30-L35 HydrophobicContact CG-CD1 4.45Å; F30-P83 HydrophobicContact CB-CB 4.2Å; F30-P83 HydrophobicContact CB-CG 4.02Å; F30-L84 HydrophobicContact CD1-CD1 4Å; F30-L84 HydrophobicContact CD2-CD1 3.91Å; F30-L84 HydrophobicContact CE1-CD1 3.58Å; F30-L84 HydrophobicContact CE2-CD1 3.49Å; F30-L84 VanDerWaalsContact CE2-CD1 3.49Å; F30-L84 HydrophobicContact CG-CD1 4.16Å; F30-L84 HydrophobicContact CZ-CD1 3.31Å; F30-M87 HydrophobicContact CE1-CG 4.49Å |
| 31 | D | 89.9 | Confident | 91.1 | Very high | 64 Ų | 64 | 62.5 Ų | 62.5 | 34% | 0.342 | 31% | 0.313 | S | S | . | . | trans | -57 | 118.3 | 173.8 | -175.3 | -76.3 | 0 | 0 | 0 | 110.5 | G25 L28 A33 L34 L35 | G25-D31 PolarHBondContact O-N 3.46Å; L28-D31 HydrophobicContact CB-CB 4.28Å; L28-D31 PolarHBondContact O-N 3.45Å; D31-A33 VanDerWaalsContact C-N 3.32Å; D31-A33 PolarHBondContact O-N 2.93Å; D31-A33 WeakPolarHBondContact OD1-CA 3.14Å; D31-A33 WeakPolarHBondContact OD1-CB 3.44Å; D31-A33 PolarHBondContact OD1-N 3.47Å; D31-L34 HydrophobicContact CB-CB 4.21Å; D31-L34 PolarHBondContact O-N 2.9Å; D31-L34 PolarHBondContact OD1-N 3.24Å; D31-L35 WeakPolarHBondContact O-CB 3.29Å; D31-L35 WeakPolarHBondContact O-CG 3.38Å; D31-L35 PolarHBondContact O-N 3.49Å | ||
| 32 | K | 88.1 | Confident | 91 | Very high | 118 Ų | 118 | 60.3 Ų | 60.3 | 51% | 0.513 | 30% | 0.304 | S | S | . | . | H | α-helix | trans | -64.3 | -36.8 | -172.3 | -63 | 177.2 | -172.3 | -166.3 | 0 | 112.1 | F30 A36 G81 P83 | F30-K32 PolarHBondContact O-N 3.22Å; F30-K32 VanDerWaalsContact O-N 3.13Å; K32-A36 WeakPolarHBondContact O-CB 3.15Å; K32-A36 PolarHBondContact O-N 2.91Å; K32-G81 WeakPolarHBondContact CE-O 3.38Å; K32-G81 PolarHBondContact NZ-O 3.02Å; K32-P83 HydrophobicContact CG-CG 3.88Å |
| 33 | A | 89.8 | Confident | 90.7 | Very high | 57 Ų | 57 | 61.6 Ų | 61.6 | 47% | 0.471 | 31% | 0.312 | S | S | . | . | H | α-helix | trans | -72.8 | -43.9 | -176.4 | 0 | 0 | 0 | 0 | 0 | 110.7 | D31 A36 I37 | D31-A33 VanDerWaalsContact C-N 3.32Å; D31-A33 PolarHBondContact O-N 2.93Å; D31-A33 WeakPolarHBondContact OD1-CA 3.14Å; D31-A33 WeakPolarHBondContact OD1-CB 3.44Å; D31-A33 PolarHBondContact OD1-N 3.47Å; A33-A36 PolarHBondContact O-N 3.32Å; A33-I37 WeakPolarHBondContact O-CB 3.27Å; A33-I37 VanDerWaalsContact O-CG1 3.28Å; A33-I37 WeakPolarHBondContact O-CG1 3.33Å; A33-I37 PolarHBondContact O-N 3.45Å |
| 34 | L | 92.3 | Very high | 90.5 | Very high | 35 Ų | 35 | 57.4 Ų | 57.4 | 18% | 0.183 | 30% | 0.3 | C | S | . | . | H | α-helix | trans | -64.6 | -43.9 | 176.3 | -109.2 | 63 | 0 | 0 | 0 | 112.5 | F21 F24 L28 D31 A36 I37 G38 | F21-L34 HydrophobicContact CD1-CG 4.25Å; F24-L34 HydrophobicContact CB-CD2 4.37Å; F24-L34 HydrophobicContact CD1-CD2 3.26Å; F24-L34 HydrophobicContact CD1-CG 4.44Å; F24-L34 HydrophobicContact CE1-CD2 3.81Å; F24-L34 HydrophobicContact CG-CD2 4.14Å; L28-L34 HydrophobicContact CD1-CD2 3.87Å; D31-L34 HydrophobicContact CB-CB 4.21Å; D31-L34 PolarHBondContact O-N 2.9Å; D31-L34 PolarHBondContact OD1-N 3.24Å; L34-A36 VanDerWaalsContact C-N 3.35Å; L34-I37 PolarHBondContact O-N 3.02Å; L34-G38 PolarHBondContact O-N 3.41Å |
| 35 | L | 92.1 | Very high | 90.3 | Very high | 0 Ų | 0 | 53.3 Ų | 53.3 | 0% | 0 | 28% | 0.282 | C | S | . | . | H | α-helix | trans | -64.4 | -40.9 | 176.7 | -68 | 173.2 | 0 | 0 | 0 | 111.3 | L22 M26 F30 D31 G38 N39 V78 P83 M87 | L22-L35 HydrophobicContact CD2-CD2 3.91Å; L22-L35 WeakPolarHBondContact O-CD2 3.39Å; M26-L35 HydrophobicContact CG-CD2 4.09Å; F30-L35 HydrophobicContact CB-CD1 3.95Å; F30-L35 HydrophobicContact CD1-CD1 3.97Å; F30-L35 HydrophobicContact CG-CD1 4.45Å; D31-L35 WeakPolarHBondContact O-CB 3.29Å; D31-L35 WeakPolarHBondContact O-CG 3.38Å; D31-L35 PolarHBondContact O-N 3.49Å; L35-G38 PolarHBondContact O-N 3.3Å; L35-N39 WeakPolarHBondContact O-CB 3.21Å; L35-N39 PolarHBondContact O-N 3.32Å; L35-N39 PolarHBondContact O-ND2 3.06Å; L35-V78 HydrophobicContact CB-CG1 3.78Å; L35-P83 HydrophobicContact CD1-CB 3.42Å; L35-P83 VanDerWaalsContact CD1-CB 3.42Å; L35-P83 HydrophobicContact CD1-CG 4.47Å; L35-M87 HydrophobicContact CD2-CE 4.19Å; L35-M87 HydrophobicContact CD2-SD 4.06Å |
| 36 | A | 90.4 | Very high | 89.9 | Confident | 19 Ų | 19 | 54 Ų | 54 | 16% | 0.157 | 29% | 0.286 | C | S | . | . | H | α-helix | trans | -61.1 | -49.4 | 175.2 | 0 | 0 | 0 | 0 | 0 | 112.3 | K32 A33 L34 G38 N39 V40 L79 | K32-A36 WeakPolarHBondContact O-CB 3.15Å; K32-A36 PolarHBondContact O-N 2.91Å; A33-A36 PolarHBondContact O-N 3.32Å; L34-A36 VanDerWaalsContact C-N 3.35Å; A36-G38 VanDerWaalsContact C-N 3.32Å; A36-G38 PolarHBondContact O-N 2.82Å; A36-N39 PolarHBondContact O-N 3Å; A36-V40 WeakPolarHBondContact O-CG2 3.44Å; A36-V40 PolarHBondContact O-N 2.97Å; A36-L79 HydrophobicContact CB-CD2 3.53Å |
| 37 | I | 92.9 | Very high | 89.6 | Confident | 87 Ų | 87 | 51.7 Ų | 51.7 | 45% | 0.446 | 28% | 0.277 | S | S | . | . | H | α-helix | trans | -62 | -43.4 | 177.6 | -69.9 | 165.6 | 0 | 0 | 0 | 110.2 | F21 A33 L34 N39 V40 L41 | F21-I37 HydrophobicContact CD2-CG2 4.38Å; A33-I37 WeakPolarHBondContact O-CB 3.27Å; A33-I37 VanDerWaalsContact O-CG1 3.28Å; A33-I37 WeakPolarHBondContact O-CG1 3.33Å; A33-I37 PolarHBondContact O-N 3.45Å; L34-I37 PolarHBondContact O-N 3.02Å; I37-N39 PolarHBondContact O-N 2.85Å; I37-V40 PolarHBondContact O-N 3.07Å; I37-L41 HydrophobicContact CG2-CD1 3.68Å; I37-L41 HydrophobicContact CG2-CG 4.29Å; I37-L41 WeakPolarHBondContact O-CB 3.36Å; I37-L41 VanDerWaalsContact O-CG 3.3Å; I37-L41 WeakPolarHBondContact O-CG 3.49Å; I37-L41 PolarHBondContact O-N 2.94Å |
| 38 | G | 93.3 | Very high | 89.1 | Confident | 0 Ų | 0 | 51 Ų | 51 | 0% | 0 | 27% | 0.271 | C | S | . | . | H | α-helix | trans | -56.9 | -46.4 | 175.8 | 0 | 0 | 0 | 0 | 0 | 112.5 | G18 L34 L35 A36 L41 F42 | G18-G38 VanDerWaalsContact CA-O 3.29Å; G18-G38 WeakPolarHBondContact CA-O 3.48Å; G18-G38 WeakPolarHBondContact O-CA 3.43Å; L34-G38 PolarHBondContact O-N 3.41Å; L35-G38 PolarHBondContact O-N 3.3Å; A36-G38 VanDerWaalsContact C-N 3.32Å; A36-G38 PolarHBondContact O-N 2.82Å; G38-L41 PolarHBondContact O-N 2.83Å; G38-F42 WeakPolarHBondContact O-CB 3.34Å; G38-F42 PolarHBondContact O-N 3.18Å |
| 39 | N | 91.6 | Very high | 88.5 | Confident | 0 Ų | 0 | 49.3 Ų | 49.3 | 0% | 0 | 26% | 0.263 | C | S | . | . | H | α-helix | trans | -64.6 | -43.8 | 177.7 | -74 | -16.8 | 0 | 0 | 0 | 112.7 | L22 L35 A36 I37 F42 V43 V75 E90 | L22-N39 WeakPolarHBondContact CD1-OD1 3.42Å; L22-N39 WeakPolarHBondContact CD2-OD1 3.34Å; L35-N39 WeakPolarHBondContact O-CB 3.21Å; L35-N39 PolarHBondContact O-N 3.32Å; L35-N39 PolarHBondContact O-ND2 3.06Å; A36-N39 PolarHBondContact O-N 3Å; I37-N39 PolarHBondContact O-N 2.85Å; N39-F42 PolarHBondContact O-N 2.86Å; N39-V43 WeakPolarHBondContact O-CB 3.49Å; N39-V43 VanDerWaalsContact O-CG2 3.27Å; N39-V43 WeakPolarHBondContact O-CG2 2.9Å; N39-V43 PolarHBondContact O-N 3.39Å; N39-V75 HydrophobicContact CB-CG1 4.05Å; N39-V75 HydrophobicContact CB-CG2 4.27Å; N39-E90 VanDerWaalsContact CG-OE1 3.3Å; N39-E90 PolarHBondContact ND2-OE2 2.9Å; N39-E90 PolarHBondContact OD1-OE1 2.86Å; N39-E90 PolarHBondContact OD1-OE2 2.77Å |
| 40 | V | 90.8 | Very high | 87.9 | Confident | 88 Ų | 88 | 41.1 Ų | 41.1 | 53% | 0.533 | 23% | 0.228 | S | C | . | . | H | α-helix | trans | -61.3 | -47.9 | 177.2 | 173.1 | 0 | 0 | 0 | 0 | 110.8 | A36 I37 F42 A44 | A36-V40 WeakPolarHBondContact O-CG2 3.44Å; A36-V40 PolarHBondContact O-N 2.97Å; I37-V40 PolarHBondContact O-N 3.07Å; V40-F42 VanDerWaalsContact C-N 3.33Å; V40-F42 PolarHBondContact O-N 3.35Å; V40-A44 VanDerWaalsContact O-CB 3.26Å; V40-A44 WeakPolarHBondContact O-CB 3.43Å; V40-A44 PolarHBondContact O-N 2.91Å |
| 41 | L | 92.2 | Very high | 87.2 | Confident | 42 Ų | 42 | 39.1 Ų | 39.1 | 22% | 0.22 | 23% | 0.228 | C | C | . | . | H | α-helix | trans | -63.2 | -40.2 | 178.1 | -72 | 170.7 | 0 | 0 | 0 | 111.9 | L14 F17 F21 I37 G38 G45 | L14-L41 HydrophobicContact CD2-CD2 3.67Å; F17-L41 HydrophobicContact CB-CD1 4.37Å; F21-L41 HydrophobicContact CD2-CD1 3.5Å; F21-L41 VanDerWaalsContact CD2-CD1 3.5Å; F21-L41 HydrophobicContact CE2-CD1 3.81Å; I37-L41 HydrophobicContact CG2-CD1 3.68Å; I37-L41 HydrophobicContact CG2-CG 4.29Å; I37-L41 WeakPolarHBondContact O-CB 3.36Å; I37-L41 VanDerWaalsContact O-CG 3.3Å; I37-L41 WeakPolarHBondContact O-CG 3.49Å; I37-L41 PolarHBondContact O-N 2.94Å; G38-L41 PolarHBondContact O-N 2.83Å; L41-G45 PolarHBondContact O-N 3.43Å |
| 42 | F | 90.3 | Very high | 86.1 | Confident | 16 Ų | 16 | 41.3 Ų | 41.3 | 7% | 0.07 | 24% | 0.239 | C | C | . | . | H | α-helix | trans | -64.4 | -49.6 | 179.4 | -177.6 | -113.5 | 0 | 0 | 0 | 112.1 | T15 V19 L22 G38 N39 V40 G45 L46 F71 F94 | T15-F42 HydrophobicContact CG2-CD2 3.79Å; T15-F42 HydrophobicContact CG2-CE2 3.74Å; V19-F42 HydrophobicContact CG2-CD2 3.83Å; V19-F42 HydrophobicContact CG2-CE2 3.76Å; L22-F42 HydrophobicContact CD1-CB 4.29Å; L22-F42 HydrophobicContact CD1-CG 4.43Å; G38-F42 WeakPolarHBondContact O-CB 3.34Å; G38-F42 PolarHBondContact O-N 3.18Å; N39-F42 PolarHBondContact O-N 2.86Å; V40-F42 VanDerWaalsContact C-N 3.33Å; V40-F42 PolarHBondContact O-N 3.35Å; F42-G45 PolarHBondContact O-N 3.39Å; F42-L46 HydrophobicContact CD1-CD1 3.96Å; F42-L46 HydrophobicContact CE1-CD1 3.55Å; F42-L46 HydrophobicContact CE1-CG 4.47Å; F42-L46 HydrophobicContact CE2-CD1 4.34Å; F42-L46 HydrophobicContact CE2-CG 4.46Å; F42-L46 HydrophobicContact CZ-CD1 3.79Å; F42-L46 HydrophobicContact CZ-CG 4.37Å; F42-L46 WeakPolarHBondContact O-CG 3.5Å; F42-L46 PolarHBondContact O-N 2.97Å; F42-F71 HydrophobicContact CD1-CE2 4.35Å; F42-F71 AromaticContact CD1-CZ 3.95Å; F42-F71 HydrophobicContact CD1-CZ 3.95Å; F42-F71 AromaticContact CE1-CE2 3.99Å; F42-F71 HydrophobicContact CE1-CE2 3.99Å; F42-F71 AromaticContact CE1-CZ 3.87Å; F42-F71 HydrophobicContact CE1-CZ 3.87Å; F42-F94 AromaticContact CE1-CD2 3.67Å; F42-F94 HydrophobicContact CE1-CD2 3.67Å; F42-F94 AromaticContact CE1-CE2 3.54Å; F42-F94 HydrophobicContact CE1-CE2 3.54Å; F42-F94 HydrophobicContact CE1-CZ 4.41Å; F42-F94 HydrophobicContact CE2-CE2 4.42Å; F42-F94 AromaticContact CZ-CD2 3.79Å; F42-F94 HydrophobicContact CZ-CD2 3.79Å; F42-F94 AromaticContact CZ-CE2 3.22Å; F42-F94 HydrophobicContact CZ-CE2 3.22Å; F42-F94 AromaticContact CZ-CZ 3.69Å; F42-F94 HydrophobicContact CZ-CZ 3.69Å |
| 43 | V | 86.8 | Confident | 84.8 | Confident | 46 Ų | 46 | 42.2 Ų | 42.2 | 28% | 0.279 | 25% | 0.245 | S | C | . | . | H | α-helix | trans | -63.4 | -44.7 | 178.3 | 174.8 | 0 | 0 | 0 | 0 | 111 | N39 L46 A47 F71 V75 | N39-V43 WeakPolarHBondContact O-CB 3.49Å; N39-V43 VanDerWaalsContact O-CG2 3.27Å; N39-V43 WeakPolarHBondContact O-CG2 2.9Å; N39-V43 PolarHBondContact O-N 3.39Å; V43-L46 PolarHBondContact O-N 2.94Å; V43-A47 PolarHBondContact O-N 2.9Å; V43-F71 HydrophobicContact CG2-CE1 3.77Å; V43-F71 HydrophobicContact CG2-CZ 3.85Å; V43-V75 HydrophobicContact CG2-CG2 4.41Å |
| 44 | A | 88 | Confident | 83.5 | Confident | 33 Ų | 33 | 48.7 Ų | 48.7 | 27% | 0.273 | 26% | 0.257 | S | S | . | . | H | α-helix | trans | -62.3 | -43.7 | 176.4 | 0 | 0 | 0 | 0 | 0 | 111.7 | L14 V40 A47 F48 | L14-A44 HydrophobicContact CD2-CB 4.13Å; V40-A44 VanDerWaalsContact O-CB 3.26Å; V40-A44 WeakPolarHBondContact O-CB 3.43Å; V40-A44 PolarHBondContact O-N 2.91Å; A44-A47 PolarHBondContact O-N 3.43Å; A44-F48 WeakPolarHBondContact O-CD2 3.21Å; A44-F48 PolarHBondContact O-N 3.49Å; A44-F48 VanDerWaalsContact O-N 3.09Å |
| 45 | G | 87.5 | Confident | 82.3 | Confident | 0 Ų | 0 | 47.7 Ų | 47.7 | 0% | 0 | 25% | 0.253 | C | S | . | . | H | α-helix | trans | -60.8 | -47 | 176.5 | 0 | 0 | 0 | 0 | 0 | 112.4 | G11 T15 L41 F42 A47 F48 V49 | G11-G45 WeakPolarHBondContact O-CA 3.5Å; T15-G45 VanDerWaalsContact OG1-CA 3.3Å; T15-G45 WeakPolarHBondContact OG1-CA 3.42Å; L41-G45 PolarHBondContact O-N 3.43Å; F42-G45 PolarHBondContact O-N 3.39Å; G45-A47 VanDerWaalsContact C-N 3.29Å; G45-A47 PolarHBondContact O-N 3.03Å; G45-F48 PolarHBondContact O-N 2.95Å; G45-F48 VanDerWaalsContact O-N 3.1Å; G45-V49 WeakPolarHBondContact O-CG2 3.44Å; G45-V49 PolarHBondContact O-N 2.67Å |
| 46 | L | 84.3 | Confident | 80.9 | Confident | 15 Ų | 15 | 53.9 Ų | 53.9 | 8% | 0.079 | 28% | 0.28 | C | S | . | . | H | α-helix | trans | -58 | -42.5 | 176.2 | -76.2 | 174.6 | 0 | 0 | 0 | 111.9 | T15 F42 V43 F48 V49 I50 F94 F98 | T15-L46 HydrophobicContact CG2-CD2 4.47Å; T15-L46 PolarHBondContact OG1-N 3.47Å; F42-L46 HydrophobicContact CD1-CD1 3.96Å; F42-L46 HydrophobicContact CE1-CD1 3.55Å; F42-L46 HydrophobicContact CE1-CG 4.47Å; F42-L46 HydrophobicContact CE2-CD1 4.34Å; F42-L46 HydrophobicContact CE2-CG 4.46Å; F42-L46 HydrophobicContact CZ-CD1 3.79Å; F42-L46 HydrophobicContact CZ-CG 4.37Å; F42-L46 WeakPolarHBondContact O-CG 3.5Å; F42-L46 PolarHBondContact O-N 2.97Å; V43-L46 PolarHBondContact O-N 2.94Å; L46-F48 VanDerWaalsContact C-N 3.3Å; L46-F48 PolarHBondContact O-N 3.37Å; L46-V49 PolarHBondContact O-N 3.42Å; L46-I50 WeakPolarHBondContact O-CB 3.45Å; L46-I50 WeakPolarHBondContact O-CG1 3.33Å; L46-I50 PolarHBondContact O-N 3.42Å; L46-F94 HydrophobicContact CD1-CE2 4.02Å; L46-F98 HydrophobicContact CD1-CE2 4.15Å; L46-F98 HydrophobicContact CD1-CZ 3.91Å; L46-F98 HydrophobicContact CD2-CE1 4.24Å; L46-F98 HydrophobicContact CD2-CZ 3.72Å; L46-F98 HydrophobicContact CG-CZ 4.41Å |
| 47 | A | 83.7 | Confident | 79.8 | Confident | 18 Ų | 18 | 61.7 Ų | 61.7 | 15% | 0.149 | 31% | 0.305 | C | S | . | . | H | α-helix | trans | -61.9 | -37.8 | 177.4 | 0 | 0 | 0 | 0 | 0 | 112.4 | V43 A44 G45 G51 L52 T55 | V43-A47 PolarHBondContact O-N 2.9Å; A44-A47 PolarHBondContact O-N 3.43Å; G45-A47 VanDerWaalsContact C-N 3.29Å; G45-A47 PolarHBondContact O-N 3.03Å; A47-G51 CarbonylContact O-C 3.08Å; A47-G51 WeakPolarHBondContact O-CA 3.16Å; A47-G51 PolarHBondContact O-N 3.23Å; A47-L52 HydrophobicContact CB-CD1 4.22Å; A47-L52 PolarHBondContact O-N 3.02Å; A47-T55 HydrophobicContact CB-CG2 4.32Å |
| 48 | F | 82.6 | Confident | 78.5 | Confident | 84 Ų | 84 | 58.7 Ų | 58.7 | 37% | 0.368 | 29% | 0.289 | S | S | . | . | H | α-helix | trans | -76.8 | -33.3 | 176.6 | -75.1 | -55.4 | 0 | 0 | 0 | 113.9 | T7 G11 L14 A44 G45 L46 | T7-F48 HydrophobicContact CG2-CB 4.27Å; T7-F48 HydrophobicContact CG2-CD1 3.4Å; T7-F48 HydrophobicContact CG2-CE1 4.1Å; T7-F48 HydrophobicContact CG2-CG 4.2Å; G11-F48 VanDerWaalsContact CA-CB 3.49Å; L14-F48 HydrophobicContact CD1-CD2 4.19Å; L14-F48 HydrophobicContact CD1-CE2 4.49Å; A44-F48 WeakPolarHBondContact O-CD2 3.21Å; A44-F48 PolarHBondContact O-N 3.49Å; A44-F48 VanDerWaalsContact O-N 3.09Å; G45-F48 PolarHBondContact O-N 2.95Å; G45-F48 VanDerWaalsContact O-N 3.1Å; L46-F48 VanDerWaalsContact C-N 3.3Å; L46-F48 PolarHBondContact O-N 3.37Å |
| 49 | V | 79.3 | Confident | 77.2 | Confident | 46 Ų | 46 | 59.6 Ų | 59.6 | 28% | 0.279 | 29% | 0.293 | S | S | . | . | H | α-helix | trans | -69.7 | -46.5 | 176.8 | 172.8 | 0 | 0 | 0 | 0 | 111.5 | Q8 M12 G45 L46 | Q8-V49 PolarHBondContact NE2-O 3Å; M12-V49 HydrophobicContact CB-CG2 4.49Å; M12-V49 HydrophobicContact CG-CG2 3.9Å; G45-V49 WeakPolarHBondContact O-CG2 3.44Å; G45-V49 PolarHBondContact O-N 2.67Å; L46-V49 PolarHBondContact O-N 3.42Å |
| 50 | I | 74.9 | Confident | 75.8 | Confident | 26 Ų | 26 | 65.5 Ų | 65.5 | 13% | 0.133 | 32% | 0.319 | C | S | . | . | H | α-helix | trans | -81.2 | -28.1 | -178 | -61.1 | 169.1 | 0 | 0 | 0 | 110.9 | L46 R54 T55 F98 F101 | L46-I50 WeakPolarHBondContact O-CB 3.45Å; L46-I50 WeakPolarHBondContact O-CG1 3.33Å; L46-I50 PolarHBondContact O-N 3.42Å; I50-R54 HydrophobicContact CG2-CB 4.01Å; I50-T55 WeakPolarHBondContact CB-OG1 3.47Å; I50-F98 HydrophobicContact CD1-CE1 4.21Å; I50-F98 HydrophobicContact CD1-CZ 4.29Å; I50-F101 HydrophobicContact CG1-CE1 4.41Å; I50-F101 HydrophobicContact CG2-CZ 4.43Å |
| 51 | G | 71.2 | Confident | 74.6 | Confident | 28 Ų | 28 | 66.4 Ų | 66.4 | 29% | 0.289 | 32% | 0.317 | S | S | . | . | trans | 95 | 135.2 | -173.2 | 0 | 0 | 0 | 0 | 0 | 111.1 | A47 E53 R54 T55 | A47-G51 CarbonylContact O-C 3.08Å; A47-G51 WeakPolarHBondContact O-CA 3.16Å; A47-G51 PolarHBondContact O-N 3.23Å; G51-E53 VanDerWaalsContact C-N 3.33Å; G51-E53 PolarHBondContact O-N 3.47Å; G51-R54 PolarHBondContact O-N 2.76Å; G51-R54 VanDerWaalsContact O-N 3.16Å; G51-T55 WeakPolarHBondContact O-CB 3.43Å; G51-T55 PolarHBondContact O-N 3.05Å; G51-T55 PolarHBondContact O-OG1 3.4Å | ||
| 52 | L | 66.9 | Low | 73 | Confident | 109 Ų | 109 | 74 Ų | 74 | 57% | 0.571 | 35% | 0.349 | S | S | * | . | H | α-helix | trans | -54.4 | -46.6 | -170.1 | -146.2 | 89.8 | 0 | 0 | 0 | 112.6 | A47 T55 F56 | A47-L52 HydrophobicContact CB-CD1 4.22Å; A47-L52 PolarHBondContact O-N 3.02Å; L52-T55 PolarHBondContact O-N 3.22Å; L52-F56 WeakPolarHBondContact O-CD2 3.49Å; L52-F56 PolarHBondContact O-N 2.67Å |
| 53 | E | 59.7 | Low | 71.8 | Confident | 138 Ų | 138 | 81.8 Ų | 81.8 | 65% | 0.645 | 39% | 0.385 | S | S | * | . | H | α-helix | trans | -68.5 | -38.7 | -177.5 | -161.4 | -174.5 | 160.3 | 0 | 0 | 112.6 | G51 R57 | G51-E53 VanDerWaalsContact C-N 3.33Å; G51-E53 PolarHBondContact O-N 3.47Å; E53-R57 PolarHBondContact O-N 3.06Å; E53-R57 VanDerWaalsContact O-N 3.12Å; E53-R57 IonicContact OE1-NH2 3.5Å |
| 54 | R | 64 | Low | 70.9 | Confident | 193 Ų | 193 | 81.2 Ų | 81.2 | 73% | 0.728 | 38% | 0.378 | S | S | * | . | H | α-helix | trans | -74.4 | -35.3 | 176.2 | -69.2 | -172.3 | -177.4 | -160 | 1.3 | 111.7 | I50 G51 R57 F58 | I50-R54 HydrophobicContact CG2-CB 4.01Å; G51-R54 PolarHBondContact O-N 2.76Å; G51-R54 VanDerWaalsContact O-N 3.16Å; R54-R57 PolarHBondContact O-N 2.97Å; R54-F58 WeakPolarHBondContact O-CB 3.42Å; R54-F58 PolarHBondContact O-N 3.37Å |
| 55 | T | 66.2 | Low | 70.1 | Confident | 14 Ų | 14 | 83.3 Ų | 83.3 | 9% | 0.086 | 38% | 0.384 | C | S | . | . | H | α-helix | trans | -64.7 | -45.7 | 175.8 | -52.8 | 0 | 0 | 0 | 0 | 110.1 | A47 I50 G51 L52 F58 F59 | A47-T55 HydrophobicContact CB-CG2 4.32Å; I50-T55 WeakPolarHBondContact CB-OG1 3.47Å; G51-T55 WeakPolarHBondContact O-CB 3.43Å; G51-T55 PolarHBondContact O-N 3.05Å; G51-T55 PolarHBondContact O-OG1 3.4Å; L52-T55 PolarHBondContact O-N 3.22Å; T55-F58 PolarHBondContact O-N 2.94Å; T55-F59 HydrophobicContact CG2-CD2 3.94Å; T55-F59 HydrophobicContact CG2-CE2 4.25Å; T55-F59 VanDerWaalsContact O-CB 3.29Å; T55-F59 WeakPolarHBondContact O-CB 3.43Å; T55-F59 PolarHBondContact O-N 3.39Å |
| 56 | F | 63.5 | Low | 69.6 | Low | 130 Ų | 130 | 91.7 Ų | 91.7 | 57% | 0.57 | 42% | 0.42 | S | S | * | . | H | α-helix | trans | -60.5 | -47.6 | 174.5 | -99 | -84.4 | 0 | 0 | 0 | 111.8 | L52 F58 F59 F60 | L52-F56 WeakPolarHBondContact O-CD2 3.49Å; L52-F56 PolarHBondContact O-N 2.67Å; F56-F58 VanDerWaalsContact C-N 3.3Å; F56-F58 PolarHBondContact O-N 3.22Å; F56-F59 PolarHBondContact O-N 3.06Å; F56-F60 HydrophobicContact CD1-CD2 4.17Å; F56-F60 HydrophobicContact CD1-CE2 4.37Å; F56-F60 HydrophobicContact CE1-CE2 4.38Å; F56-F60 VanDerWaalsContact O-CB 3.3Å; F56-F60 WeakPolarHBondContact O-CB 3.41Å; F56-F60 PolarHBondContact O-N 3.28Å |
| 57 | R | 66.2 | Low | 69.5 | Low | 182 Ų | 182 | 91.1 Ų | 91.1 | 69% | 0.687 | 42% | 0.417 | S | S | * | . | H | α-helix | trans | -64.4 | -32.6 | 175.7 | -75.3 | -172.5 | -172.8 | 176.4 | 8.5 | 113.4 | E53 R54 Q61 | E53-R57 PolarHBondContact O-N 3.06Å; E53-R57 VanDerWaalsContact O-N 3.12Å; E53-R57 IonicContact OE1-NH2 3.5Å; R54-R57 PolarHBondContact O-N 2.97Å; R57-Q61 PolarHBondContact O-N 3.4Å |
| 58 | F | 65.9 | Low | 69.3 | Low | 24 Ų | 24 | 90.5 Ų | 90.5 | 11% | 0.105 | 41% | 0.412 | C | S | . | . | H | α-helix | trans | -75.6 | -40.5 | 179.3 | -171.4 | -108.6 | 0 | 0 | 0 | 112.1 | R54 T55 F56 L97 F101 | R54-F58 WeakPolarHBondContact O-CB 3.42Å; R54-F58 PolarHBondContact O-N 3.37Å; T55-F58 PolarHBondContact O-N 2.94Å; F56-F58 VanDerWaalsContact C-N 3.3Å; F56-F58 PolarHBondContact O-N 3.22Å; F58-L97 HydrophobicContact CD1-CD2 3.67Å; F58-L97 HydrophobicContact CE1-CD2 3.41Å; F58-L97 VanDerWaalsContact CE1-CD2 3.41Å; F58-L97 HydrophobicContact CZ-CD2 4.42Å; F58-F101 HydrophobicContact CD2-CD2 4.01Å; F58-F101 AromaticContact CD2-CE2 3.68Å; F58-F101 HydrophobicContact CD2-CE2 3.68Å; F58-F101 AromaticContact CE1-CD2 3.96Å; F58-F101 HydrophobicContact CE1-CD2 3.96Å; F58-F101 HydrophobicContact CE1-CE2 4.26Å; F58-F101 HydrophobicContact CE1-CG 4.45Å; F58-F101 AromaticContact CE2-CD2 3.19Å; F58-F101 HydrophobicContact CE2-CD2 3.19Å; F58-F101 AromaticContact CE2-CE2 3.35Å; F58-F101 HydrophobicContact CE2-CE2 3.35Å; F58-F101 HydrophobicContact CE2-CG 4.32Å; F58-F101 HydrophobicContact CG-CE2 4.3Å; F58-F101 HydrophobicContact CZ-CB 4.14Å; F58-F101 AromaticContact CZ-CD2 3.16Å; F58-F101 HydrophobicContact CZ-CD2 3.16Å; F58-F101 AromaticContact CZ-CE2 3.68Å; F58-F101 HydrophobicContact CZ-CE2 3.68Å; F58-F101 AromaticContact CZ-CG 3.88Å; F58-F101 HydrophobicContact CZ-CG 3.88Å |
| 59 | F | 65.6 | Low | 69.3 | Low | 19 Ų | 19 | 88.7 Ų | 88.7 | 8% | 0.083 | 42% | 0.416 | C | S | . | . | H | α-helix | trans | -70.9 | -38 | 174.5 | -97.3 | -117.3 | 0 | 0 | 0 | 112.1 | T55 F56 T68 F71 L72 L97 | T55-F59 HydrophobicContact CG2-CD2 3.94Å; T55-F59 HydrophobicContact CG2-CE2 4.25Å; T55-F59 VanDerWaalsContact O-CB 3.29Å; T55-F59 WeakPolarHBondContact O-CB 3.43Å; T55-F59 PolarHBondContact O-N 3.39Å; F56-F59 PolarHBondContact O-N 3.06Å; F59-T68 HydrophobicContact CB-CG2 4.14Å; F59-T68 HydrophobicContact CD1-CG2 3.32Å; F59-T68 HydrophobicContact CE1-CG2 4Å; F59-T68 HydrophobicContact CG-CG2 4.09Å; F59-T68 WeakPolarHBondContact O-CB 3.43Å; F59-T68 PolarHBondContact O-OG1 3.02Å; F59-F71 AromaticContact CE1-CD1 3.74Å; F59-F71 HydrophobicContact CE1-CD1 3.74Å; F59-F71 HydrophobicContact CE1-CE1 4.13Å; F59-F71 AromaticContact CZ-CD1 3.7Å; F59-F71 HydrophobicContact CZ-CD1 3.7Å; F59-F71 AromaticContact CZ-CE1 3.8Å; F59-F71 HydrophobicContact CZ-CE1 3.8Å; F59-L72 HydrophobicContact CD1-CD1 4.3Å; F59-L72 HydrophobicContact CE1-CD1 4.39Å; F59-L72 HydrophobicContact CE1-CG 4.25Å; F59-L97 HydrophobicContact CD1-CD1 4.34Å; F59-L97 HydrophobicContact CD2-CD1 4.39Å; F59-L97 HydrophobicContact CD2-CD2 3.9Å; F59-L97 HydrophobicContact CE1-CD1 3.82Å; F59-L97 HydrophobicContact CE2-CD1 3.9Å; F59-L97 HydrophobicContact CE2-CD2 3.66Å; F59-L97 HydrophobicContact CE2-CG 4.45Å; F59-L97 HydrophobicContact CZ-CD1 3.57Å; F59-L97 HydrophobicContact CZ-CD2 4.21Å |
| 60 | F | 61.9 | Low | 69.6 | Low | 125 Ų | 125 | 90.5 Ų | 90.5 | 55% | 0.548 | 42% | 0.421 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -95.5 | 15 | -177.7 | -85.9 | -94.6 | 0 | 0 | 0 | 115 | F56 K62 M65 | F56-F60 HydrophobicContact CD1-CD2 4.17Å; F56-F60 HydrophobicContact CD1-CE2 4.37Å; F56-F60 HydrophobicContact CE1-CE2 4.38Å; F56-F60 VanDerWaalsContact O-CB 3.3Å; F56-F60 WeakPolarHBondContact O-CB 3.41Å; F56-F60 PolarHBondContact O-N 3.28Å; F60-K62 PolarHBondContact O-N 3.43Å; F60-M65 VanDerWaalsContact CA-SD 3.57Å; F60-M65 HydrophobicContact CB-SD 4.29Å; F60-M65 HydrophobicContact CD1-CE 3.81Å; F60-M65 HydrophobicContact CD1-SD 3.85Å; F60-M65 HydrophobicContact CE1-CE 3.92Å; F60-M65 HydrophobicContact CG-SD 4.25Å |
| 61 | Q | 65.6 | Low | 70.2 | Confident | 107 Ų | 107 | 89.3 Ų | 89.3 | 50% | 0.5 | 42% | 0.415 | S | S | . | . | trans | -69.7 | 127.9 | 174.2 | -146.3 | 171.3 | 10.3 | 0 | 0 | 109.6 | R57 H63 K64 M65 | R57-Q61 PolarHBondContact O-N 3.4Å; Q61-H63 PolarHBondContact O-N 2.95Å; Q61-K64 HydrophobicContact CB-CB 4.21Å; Q61-K64 HydrophobicContact CB-CG 4.3Å; Q61-K64 CarbonylContact O-C 3.57Å; Q61-K64 WeakPolarHBondContact O-CA 3.32Å; Q61-K64 PolarHBondContact O-N 3.23Å; Q61-M65 WeakPolarHBondContact O-CG 3.32Å; Q61-M65 PolarHBondContact O-N 3.47Å | ||
| 62 | K | 59.9 | Low | 70.9 | Confident | 202 Ų | 202 | 91.8 Ų | 91.8 | 88% | 0.878 | 42% | 0.421 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -49.3 | -34.8 | -175.8 | -72.2 | -172.2 | 177.1 | -177.8 | 0 | 113.9 | F60 K64 | F60-K62 PolarHBondContact O-N 3.43Å; K62-K64 VanDerWaalsContact C-N 3.33Å |
| 63 | H | 64.5 | Low | 72 | Confident | 179 Ų | 179 | 88 Ų | 88 | 83% | 0.829 | 41% | 0.408 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -77.4 | -16.2 | 179.3 | -158.6 | -65.5 | 0 | 0 | 0 | 114 | Q61 | Q61-H63 PolarHBondContact O-N 2.95Š|
| 64 | K | 67.8 | Low | 73.3 | Confident | 34 Ų | 34 | 81.4 Ų | 81.4 | 15% | 0.148 | 38% | 0.378 | C | S | . | . | T | Hydrogen-bonded Turn | trans | -110 | -9.6 | -176.9 | -67.1 | -82.6 | -175.2 | 169.3 | 0 | 113.2 | Q61 K62 K66 A67 T68 L97 | Q61-K64 HydrophobicContact CB-CB 4.21Å; Q61-K64 HydrophobicContact CB-CG 4.3Å; Q61-K64 CarbonylContact O-C 3.57Å; Q61-K64 WeakPolarHBondContact O-CA 3.32Å; Q61-K64 PolarHBondContact O-N 3.23Å; K62-K64 VanDerWaalsContact C-N 3.33Å; K64-K66 VanDerWaalsContact C-N 3.26Å; K64-K66 PolarHBondContact O-N 3.38Å; K64-K66 VanDerWaalsContact O-N 3.14Å; K64-A67 WeakPolarHBondContact O-CA 3.41Å; K64-A67 WeakPolarHBondContact O-CB 3.46Å; K64-A67 PolarHBondContact O-N 2.9Å; K64-T68 PolarHBondContact O-N 2.99Å; K64-T68 PolarHBondContact O-OG1 2.99Å; K64-L97 PolarHBondContact NZ-O 2.73Å |
| 65 | M | 70.2 | Confident | 74.4 | Confident | 77 Ų | 77 | 72.9 Ų | 72.9 | 38% | 0.379 | 35% | 0.347 | S | S | . | . | H | α-helix | trans | -51.5 | -38.9 | -178.2 | -69.4 | -61.1 | -69 | 0 | 0 | 114.3 | F60 Q61 A67 T68 G69 | F60-M65 VanDerWaalsContact CA-SD 3.57Å; F60-M65 HydrophobicContact CB-SD 4.29Å; F60-M65 HydrophobicContact CD1-CE 3.81Å; F60-M65 HydrophobicContact CD1-SD 3.85Å; F60-M65 HydrophobicContact CE1-CE 3.92Å; F60-M65 HydrophobicContact CG-SD 4.25Å; Q61-M65 WeakPolarHBondContact O-CG 3.32Å; Q61-M65 PolarHBondContact O-N 3.47Å; M65-A67 VanDerWaalsContact C-N 3.34Å; M65-A67 PolarHBondContact O-N 2.84Å; M65-T68 PolarHBondContact O-N 3.46Å; M65-G69 PolarHBondContact O-N 3.43Å |
| 66 | K | 77.5 | Confident | 75.5 | Confident | 175 Ų | 175 | 78.5 Ų | 78.5 | 76% | 0.761 | 37% | 0.37 | S | S | * | . | H | α-helix | trans | -63.5 | -40.7 | 177.2 | -66.9 | -175.2 | 179.8 | -177.3 | 0 | 111.7 | K64 G69 F70 | K64-K66 VanDerWaalsContact C-N 3.26Å; K64-K66 PolarHBondContact O-N 3.38Å; K64-K66 VanDerWaalsContact O-N 3.14Å; K66-G69 PolarHBondContact O-N 3.33Å; K66-F70 WeakPolarHBondContact O-CD2 3.46Å; K66-F70 PolarHBondContact O-N 3.4Å; K66-F70 VanDerWaalsContact O-N 3.15Å |
| 67 | A | 81.6 | Confident | 76.7 | Confident | 3 Ų | 3 | 74.3 Ų | 74.3 | 3% | 0.025 | 36% | 0.355 | C | S | . | . | H | α-helix | trans | -67.7 | -44.3 | 177.9 | 0 | 0 | 0 | 0 | 0 | 111.6 | K64 M65 G69 F70 F71 L96 L97 | K64-A67 WeakPolarHBondContact O-CA 3.41Å; K64-A67 WeakPolarHBondContact O-CB 3.46Å; K64-A67 PolarHBondContact O-N 2.9Å; M65-A67 VanDerWaalsContact C-N 3.34Å; M65-A67 PolarHBondContact O-N 2.84Å; A67-G69 VanDerWaalsContact C-N 3.31Å; A67-G69 PolarHBondContact O-N 3.14Å; A67-F70 PolarHBondContact O-N 3.01Å; A67-F71 WeakPolarHBondContact O-CB 3.41Å; A67-F71 PolarHBondContact O-N 2.93Å; A67-L96 HydrophobicContact CB-CB 3.75Å; A67-L96 HydrophobicContact CB-CD2 3.8Å; A67-L96 HydrophobicContact CB-CG 3.7Å; A67-L97 HydrophobicContact CB-CB 4.11Å; A67-L97 HydrophobicContact CB-CG 4.22Å |
| 68 | T | 81 | Confident | 77.7 | Confident | 6 Ų | 6 | 65.7 Ų | 65.7 | 4% | 0.037 | 32% | 0.323 | C | S | . | . | H | α-helix | trans | -58.1 | -43.5 | 174.5 | -61.2 | 0 | 0 | 0 | 0 | 112 | F59 K64 M65 F71 L72 | F59-T68 HydrophobicContact CB-CG2 4.14Å; F59-T68 HydrophobicContact CD1-CG2 3.32Å; F59-T68 HydrophobicContact CE1-CG2 4Å; F59-T68 HydrophobicContact CG-CG2 4.09Å; F59-T68 WeakPolarHBondContact O-CB 3.43Å; F59-T68 PolarHBondContact O-OG1 3.02Å; K64-T68 PolarHBondContact O-N 2.99Å; K64-T68 PolarHBondContact O-OG1 2.99Å; M65-T68 PolarHBondContact O-N 3.46Å; T68-F71 PolarHBondContact O-N 3.45Å; T68-L72 HydrophobicContact CG2-CD1 3.79Å; T68-L72 HydrophobicContact CG2-CG 4.5Å; T68-L72 WeakPolarHBondContact O-CB 3.47Å; T68-L72 PolarHBondContact O-N 2.96Å |
| 69 | G | 82.7 | Confident | 78.5 | Confident | 45 Ų | 45 | 68.9 Ų | 68.9 | 46% | 0.464 | 34% | 0.341 | S | S | . | . | H | α-helix | trans | -61.7 | -43.5 | 176.3 | 0 | 0 | 0 | 0 | 0 | 112.9 | M65 K66 A67 G73 | M65-G69 PolarHBondContact O-N 3.43Å; K66-G69 PolarHBondContact O-N 3.33Å; A67-G69 VanDerWaalsContact C-N 3.31Å; A67-G69 PolarHBondContact O-N 3.14Å; G69-G73 VanDerWaalsContact O-CA 3.29Å; G69-G73 WeakPolarHBondContact O-CA 3.25Å; G69-G73 PolarHBondContact O-N 3.37Å |
| 70 | F | 85.6 | Confident | 79.4 | Confident | 84 Ų | 84 | 73.1 Ų | 73.1 | 37% | 0.368 | 36% | 0.363 | S | S | . | . | H | α-helix | trans | -67.8 | -37.5 | 176.3 | -78.2 | -62.7 | 0 | 0 | 0 | 113.1 | K66 A67 G74 F89 Y92 | K66-F70 WeakPolarHBondContact O-CD2 3.46Å; K66-F70 PolarHBondContact O-N 3.4Å; K66-F70 VanDerWaalsContact O-N 3.15Å; A67-F70 PolarHBondContact O-N 3.01Å; F70-G74 PolarHBondContact O-N 2.84Å; F70-F89 AromaticContact CD1-CD1 3.63Å; F70-F89 HydrophobicContact CD1-CD1 3.63Å; F70-F89 AromaticContact CD1-CE1 3.94Å; F70-F89 HydrophobicContact CD1-CE1 3.94Å; F70-F89 HydrophobicContact CE1-CD1 4.07Å; F70-F89 AromaticContact CE1-CE1 3.89Å; F70-F89 HydrophobicContact CE1-CE1 3.89Å; F70-Y92 HydrophobicContact CB-CD1 4.44Å; F70-Y92 HydrophobicContact CD2-CD1 4.32Å; F70-Y92 HydrophobicContact CD2-CE1 4.11Å; F70-Y92 HydrophobicContact CE2-CE1 4.3Å; F70-Y92 HydrophobicContact CG-CD1 4.23Å; F70-Y92 HydrophobicContact CG-CE1 4.46Å |
| 71 | F | 86.6 | Confident | 80.4 | Confident | 2 Ų | 2 | 67.8 Ų | 67.8 | 1% | 0.009 | 34% | 0.343 | C | S | . | . | H | α-helix | trans | -69.6 | -54.8 | 178.4 | 178.5 | -105.1 | 0 | 0 | 0 | 111.9 | F42 V43 F59 A67 T68 G73 G74 V75 E90 F94 L97 | F42-F71 HydrophobicContact CD1-CE2 4.35Å; F42-F71 AromaticContact CD1-CZ 3.95Å; F42-F71 HydrophobicContact CD1-CZ 3.95Å; F42-F71 AromaticContact CE1-CE2 3.99Å; F42-F71 HydrophobicContact CE1-CE2 3.99Å; F42-F71 AromaticContact CE1-CZ 3.87Å; F42-F71 HydrophobicContact CE1-CZ 3.87Å; V43-F71 HydrophobicContact CG2-CE1 3.77Å; V43-F71 HydrophobicContact CG2-CZ 3.85Å; F59-F71 AromaticContact CE1-CD1 3.74Å; F59-F71 HydrophobicContact CE1-CD1 3.74Å; F59-F71 HydrophobicContact CE1-CE1 4.13Å; F59-F71 AromaticContact CZ-CD1 3.7Å; F59-F71 HydrophobicContact CZ-CD1 3.7Å; F59-F71 AromaticContact CZ-CE1 3.8Å; F59-F71 HydrophobicContact CZ-CE1 3.8Å; A67-F71 WeakPolarHBondContact O-CB 3.41Å; A67-F71 PolarHBondContact O-N 2.93Å; T68-F71 PolarHBondContact O-N 3.45Å; F71-G73 VanDerWaalsContact C-N 3.3Å; F71-G73 PolarHBondContact O-N 3.44Å; F71-G74 PolarHBondContact O-N 2.92Å; F71-V75 HydrophobicContact CZ-CG2 4.48Å; F71-V75 WeakPolarHBondContact O-CG2 3.5Å; F71-V75 PolarHBondContact O-N 3.24Å; F71-E90 HydrophobicContact CD2-CG 3.95Å; F71-E90 HydrophobicContact CE2-CG 4.05Å; F71-F94 HydrophobicContact CD2-CB 3.86Å; F71-F94 HydrophobicContact CD2-CD2 4.35Å; F71-F94 HydrophobicContact CE2-CB 4.1Å; F71-F94 AromaticContact CE2-CD2 3.92Å; F71-F94 HydrophobicContact CE2-CD2 3.92Å; F71-F94 HydrophobicContact CE2-CG 4.47Å; F71-L97 HydrophobicContact CB-CD1 4.1Å; F71-L97 HydrophobicContact CD1-CD1 4.41Å; F71-L97 HydrophobicContact CG-CD1 4.41Å |
| 72 | L | 86.4 | Confident | 81.5 | Confident | 79 Ų | 79 | 70.6 Ų | 70.6 | 41% | 0.414 | 35% | 0.349 | S | S | . | . | H | α-helix | trans | -65.6 | -35.1 | 177.1 | -75.6 | 170.7 | 0 | 0 | 0 | 112.1 | F59 T68 V75 F76 | F59-L72 HydrophobicContact CD1-CD1 4.3Å; F59-L72 HydrophobicContact CE1-CD1 4.39Å; F59-L72 HydrophobicContact CE1-CG 4.25Å; T68-L72 HydrophobicContact CG2-CD1 3.79Å; T68-L72 HydrophobicContact CG2-CG 4.5Å; T68-L72 WeakPolarHBondContact O-CB 3.47Å; T68-L72 PolarHBondContact O-N 2.96Å; L72-V75 PolarHBondContact O-N 2.92Å; L72-F76 WeakPolarHBondContact O-CB 3.47Å; L72-F76 PolarHBondContact O-N 3.39Å |
| 73 | G | 88.9 | Confident | 82.7 | Confident | 30 Ų | 30 | 61.7 Ų | 61.7 | 31% | 0.309 | 31% | 0.312 | S | S | . | . | H | α-helix | trans | -62 | -44.4 | 172.3 | 0 | 0 | 0 | 0 | 0 | 111.6 | G69 F71 F76 V77 | G69-G73 VanDerWaalsContact O-CA 3.29Å; G69-G73 WeakPolarHBondContact O-CA 3.25Å; G69-G73 PolarHBondContact O-N 3.37Å; F71-G73 VanDerWaalsContact C-N 3.3Å; F71-G73 PolarHBondContact O-N 3.44Å; G73-F76 PolarHBondContact O-N 3.49Å; G73-V77 WeakPolarHBondContact O-CG2 3.3Å; G73-V77 PolarHBondContact O-N 3.33Å |
| 74 | G | 87.4 | Confident | 83.8 | Confident | 0 Ų | 0 | 57.9 Ų | 57.9 | 0% | 0 | 30% | 0.297 | C | S | . | . | H | α-helix | trans | -57.4 | -49 | 173.7 | 0 | 0 | 0 | 0 | 0 | 112.3 | F70 F71 F76 V77 V78 G86 | F70-G74 PolarHBondContact O-N 2.84Å; F71-G74 PolarHBondContact O-N 2.92Å; G74-F76 VanDerWaalsContact C-N 3.3Å; G74-F76 PolarHBondContact O-N 2.93Å; G74-V77 PolarHBondContact O-N 3.33Å; G74-V77 VanDerWaalsContact O-N 3.14Å; G74-V78 WeakPolarHBondContact O-CG2 3.29Å; G74-V78 PolarHBondContact O-N 2.94Å; G74-G86 WeakPolarHBondContact CA-O 3.4Å; G74-G86 WeakPolarHBondContact O-CA 3.3Å |
| 75 | V | 87.2 | Confident | 84.8 | Confident | 14 Ų | 14 | 59.6 Ų | 59.6 | 9% | 0.085 | 31% | 0.307 | C | S | . | . | H | α-helix | trans | -55.9 | -46.7 | 175.2 | 174.4 | 0 | 0 | 0 | 0 | 110.7 | N39 V43 F71 L72 V77 V78 L79 E90 | N39-V75 HydrophobicContact CB-CG1 4.05Å; N39-V75 HydrophobicContact CB-CG2 4.27Å; V43-V75 HydrophobicContact CG2-CG2 4.41Å; F71-V75 HydrophobicContact CZ-CG2 4.48Å; F71-V75 WeakPolarHBondContact O-CG2 3.5Å; F71-V75 PolarHBondContact O-N 3.24Å; L72-V75 PolarHBondContact O-N 2.92Å; V75-V77 VanDerWaalsContact C-N 3.34Å; V75-V77 PolarHBondContact O-N 2.84Å; V75-V78 WeakPolarHBondContact O-CB 3.38Å; V75-V78 PolarHBondContact O-N 3.45Å; V75-L79 HydrophobicContact CG1-CD1 4.2Å; V75-L79 WeakPolarHBondContact O-CG 3.38Å; V75-L79 PolarHBondContact O-N 3.46Å; V75-E90 WeakPolarHBondContact CA-OE2 3.29Å; V75-E90 HydrophobicContact CG2-CG 3.79Å; V75-E90 WeakPolarHBondContact CG2-OE1 3.38Å; V75-E90 PolarHBondContact N-OE2 3.25Å |
| 76 | F | 88.5 | Confident | 85.7 | Confident | 132 Ų | 132 | 55.9 Ų | 55.9 | 58% | 0.579 | 29% | 0.289 | S | S | * | . | H | α-helix | trans | -64 | -38.1 | 180 | -163.4 | -110.2 | 0 | 0 | 0 | 112.7 | L72 G73 G74 L79 I80 | L72-F76 WeakPolarHBondContact O-CB 3.47Å; L72-F76 PolarHBondContact O-N 3.39Å; G73-F76 PolarHBondContact O-N 3.49Å; G74-F76 VanDerWaalsContact C-N 3.3Å; G74-F76 PolarHBondContact O-N 2.93Å; F76-L79 PolarHBondContact O-N 3.34Å; F76-I80 HydrophobicContact CD1-CD1 3.43Å; F76-I80 VanDerWaalsContact CD1-CD1 3.43Å; F76-I80 HydrophobicContact CD1-CG1 4.3Å; F76-I80 HydrophobicContact CE1-CD1 3.31Å; F76-I80 HydrophobicContact CE1-CG1 4.18Å; F76-I80 HydrophobicContact CG-CD1 4.34Å; F76-I80 HydrophobicContact CZ-CD1 4.12Å; F76-I80 WeakPolarHBondContact O-CG1 3.18Å; F76-I80 PolarHBondContact O-N 2.84Å |
| 77 | V | 89.2 | Confident | 86.3 | Confident | 41 Ų | 41 | 48.2 Ų | 48.2 | 25% | 0.248 | 26% | 0.256 | C | S | . | . | H | α-helix | trans | -66.1 | -37.9 | 175.7 | 173.6 | 0 | 0 | 0 | 0 | 111.4 | G73 G74 V75 L79 I80 G81 W82 I85 | G73-V77 WeakPolarHBondContact O-CG2 3.3Å; G73-V77 PolarHBondContact O-N 3.33Å; G74-V77 PolarHBondContact O-N 3.33Å; G74-V77 VanDerWaalsContact O-N 3.14Å; V75-V77 VanDerWaalsContact C-N 3.34Å; V75-V77 PolarHBondContact O-N 2.84Å; V77-L79 VanDerWaalsContact C-N 3.35Å; V77-I80 PolarHBondContact O-N 3.43Å; V77-G81 PolarHBondContact O-N 3.47Å; V77-W82 HydrophobicContact CG1-CB 3.81Å; V77-W82 PolarHBondContact O-N 2.86Å; V77-W82 VanDerWaalsContact O-N 3.09Å; V77-I85 HydrophobicContact CG1-CB 4.29Å; V77-I85 HydrophobicContact CG1-CG2 4.27Å |
| 78 | V | 86.7 | Confident | 86.7 | Confident | 1 Ų | 1 | 53.6 Ų | 53.6 | 1% | 0.006 | 28% | 0.283 | C | S | . | . | H | α-helix | trans | -61.2 | -45.2 | 171.6 | 176.3 | 0 | 0 | 0 | 0 | 110.4 | L35 G74 V75 I80 G81 P83 M87 | L35-V78 HydrophobicContact CB-CG1 3.78Å; G74-V78 WeakPolarHBondContact O-CG2 3.29Å; G74-V78 PolarHBondContact O-N 2.94Å; V75-V78 WeakPolarHBondContact O-CB 3.38Å; V75-V78 PolarHBondContact O-N 3.45Å; V78-I80 PolarHBondContact O-N 3.29Å; V78-G81 PolarHBondContact O-N 3.44Å; V78-P83 HydrophobicContact CG1-CB 4.44Å; V78-M87 HydrophobicContact CG2-CG 4.39Å |
| 79 | L | 83.5 | Confident | 87.1 | Confident | 92 Ų | 92 | 57.3 Ų | 57.3 | 48% | 0.482 | 30% | 0.299 | S | S | . | . | H | α-helix | trans | -65.4 | -35.3 | 179.4 | -66 | 176.1 | 0 | 0 | 0 | 113.6 | A36 V75 F76 V77 G81 | A36-L79 HydrophobicContact CB-CD2 3.53Å; V75-L79 HydrophobicContact CG1-CD1 4.2Å; V75-L79 WeakPolarHBondContact O-CG 3.38Å; V75-L79 PolarHBondContact O-N 3.46Å; F76-L79 PolarHBondContact O-N 3.34Å; V77-L79 VanDerWaalsContact C-N 3.35Å; L79-G81 PolarHBondContact O-N 2.94Å |
| 80 | I | 85.4 | Confident | 87.4 | Confident | 108 Ų | 108 | 55.6 Ų | 55.6 | 55% | 0.554 | 28% | 0.279 | S | S | * | . | H | α-helix | trans | -69 | -16.4 | 174.5 | -71.8 | 166.2 | 0 | 0 | 0 | 111.8 | F76 V77 V78 | F76-I80 HydrophobicContact CD1-CD1 3.43Å; F76-I80 VanDerWaalsContact CD1-CD1 3.43Å; F76-I80 HydrophobicContact CD1-CG1 4.3Å; F76-I80 HydrophobicContact CE1-CD1 3.31Å; F76-I80 HydrophobicContact CE1-CG1 4.18Å; F76-I80 HydrophobicContact CG-CD1 4.34Å; F76-I80 HydrophobicContact CZ-CD1 4.12Å; F76-I80 WeakPolarHBondContact O-CG1 3.18Å; F76-I80 PolarHBondContact O-N 2.84Å; V77-I80 PolarHBondContact O-N 3.43Å; V78-I80 PolarHBondContact O-N 3.29Å |
| 81 | G | 82.6 | Confident | 87.5 | Confident | 13 Ų | 13 | 55.8 Ų | 55.8 | 13% | 0.134 | 28% | 0.283 | C | S | . | . | T | Hydrogen-bonded Turn | trans | 102.1 | 23.5 | 173.8 | 0 | 0 | 0 | 0 | 0 | 114.5 | K32 V77 V78 L79 P83 | K32-G81 WeakPolarHBondContact CE-O 3.38Å; K32-G81 PolarHBondContact NZ-O 3.02Å; V77-G81 PolarHBondContact O-N 3.47Å; V78-G81 PolarHBondContact O-N 3.44Å; L79-G81 PolarHBondContact O-N 2.94Å; G81-P83 WeakPolarHBondContact O-CD 3.15Å |
| 82 | W | 88 | Confident | 87.6 | Confident | 166 Ų | 166 | 62.4 Ų | 62.4 | 63% | 0.629 | 31% | 0.309 | S | S | * | . | trans | -110.2 | 64.8 | 167 | -70.9 | 67.4 | 0 | 0 | 0 | 110.2 | V77 L84 I85 G86 | V77-W82 HydrophobicContact CG1-CB 3.81Å; V77-W82 PolarHBondContact O-N 2.86Å; V77-W82 VanDerWaalsContact O-N 3.09Å; W82-L84 VanDerWaalsContact C-N 3.31Å; W82-L84 PolarHBondContact O-N 2.78Å; W82-I85 HydrophobicContact CE3-CD1 3.48Å; W82-I85 VanDerWaalsContact CE3-CD1 3.48Å; W82-I85 HydrophobicContact CE3-CG1 4.33Å; W82-I85 HydrophobicContact CZ3-CD1 3.86Å; W82-I85 PolarHBondContact O-N 3.39Å; W82-G86 PolarHBondContact O-N 3.42Å | ||
| 83 | P | 85.6 | Confident | 87.6 | Confident | 14 Ų | 14 | 58.6 Ų | 58.6 | 9% | 0.091 | 29% | 0.289 | C | S | . | . | H | α-helix | trans | -59.9 | -38.4 | -169.1 | 23.9 | -35.3 | 0 | 0 | 0 | 113.1 | F30 K32 L35 V78 G81 I85 G86 M87 | F30-P83 HydrophobicContact CB-CB 4.2Å; F30-P83 HydrophobicContact CB-CG 4.02Å; K32-P83 HydrophobicContact CG-CG 3.88Å; L35-P83 HydrophobicContact CD1-CB 3.42Å; L35-P83 VanDerWaalsContact CD1-CB 3.42Å; L35-P83 HydrophobicContact CD1-CG 4.47Å; V78-P83 HydrophobicContact CG1-CB 4.44Å; G81-P83 WeakPolarHBondContact O-CD 3.15Å; P83-I85 PolarHBondContact O-N 3.22Å; P83-G86 PolarHBondContact O-N 3.47Å; P83-M87 WeakPolarHBondContact O-CB 3.41Å; P83-M87 WeakPolarHBondContact O-CG 3.28Å; P83-M87 PolarHBondContact O-N 2.92Å |
| 84 | L | 86.5 | Confident | 87.4 | Confident | 99 Ų | 99 | 60 Ų | 60 | 52% | 0.518 | 29% | 0.286 | S | S | . | . | H | α-helix | trans | -62.3 | -48.4 | -177.2 | -164.7 | 72.2 | 0 | 0 | 0 | 112.1 | F30 W82 I88 | F30-L84 HydrophobicContact CD1-CD1 4Å; F30-L84 HydrophobicContact CD2-CD1 3.91Å; F30-L84 HydrophobicContact CE1-CD1 3.58Å; F30-L84 HydrophobicContact CE2-CD1 3.49Å; F30-L84 VanDerWaalsContact CE2-CD1 3.49Å; F30-L84 HydrophobicContact CG-CD1 4.16Å; F30-L84 HydrophobicContact CZ-CD1 3.31Å; W82-L84 VanDerWaalsContact C-N 3.31Å; W82-L84 PolarHBondContact O-N 2.78Å; L84-I88 WeakPolarHBondContact O-CG1 3.47Å; L84-I88 PolarHBondContact O-N 3.14Å |
| 85 | I | 89.1 | Confident | 87.3 | Confident | 70 Ų | 70 | 66 Ų | 66 | 36% | 0.359 | 31% | 0.313 | S | S | . | . | H | α-helix | trans | -68.7 | -43.4 | 178.6 | -60.7 | -175.3 | 0 | 0 | 0 | 109.9 | V77 W82 P83 M87 I88 F89 | V77-I85 HydrophobicContact CG1-CB 4.29Å; V77-I85 HydrophobicContact CG1-CG2 4.27Å; W82-I85 HydrophobicContact CE3-CD1 3.48Å; W82-I85 VanDerWaalsContact CE3-CD1 3.48Å; W82-I85 HydrophobicContact CE3-CG1 4.33Å; W82-I85 HydrophobicContact CZ3-CD1 3.86Å; W82-I85 PolarHBondContact O-N 3.39Å; P83-I85 PolarHBondContact O-N 3.22Å; I85-M87 VanDerWaalsContact C-N 3.34Å; I85-M87 PolarHBondContact O-N 3.06Å; I85-I88 PolarHBondContact O-N 3.03Å; I85-F89 HydrophobicContact CG2-CD2 3.65Å; I85-F89 HydrophobicContact CG2-CE2 3.46Å; I85-F89 VanDerWaalsContact CG2-CE2 3.46Å; I85-F89 VanDerWaalsContact O-CD2 3.27Å; I85-F89 WeakPolarHBondContact O-CD2 3.09Å; I85-F89 PolarHBondContact O-N 3.21Å; I85-F89 VanDerWaalsContact O-N 3.15Å |
| 86 | G | 89.5 | Confident | 87.1 | Confident | 0 Ų | 0 | 68 Ų | 68 | 0% | 0 | 32% | 0.323 | C | S | . | . | H | α-helix | trans | -57.5 | -44.9 | 178.6 | 0 | 0 | 0 | 0 | 0 | 112.7 | G74 W82 P83 I88 F89 E90 | G74-G86 WeakPolarHBondContact CA-O 3.4Å; G74-G86 WeakPolarHBondContact O-CA 3.3Å; W82-G86 PolarHBondContact O-N 3.42Å; P83-G86 PolarHBondContact O-N 3.47Å; G86-I88 PolarHBondContact O-N 3.06Å; G86-F89 PolarHBondContact O-N 3Å; G86-E90 WeakPolarHBondContact O-CB 3.27Å; G86-E90 PolarHBondContact O-N 3.47Å |
| 87 | M | 89.4 | Confident | 86.5 | Confident | 14 Ų | 14 | 61.7 Ų | 61.7 | 7% | 0.069 | 30% | 0.295 | C | S | . | . | H | α-helix | trans | -61.5 | -38.8 | 177.3 | -73.3 | -66.9 | -75.9 | 0 | 0 | 112.8 | L22 M26 F30 L35 V78 P83 I85 E90 I91 | L22-M87 HydrophobicContact CD2-CE 4.24Å; L22-M87 HydrophobicContact CD2-SD 3.92Å; M26-M87 HydrophobicContact CE-CE 4.22Å; M26-M87 HydrophobicContact CG-CE 3.82Å; M26-M87 HydrophobicContact SD-CE 3.48Å; M26-M87 WeakPolarHBondContact SD-CE 3.4Å; F30-M87 HydrophobicContact CE1-CG 4.49Å; L35-M87 HydrophobicContact CD2-CE 4.19Å; L35-M87 HydrophobicContact CD2-SD 4.06Å; V78-M87 HydrophobicContact CG2-CG 4.39Å; P83-M87 WeakPolarHBondContact O-CB 3.41Å; P83-M87 WeakPolarHBondContact O-CG 3.28Å; P83-M87 PolarHBondContact O-N 2.92Å; I85-M87 VanDerWaalsContact C-N 3.34Å; I85-M87 PolarHBondContact O-N 3.06Å; M87-E90 PolarHBondContact O-N 3.04Å; M87-I91 WeakPolarHBondContact O-CD1 3.32Å; M87-I91 VanDerWaalsContact O-CG1 3.24Å; M87-I91 WeakPolarHBondContact O-CG1 3.3Å; M87-I91 PolarHBondContact O-N 2.9Å |
| 88 | I | 90.3 | Very high | 85.8 | Confident | 115 Ų | 115 | 60.5 Ų | 60.5 | 59% | 0.59 | 29% | 0.287 | S | S | * | . | H | α-helix | trans | -63.4 | -47 | 176.4 | -65.8 | 167.7 | 0 | 0 | 0 | 110.4 | L84 I85 G86 E90 Y92 | L84-I88 WeakPolarHBondContact O-CG1 3.47Å; L84-I88 PolarHBondContact O-N 3.14Å; I85-I88 PolarHBondContact O-N 3.03Å; G86-I88 PolarHBondContact O-N 3.06Å; I88-E90 VanDerWaalsContact C-N 3.32Å; I88-E90 PolarHBondContact O-N 3.45Å; I88-Y92 WeakPolarHBondContact O-CB 3.27Å; I88-Y92 PolarHBondContact O-N 2.93Å; I88-Y92 VanDerWaalsContact O-N 3.08Å |
| 89 | F | 90.4 | Very high | 85.1 | Confident | 84 Ų | 84 | 69.7 Ų | 69.7 | 37% | 0.368 | 32% | 0.321 | S | S | . | . | H | α-helix | trans | -63.4 | -39.7 | 176.4 | -80.5 | -67.2 | 0 | 0 | 0 | 112.2 | F70 I85 G86 Y92 G93 | F70-F89 AromaticContact CD1-CD1 3.63Å; F70-F89 HydrophobicContact CD1-CD1 3.63Å; F70-F89 AromaticContact CD1-CE1 3.94Å; F70-F89 HydrophobicContact CD1-CE1 3.94Å; F70-F89 HydrophobicContact CE1-CD1 4.07Å; F70-F89 AromaticContact CE1-CE1 3.89Å; F70-F89 HydrophobicContact CE1-CE1 3.89Å; I85-F89 HydrophobicContact CG2-CD2 3.65Å; I85-F89 HydrophobicContact CG2-CE2 3.46Å; I85-F89 VanDerWaalsContact CG2-CE2 3.46Å; I85-F89 VanDerWaalsContact O-CD2 3.27Å; I85-F89 WeakPolarHBondContact O-CD2 3.09Å; I85-F89 PolarHBondContact O-N 3.21Å; I85-F89 VanDerWaalsContact O-N 3.15Å; G86-F89 PolarHBondContact O-N 3Å; F89-Y92 PolarHBondContact O-N 3.38Å; F89-G93 PolarHBondContact O-N 3.19Å |
| 90 | E | 88.7 | Confident | 84.3 | Confident | 9 Ų | 9 | 67.7 Ų | 67.7 | 4% | 0.042 | 32% | 0.322 | C | S | . | . | H | α-helix | trans | -63.4 | -49.6 | 177.9 | -112.2 | -175.6 | 97.7 | 0 | 0 | 112.3 | N39 F71 V75 G86 M87 I88 Y92 G93 F94 | N39-E90 VanDerWaalsContact CG-OE1 3.3Å; N39-E90 PolarHBondContact ND2-OE2 2.9Å; N39-E90 PolarHBondContact OD1-OE1 2.86Å; N39-E90 PolarHBondContact OD1-OE2 2.77Å; F71-E90 HydrophobicContact CD2-CG 3.95Å; F71-E90 HydrophobicContact CE2-CG 4.05Å; V75-E90 WeakPolarHBondContact CA-OE2 3.29Å; V75-E90 HydrophobicContact CG2-CG 3.79Å; V75-E90 WeakPolarHBondContact CG2-OE1 3.38Å; V75-E90 PolarHBondContact N-OE2 3.25Å; G86-E90 WeakPolarHBondContact O-CB 3.27Å; G86-E90 PolarHBondContact O-N 3.47Å; M87-E90 PolarHBondContact O-N 3.04Å; I88-E90 VanDerWaalsContact C-N 3.32Å; I88-E90 PolarHBondContact O-N 3.45Å; E90-Y92 VanDerWaalsContact C-N 3.3Å; E90-Y92 PolarHBondContact O-N 2.99Å; E90-G93 PolarHBondContact O-N 3.48Å; E90-F94 WeakPolarHBondContact O-CB 3.47Å; E90-F94 PolarHBondContact O-N 3.35Å |
| 91 | I | 87.5 | Confident | 83.3 | Confident | 89 Ų | 89 | 65 Ų | 65 | 46% | 0.456 | 31% | 0.307 | S | S | . | . | H | α-helix | trans | -60.6 | -44.9 | 179 | -66.9 | 164.1 | 0 | 0 | 0 | 109.6 | M87 F94 F95 | M87-I91 WeakPolarHBondContact O-CD1 3.32Å; M87-I91 VanDerWaalsContact O-CG1 3.24Å; M87-I91 WeakPolarHBondContact O-CG1 3.3Å; M87-I91 PolarHBondContact O-N 2.9Å; I91-F94 PolarHBondContact O-N 2.88Å; I91-F95 HydrophobicContact CG2-CD2 3.85Å; I91-F95 HydrophobicContact CG2-CE2 4.04Å; I91-F95 WeakPolarHBondContact O-CB 3.22Å; I91-F95 WeakPolarHBondContact O-CD2 3.44Å; I91-F95 PolarHBondContact O-N 3.41Å |
| 92 | Y | 89.1 | Confident | 82.4 | Confident | 140 Ų | 140 | 69.3 Ų | 69.3 | 55% | 0.549 | 32% | 0.322 | S | S | . | . | H | α-helix | trans | -62.3 | -48.4 | 177.8 | -177.4 | -104.7 | 0 | 0 | 0 | 112.4 | F70 I88 F89 E90 L96 | F70-Y92 HydrophobicContact CB-CD1 4.44Å; F70-Y92 HydrophobicContact CD2-CD1 4.32Å; F70-Y92 HydrophobicContact CD2-CE1 4.11Å; F70-Y92 HydrophobicContact CE2-CE1 4.3Å; F70-Y92 HydrophobicContact CG-CD1 4.23Å; F70-Y92 HydrophobicContact CG-CE1 4.46Å; I88-Y92 WeakPolarHBondContact O-CB 3.27Å; I88-Y92 PolarHBondContact O-N 2.93Å; I88-Y92 VanDerWaalsContact O-N 3.08Å; F89-Y92 PolarHBondContact O-N 3.38Å; E90-Y92 VanDerWaalsContact C-N 3.3Å; E90-Y92 PolarHBondContact O-N 2.99Å; Y92-L96 HydrophobicContact CE1-CD2 4.48Å; Y92-L96 WeakPolarHBondContact O-CB 3.44Å; Y92-L96 PolarHBondContact O-N 3.1Å; Y92-L96 VanDerWaalsContact O-N 3.11Å |
| 93 | G | 86.6 | Confident | 81 | Confident | 0 Ų | 0 | 65.9 Ų | 65.9 | 0% | 0 | 32% | 0.321 | C | S | . | . | H | α-helix | trans | -60.8 | -47.1 | 177.3 | 0 | 0 | 0 | 0 | 0 | 111.7 | F89 E90 L96 L97 | F89-G93 PolarHBondContact O-N 3.19Å; E90-G93 PolarHBondContact O-N 3.48Å; G93-L96 PolarHBondContact O-N 3.34Å; G93-L97 WeakPolarHBondContact O-CB 3.4Å; G93-L97 PolarHBondContact O-N 3.14Å |
| 94 | F | 84.8 | Confident | 79.8 | Confident | 58 Ų | 58 | 68.5 Ų | 68.5 | 25% | 0.254 | 34% | 0.337 | S | S | . | . | H | α-helix | trans | -58.7 | -51.3 | 178.6 | -175.9 | -98 | 0 | 0 | 0 | 111.5 | F42 L46 F71 E90 I91 L96 L97 F98 | F42-F94 AromaticContact CE1-CD2 3.67Å; F42-F94 HydrophobicContact CE1-CD2 3.67Å; F42-F94 AromaticContact CE1-CE2 3.54Å; F42-F94 HydrophobicContact CE1-CE2 3.54Å; F42-F94 HydrophobicContact CE1-CZ 4.41Å; F42-F94 HydrophobicContact CE2-CE2 4.42Å; F42-F94 AromaticContact CZ-CD2 3.79Å; F42-F94 HydrophobicContact CZ-CD2 3.79Å; F42-F94 AromaticContact CZ-CE2 3.22Å; F42-F94 HydrophobicContact CZ-CE2 3.22Å; F42-F94 AromaticContact CZ-CZ 3.69Å; F42-F94 HydrophobicContact CZ-CZ 3.69Å; L46-F94 HydrophobicContact CD1-CE2 4.02Å; F71-F94 HydrophobicContact CD2-CB 3.86Å; F71-F94 HydrophobicContact CD2-CD2 4.35Å; F71-F94 HydrophobicContact CE2-CB 4.1Å; F71-F94 AromaticContact CE2-CD2 3.92Å; F71-F94 HydrophobicContact CE2-CD2 3.92Å; F71-F94 HydrophobicContact CE2-CG 4.47Å; E90-F94 WeakPolarHBondContact O-CB 3.47Å; E90-F94 PolarHBondContact O-N 3.35Å; I91-F94 PolarHBondContact O-N 2.88Å; F94-L96 VanDerWaalsContact C-N 3.28Å; F94-L96 PolarHBondContact O-N 2.84Å; F94-L97 PolarHBondContact O-N 3.42Å; F94-F98 HydrophobicContact CD1-CD2 4.27Å; F94-F98 AromaticContact CD2-CD2 3.48Å; F94-F98 HydrophobicContact CD2-CD2 3.48Å; F94-F98 VanDerWaalsContact CD2-CD2 3.48Å; F94-F98 AromaticContact CD2-CE2 3.42Å; F94-F98 HydrophobicContact CD2-CE2 3.42Å; F94-F98 VanDerWaalsContact CD2-CE2 3.42Å; F94-F98 HydrophobicContact CE1-CD2 4.07Å; F94-F98 HydrophobicContact CE1-CG 4.42Å; F94-F98 AromaticContact CE2-CD2 3.21Å; F94-F98 HydrophobicContact CE2-CD2 3.21Å; F94-F98 AromaticContact CE2-CE2 3.01Å; F94-F98 HydrophobicContact CE2-CE2 3.01Å; F94-F98 HydrophobicContact CE2-CG 4.11Å; F94-F98 AromaticContact CE2-CZ 3.75Å; F94-F98 HydrophobicContact CE2-CZ 3.75Å; F94-F98 AromaticContact CG-CD2 3.99Å; F94-F98 HydrophobicContact CG-CD2 3.99Å; F94-F98 HydrophobicContact CG-CE2 4.37Å; F94-F98 AromaticContact CZ-CD2 3.55Å; F94-F98 HydrophobicContact CZ-CD2 3.55Å; F94-F98 AromaticContact CZ-CE2 3.73Å; F94-F98 HydrophobicContact CZ-CE2 3.73Å; F94-F98 HydrophobicContact CZ-CG 4Å; F94-F98 HydrophobicContact CZ-CZ 4.28Å; F94-F98 WeakPolarHBondContact O-CD2 3.42Å; F94-F98 PolarHBondContact O-N 2.79Å |
| 95 | F | 84 | Confident | 78.6 | Confident | 126 Ų | 126 | 66.8 Ų | 66.8 | 55% | 0.553 | 33% | 0.33 | S | S | * | . | H | α-helix | trans | -57.3 | -42.3 | 176.9 | -96.9 | -83.4 | 0 | 0 | 0 | 112.1 | I91 R99 F102 | I91-F95 HydrophobicContact CG2-CD2 3.85Å; I91-F95 HydrophobicContact CG2-CE2 4.04Å; I91-F95 WeakPolarHBondContact O-CB 3.22Å; I91-F95 WeakPolarHBondContact O-CD2 3.44Å; I91-F95 PolarHBondContact O-N 3.41Å; F95-R99 WeakPolarHBondContact O-CB 3.35Å; F95-R99 PolarHBondContact O-N 3.23Å; F95-F102 HydrophobicContact CE1-CZ 4.36Å |
| 96 | L | 83.1 | Confident | 77.3 | Confident | 57 Ų | 57 | 66.1 Ų | 66.1 | 30% | 0.298 | 33% | 0.33 | S | S | . | . | H | α-helix | trans | -69.4 | -34.9 | -179.6 | -164.9 | 64.7 | 0 | 0 | 0 | 112.5 | A67 Y92 G93 F94 | A67-L96 HydrophobicContact CB-CB 3.75Å; A67-L96 HydrophobicContact CB-CD2 3.8Å; A67-L96 HydrophobicContact CB-CG 3.7Å; Y92-L96 HydrophobicContact CE1-CD2 4.48Å; Y92-L96 WeakPolarHBondContact O-CB 3.44Å; Y92-L96 PolarHBondContact O-N 3.1Å; Y92-L96 VanDerWaalsContact O-N 3.11Å; G93-L96 PolarHBondContact O-N 3.34Å; F94-L96 VanDerWaalsContact C-N 3.28Å; F94-L96 PolarHBondContact O-N 2.84Å |
| 97 | L | 77.4 | Confident | 76 | Confident | 0 Ų | 0 | 67.4 Ų | 67.4 | 0% | 0 | 34% | 0.343 | C | S | . | . | H | α-helix | trans | -69.2 | -47.4 | 178.7 | -138.8 | 153.1 | 0 | 0 | 0 | 110.2 | F58 F59 K64 A67 F71 G93 F94 | F58-L97 HydrophobicContact CD1-CD2 3.67Å; F58-L97 HydrophobicContact CE1-CD2 3.41Å; F58-L97 VanDerWaalsContact CE1-CD2 3.41Å; F58-L97 HydrophobicContact CZ-CD2 4.42Å; F59-L97 HydrophobicContact CD1-CD1 4.34Å; F59-L97 HydrophobicContact CD2-CD1 4.39Å; F59-L97 HydrophobicContact CD2-CD2 3.9Å; F59-L97 HydrophobicContact CE1-CD1 3.82Å; F59-L97 HydrophobicContact CE2-CD1 3.9Å; F59-L97 HydrophobicContact CE2-CD2 3.66Å; F59-L97 HydrophobicContact CE2-CG 4.45Å; F59-L97 HydrophobicContact CZ-CD1 3.57Å; F59-L97 HydrophobicContact CZ-CD2 4.21Å; K64-L97 PolarHBondContact NZ-O 2.73Å; A67-L97 HydrophobicContact CB-CB 4.11Å; A67-L97 HydrophobicContact CB-CG 4.22Å; F71-L97 HydrophobicContact CB-CD1 4.1Å; F71-L97 HydrophobicContact CD1-CD1 4.41Å; F71-L97 HydrophobicContact CG-CD1 4.41Å; G93-L97 WeakPolarHBondContact O-CB 3.4Å; G93-L97 PolarHBondContact O-N 3.14Å; F94-L97 PolarHBondContact O-N 3.42Å |
| 98 | F | 72.8 | Confident | 74.6 | Confident | 15 Ų | 15 | 71.3 Ų | 71.3 | 7% | 0.066 | 36% | 0.36 | C | S | . | . | H | α-helix | trans | -84.6 | -7.9 | -176.2 | -75.4 | -88.4 | 0 | 0 | 0 | 115.2 | L46 I50 F94 G100 F101 F102 | L46-F98 HydrophobicContact CD1-CE2 4.15Å; L46-F98 HydrophobicContact CD1-CZ 3.91Å; L46-F98 HydrophobicContact CD2-CE1 4.24Å; L46-F98 HydrophobicContact CD2-CZ 3.72Å; L46-F98 HydrophobicContact CG-CZ 4.41Å; I50-F98 HydrophobicContact CD1-CE1 4.21Å; I50-F98 HydrophobicContact CD1-CZ 4.29Å; F94-F98 HydrophobicContact CD1-CD2 4.27Å; F94-F98 AromaticContact CD2-CD2 3.48Å; F94-F98 HydrophobicContact CD2-CD2 3.48Å; F94-F98 VanDerWaalsContact CD2-CD2 3.48Å; F94-F98 AromaticContact CD2-CE2 3.42Å; F94-F98 HydrophobicContact CD2-CE2 3.42Å; F94-F98 VanDerWaalsContact CD2-CE2 3.42Å; F94-F98 HydrophobicContact CE1-CD2 4.07Å; F94-F98 HydrophobicContact CE1-CG 4.42Å; F94-F98 AromaticContact CE2-CD2 3.21Å; F94-F98 HydrophobicContact CE2-CD2 3.21Å; F94-F98 AromaticContact CE2-CE2 3.01Å; F94-F98 HydrophobicContact CE2-CE2 3.01Å; F94-F98 HydrophobicContact CE2-CG 4.11Å; F94-F98 AromaticContact CE2-CZ 3.75Å; F94-F98 HydrophobicContact CE2-CZ 3.75Å; F94-F98 AromaticContact CG-CD2 3.99Å; F94-F98 HydrophobicContact CG-CD2 3.99Å; F94-F98 HydrophobicContact CG-CE2 4.37Å; F94-F98 AromaticContact CZ-CD2 3.55Å; F94-F98 HydrophobicContact CZ-CD2 3.55Å; F94-F98 AromaticContact CZ-CE2 3.73Å; F94-F98 HydrophobicContact CZ-CE2 3.73Å; F94-F98 HydrophobicContact CZ-CG 4Å; F94-F98 HydrophobicContact CZ-CZ 4.28Å; F94-F98 WeakPolarHBondContact O-CD2 3.42Å; F94-F98 PolarHBondContact O-N 2.79Å; F98-G100 PolarHBondContact O-N 3.38Å; F98-F101 HydrophobicContact CD1-CB 3.96Å; F98-F101 WeakPolarHBondContact O-CA 3.37Å; F98-F101 PolarHBondContact O-N 3.42Å; F98-F102 HydrophobicContact CB-CE2 4.46Å; F98-F102 WeakPolarHBondContact O-CD2 3.3Å; F98-F102 PolarHBondContact O-N 2.8Å |
| 99 | R | 72.8 | Confident | 73.1 | Confident | 195 Ų | 195 | 69 Ų | 69 | 74% | 0.736 | 35% | 0.347 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -50.3 | -30.5 | 176.9 | -173.1 | 173.5 | 167.2 | -178.1 | -3.7 | 114.7 | F95 | F95-R99 WeakPolarHBondContact O-CB 3.35Å; F95-R99 PolarHBondContact O-N 3.23Å |
| 100 | G | 66.6 | Low | 71.6 | Confident | 49 Ų | 49 | 73 Ų | 73 | 51% | 0.505 | 36% | 0.36 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -89.8 | -11.6 | 175.9 | 0 | 0 | 0 | 0 | 0 | 115 | F98 | F98-G100 PolarHBondContact O-N 3.38Š|
| 101 | F | 64.8 | Low | 70 | Confident | 53 Ų | 53 | 80.6 Ų | 80.6 | 23% | 0.232 | 39% | 0.389 | C | S | . | . | T | Hydrogen-bonded Turn | trans | -102.6 | -13.8 | -177.3 | -120.3 | -108.5 | 0 | 0 | 0 | 113.2 | I50 F58 F98 P103 V104 V105 | I50-F101 HydrophobicContact CG1-CE1 4.41Å; I50-F101 HydrophobicContact CG2-CZ 4.43Å; F58-F101 HydrophobicContact CD2-CD2 4.01Å; F58-F101 AromaticContact CD2-CE2 3.68Å; F58-F101 HydrophobicContact CD2-CE2 3.68Å; F58-F101 AromaticContact CE1-CD2 3.96Å; F58-F101 HydrophobicContact CE1-CD2 3.96Å; F58-F101 HydrophobicContact CE1-CE2 4.26Å; F58-F101 HydrophobicContact CE1-CG 4.45Å; F58-F101 AromaticContact CE2-CD2 3.19Å; F58-F101 HydrophobicContact CE2-CD2 3.19Å; F58-F101 AromaticContact CE2-CE2 3.35Å; F58-F101 HydrophobicContact CE2-CE2 3.35Å; F58-F101 HydrophobicContact CE2-CG 4.32Å; F58-F101 HydrophobicContact CG-CE2 4.3Å; F58-F101 HydrophobicContact CZ-CB 4.14Å; F58-F101 AromaticContact CZ-CD2 3.16Å; F58-F101 HydrophobicContact CZ-CD2 3.16Å; F58-F101 AromaticContact CZ-CE2 3.68Å; F58-F101 HydrophobicContact CZ-CE2 3.68Å; F58-F101 AromaticContact CZ-CG 3.88Å; F58-F101 HydrophobicContact CZ-CG 3.88Å; F98-F101 HydrophobicContact CD1-CB 3.96Å; F98-F101 WeakPolarHBondContact O-CA 3.37Å; F98-F101 PolarHBondContact O-N 3.42Å; F101-P103 VanDerWaalsContact C-N 3.34Å; F101-V104 HydrophobicContact CD1-CB 4.4Å; F101-V104 WeakPolarHBondContact O-CB 3.44Å; F101-V104 PolarHBondContact O-N 2.91Å; F101-V105 PolarHBondContact O-N 3.09Å |
| 102 | F | 63.4 | Low | 68.6 | Low | 102 Ų | 102 | 79.7 Ų | 79.7 | 45% | 0.447 | 39% | 0.387 | S | S | . | . | H | α-helix | trans | -48.4 | -43.3 | 174.9 | -99.3 | -88.8 | 0 | 0 | 0 | 114.6 | F95 F98 V104 V105 V106 | F95-F102 HydrophobicContact CE1-CZ 4.36Å; F98-F102 HydrophobicContact CB-CE2 4.46Å; F98-F102 WeakPolarHBondContact O-CD2 3.3Å; F98-F102 PolarHBondContact O-N 2.8Å; F102-V104 VanDerWaalsContact C-N 3.26Å; F102-V104 PolarHBondContact O-N 3.16Å; F102-V105 PolarHBondContact O-N 3.25Å; F102-V106 WeakPolarHBondContact O-CB 3.17Å; F102-V106 VanDerWaalsContact O-CG2 3.27Å; F102-V106 WeakPolarHBondContact O-CG2 3.26Å; F102-V106 PolarHBondContact O-N 3.06Å |
| 103 | P | 59.4 | Low | 66.8 | Low | 94 Ų | 94 | 78.2 Ų | 78.2 | 61% | 0.61 | 39% | 0.394 | S | S | * | . | H | α-helix | trans | -62.7 | -35 | 178.4 | -20.2 | 32.1 | 0 | 0 | 0 | 112.6 | F101 G107 | F101-P103 VanDerWaalsContact C-N 3.34Å; P103-G107 PolarHBondContact O-N 2.94Å |
| 104 | V | 59.9 | Low | 65.4 | Low | 70 Ų | 70 | 83.7 Ų | 83.7 | 42% | 0.424 | 43% | 0.428 | S | S | . | . | H | α-helix | trans | -71.2 | -46.2 | 178.3 | -178.1 | 0 | 0 | 0 | 0 | 110 | F101 F102 G107 F108 | F101-V104 HydrophobicContact CD1-CB 4.4Å; F101-V104 WeakPolarHBondContact O-CB 3.44Å; F101-V104 PolarHBondContact O-N 2.91Å; F102-V104 VanDerWaalsContact C-N 3.26Å; F102-V104 PolarHBondContact O-N 3.16Å; V104-G107 PolarHBondContact O-N 2.9Å; V104-F108 HydrophobicContact CG1-CD2 4.05Å; V104-F108 HydrophobicContact CG1-CE2 4.14Å; V104-F108 WeakPolarHBondContact O-CD2 3.38Å; V104-F108 PolarHBondContact O-N 3.32Å |
| 105 | V | 60.6 | Low | 63.8 | Low | 62 Ų | 62 | 84.7 Ų | 84.7 | 38% | 0.376 | 44% | 0.435 | S | S | . | . | H | α-helix | trans | -61.5 | -45.1 | 177.2 | 175.9 | 0 | 0 | 0 | 0 | 111.3 | F101 F102 G107 F108 I109 | F101-V105 PolarHBondContact O-N 3.09Å; F102-V105 PolarHBondContact O-N 3.25Å; V105-G107 VanDerWaalsContact C-N 3.33Å; V105-G107 PolarHBondContact O-N 3.41Å; V105-F108 WeakPolarHBondContact O-CB 3.15Å; V105-F108 PolarHBondContact O-N 3.27Å; V105-F108 VanDerWaalsContact O-N 3.14Å; V105-I109 HydrophobicContact CG1-CD1 3.82Å; V105-I109 HydrophobicContact CG1-CG1 4.39Å; V105-I109 WeakPolarHBondContact O-CG1 3.49Å; V105-I109 PolarHBondContact O-N 3.29Å |
| 106 | V | 61.5 | Low | 62.1 | Low | 57 Ų | 57 | 79.3 Ų | 79.3 | 35% | 0.345 | 42% | 0.415 | S | S | . | . | H | α-helix | trans | -63.6 | -39.7 | 175.9 | 173 | 0 | 0 | 0 | 0 | 111.1 | F102 F108 I109 R110 | F102-V106 WeakPolarHBondContact O-CB 3.17Å; F102-V106 VanDerWaalsContact O-CG2 3.27Å; F102-V106 WeakPolarHBondContact O-CG2 3.26Å; F102-V106 PolarHBondContact O-N 3.06Å; V106-F108 VanDerWaalsContact C-N 3.29Å; V106-F108 PolarHBondContact O-N 2.98Å; V106-I109 PolarHBondContact O-N 3.12Å; V106-R110 HydrophobicContact CG1-CG 4.39Å; V106-R110 WeakPolarHBondContact O-CB 3.37Å; V106-R110 VanDerWaalsContact O-CG 3.32Å; V106-R110 WeakPolarHBondContact O-CG 3.49Å; V106-R110 PolarHBondContact O-N 3.22Å |
| 107 | G | 62.4 | Low | 60.8 | Low | 27 Ų | 27 | 80.8 Ų | 80.8 | 28% | 0.278 | 43% | 0.431 | S | S | . | . | H | α-helix | trans | -61.8 | -34.5 | 173 | 0 | 0 | 0 | 0 | 0 | 113.4 | P103 V104 V105 R111 | P103-G107 PolarHBondContact O-N 2.94Å; V104-G107 PolarHBondContact O-N 2.9Å; V105-G107 VanDerWaalsContact C-N 3.33Å; V105-G107 PolarHBondContact O-N 3.41Å; G107-R111 VanDerWaalsContact O-CD 3.32Å; G107-R111 WeakPolarHBondContact O-CD 3.41Å; G107-R111 VanDerWaalsContact O-CG 3.27Å; G107-R111 WeakPolarHBondContact O-CG 3.49Å |
| 108 | F | 60.7 | Low | 59.7 | Low | 96 Ų | 96 | 86.7 Ų | 86.7 | 42% | 0.421 | 46% | 0.461 | S | S | . | . | H | α-helix | trans | -73.1 | -46.3 | 172.8 | -95 | -85.8 | 0 | 0 | 0 | 112.4 | L4 V104 V105 V106 R110 R111 V112 | L4-F108 HydrophobicContact CD2-CE1 4.42Å; V104-F108 HydrophobicContact CG1-CD2 4.05Å; V104-F108 HydrophobicContact CG1-CE2 4.14Å; V104-F108 WeakPolarHBondContact O-CD2 3.38Å; V104-F108 PolarHBondContact O-N 3.32Å; V105-F108 WeakPolarHBondContact O-CB 3.15Å; V105-F108 PolarHBondContact O-N 3.27Å; V105-F108 VanDerWaalsContact O-N 3.14Å; V106-F108 VanDerWaalsContact C-N 3.29Å; V106-F108 PolarHBondContact O-N 2.98Å; F108-R110 VanDerWaalsContact C-N 3.35Å; F108-R110 PolarHBondContact O-N 3.3Å; F108-R111 WeakPolarHBondContact O-CB 3.47Å; F108-R111 PolarHBondContact O-N 3.39Å; F108-V112 PolarHBondContact O-N 3.11Å |
| 109 | I | 59.8 | Low | 58.6 | Low | 65 Ų | 65 | 90.1 Ų | 90.1 | 33% | 0.333 | 48% | 0.48 | S | S | . | . | H | α-helix | trans | -60.2 | -42.8 | 178.9 | -73.9 | 170.8 | 0 | 0 | 0 | 111.4 | V105 V106 R111 V112 L115 L119 | V105-I109 HydrophobicContact CG1-CD1 3.82Å; V105-I109 HydrophobicContact CG1-CG1 4.39Å; V105-I109 WeakPolarHBondContact O-CG1 3.49Å; V105-I109 PolarHBondContact O-N 3.29Å; V106-I109 PolarHBondContact O-N 3.12Å; I109-R111 PolarHBondContact O-N 3.12Å; I109-R111 VanDerWaalsContact O-N 3.14Å; I109-V112 PolarHBondContact O-N 3.42Å; I109-L115 HydrophobicContact CG2-CB 3.94Å; I109-L115 HydrophobicContact CG2-CD1 3.82Å; I109-L115 HydrophobicContact CG2-CG 4.45Å; I109-L119 HydrophobicContact CG2-CD1 4.48Å |
| 110 | R | 57.6 | Low | 57.7 | Low | 169 Ų | 169 | 85.4 Ų | 85.4 | 64% | 0.638 | 47% | 0.469 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -62.4 | -18.6 | 176.3 | -75.3 | 179.3 | 179.1 | -176.1 | 0.2 | 113.8 | V106 F108 | V106-R110 HydrophobicContact CG1-CG 4.39Å; V106-R110 WeakPolarHBondContact O-CB 3.37Å; V106-R110 VanDerWaalsContact O-CG 3.32Å; V106-R110 WeakPolarHBondContact O-CG 3.49Å; V106-R110 PolarHBondContact O-N 3.22Å; F108-R110 VanDerWaalsContact C-N 3.35Å; F108-R110 PolarHBondContact O-N 3.3Å |
| 111 | R | 55.2 | Low | 57.3 | Low | 169 Ų | 169 | 88.1 Ų | 88.1 | 64% | 0.638 | 47% | 0.472 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -92.2 | -8.9 | 177.9 | -68.3 | 170.7 | -177.2 | -177.7 | 0.3 | 112.9 | G107 F108 I109 P113 | G107-R111 VanDerWaalsContact O-CD 3.32Å; G107-R111 WeakPolarHBondContact O-CD 3.41Å; G107-R111 VanDerWaalsContact O-CG 3.27Å; G107-R111 WeakPolarHBondContact O-CG 3.49Å; F108-R111 WeakPolarHBondContact O-CB 3.47Å; F108-R111 PolarHBondContact O-N 3.39Å; I109-R111 PolarHBondContact O-N 3.12Å; I109-R111 VanDerWaalsContact O-N 3.14Å; R111-P113 WeakPolarHBondContact O-CD 3.32Å |
| 112 | V | 57.8 | Low | 56.8 | Low | 70 Ų | 70 | 91 Ų | 91 | 42% | 0.424 | 50% | 0.495 | S | S | . | . | S | Bend | trans | -84.4 | 112.1 | 172.3 | -178.9 | 0 | 0 | 0 | 0 | 108 | F108 I109 V114 L115 G116 | F108-V112 PolarHBondContact O-N 3.11Å; I109-V112 PolarHBondContact O-N 3.42Å; V112-V114 HydrophobicContact CG1-CB 4.47Å; V112-V114 PolarHBondContact O-N 3.03Å; V112-L115 PolarHBondContact O-N 3.45Å; V112-G116 PolarHBondContact O-N 3.49Å |
| 113 | P | 51.2 | Low | 56.6 | Low | 108 Ų | 108 | 89.7 Ų | 89.7 | 70% | 0.701 | 51% | 0.511 | S | S | * | . | H | α-helix | trans | -60.3 | -24.2 | -170.1 | 19.7 | -30.5 | 0 | 0 | 0 | 114 | R111 S117 | R111-P113 WeakPolarHBondContact O-CD 3.32Å; P113-S117 PolarHBondContact O-N 3.47Å |
| 114 | V | 57.1 | Low | 56.4 | Low | 116 Ų | 116 | 91.4 Ų | 91.4 | 70% | 0.703 | 51% | 0.514 | S | S | * | . | H | α-helix | trans | -70.6 | -38.3 | 176.2 | -177.7 | 0 | 0 | 0 | 0 | 112.4 | V112 | V112-V114 HydrophobicContact CG1-CB 4.47Å; V112-V114 PolarHBondContact O-N 3.03Å |
| 115 | L | 50.8 | Low | 56.1 | Low | 79 Ų | 79 | 97.2 Ų | 97.2 | 41% | 0.414 | 53% | 0.528 | S | S | . | . | H | α-helix | trans | -89.2 | -24.3 | 178 | -69.6 | 167 | 0 | 0 | 0 | 112.2 | I109 V112 L118 L119 | I109-L115 HydrophobicContact CG2-CB 3.94Å; I109-L115 HydrophobicContact CG2-CD1 3.82Å; I109-L115 HydrophobicContact CG2-CG 4.45Å; V112-L115 PolarHBondContact O-N 3.45Å; L115-L118 PolarHBondContact O-N 3.35Å; L115-L119 PolarHBondContact O-N 3.17Å |
| 116 | G | 50.2 | Low | 55.3 | Low | 13 Ų | 13 | 99.6 Ų | 99.6 | 13% | 0.134 | 55% | 0.547 | C | S | . | . | H | α-helix | trans | -64.6 | -33 | 174.2 | 0 | 0 | 0 | 0 | 0 | 113.8 | V112 N120 | V112-G116 PolarHBondContact O-N 3.49Å; G116-N120 WeakPolarHBondContact O-CB 3.34Å; G116-N120 PolarHBondContact O-N 3.05Å; G116-N120 PolarHBondContact O-ND2 3.46Å |
| 117 | S | 55 | Low | 54.5 | Low | 88 Ų | 88 | 103 Ų | 103 | 62% | 0.615 | 57% | 0.569 | S | S | * | * | H | α-helix | trans | -71.1 | -36.3 | 176.3 | -78.4 | 0 | 0 | 0 | 0 | 113.2 | P113 N120 | P113-S117 PolarHBondContact O-N 3.47Å; S117-N120 PolarHBondContact O-N 2.85Å |
| 118 | L | 53.3 | Low | 53.4 | Low | 123 Ų | 123 | 112 Ų | 112 | 64% | 0.644 | 62% | 0.618 | S | S | * | * | H | α-helix | trans | -70.1 | -33.8 | 176.4 | -71.9 | 171.2 | 0 | 0 | 0 | 112.3 | L115 | L115-L118 PolarHBondContact O-N 3.35Å |
| 119 | L | 51 | Low | 53 | Low | 88 Ų | 88 | 112.8 Ų | 112.8 | 46% | 0.461 | 63% | 0.628 | S | S | . | * | H | α-helix | trans | -83.4 | -9.7 | 175.6 | -87.4 | 155.1 | 0 | 0 | 0 | 114.2 | I109 L115 | I109-L119 HydrophobicContact CG2-CD1 4.48Å; L115-L119 PolarHBondContact O-N 3.17Å |
| 120 | N | 52.5 | Low | 52.6 | Low | 96 Ų | 96 | 115.3 Ų | 115.3 | 51% | 0.513 | 64% | 0.644 | S | S | . | * | T | Hydrogen-bonded Turn | trans | -93.8 | 7 | 173.1 | -102.8 | -50.6 | 0 | 0 | 0 | 113.3 | G116 S117 R125 | G116-N120 WeakPolarHBondContact O-CB 3.34Å; G116-N120 PolarHBondContact O-N 3.05Å; G116-N120 PolarHBondContact O-ND2 3.46Å; S117-N120 PolarHBondContact O-N 2.85Å; N120-R125 PolarHBondContact OD1-NH2 2.86Å |
| 121 | L | 58.7 | Low | 52.4 | Low | 105 Ų | 105 | 112.3 Ų | 112.3 | 55% | 0.55 | 64% | 0.644 | S | S | . | * | S | Bend | trans | -62.2 | 135.9 | 170.5 | -94.4 | 92.1 | 0 | 0 | 0 | 110 | G123 | L121-G123 PolarHBondContact O-N 3.14Š|
| 122 | P | 55.2 | Low | 52.2 | Low | 113 Ų | 113 | 108.9 Ų | 108.9 | 73% | 0.734 | 64% | 0.644 | S | S | * | * | G | 310 helix | trans | -63.1 | -6.7 | -167 | 21.3 | -32.3 | 0 | 0 | 0 | 115.9 | I124 | P122-I124 PolarHBondContact O-N 3.5Š|
| 123 | G | 58.4 | Low | 51.9 | Low | 75 Ų | 75 | 111.4 Ų | 111.4 | 77% | 0.773 | 66% | 0.658 | S | S | * | * | G | 310 helix | trans | -75.9 | -14 | -178 | 0 | 0 | 0 | 0 | 0 | 116.4 | L121 | L121-G123 PolarHBondContact O-N 3.14Š|
| 124 | I | 55.3 | Low | 51.9 | Low | 130 Ų | 130 | 111.6 Ų | 111.6 | 67% | 0.667 | 66% | 0.655 | S | S | * | * | G | 310 helix | trans | -114.3 | 17.8 | -176.6 | -45.8 | 168.1 | 0 | 0 | 0 | 111.6 | P122 | P122-I124 PolarHBondContact O-N 3.5Š|
| 125 | R | 53.3 | Low | 51.5 | Low | 192 Ų | 192 | 111.3 Ų | 111.3 | 73% | 0.725 | 65% | 0.652 | S | S | * | * | S | Bend | trans | -87.2 | -7.1 | 177.2 | -81 | -167.8 | 178.9 | -164.2 | 0.9 | 115 | N120 | N120-R125 PolarHBondContact OD1-NH2 2.86Š|
| 126 | S | 45.1 | Very low | 51.6 | Low | 112 Ų | 112 | 113.8 Ų | 113.8 | 78% | 0.783 | 67% | 0.67 | S | S | * | * | S | Bend | trans | -105.4 | 6.8 | -162.9 | -153.9 | 0 | 0 | 0 | 0 | 117.5 | ||
| 127 | T | 44.8 | Very low | 51.7 | Low | 130 Ų | 130 | 122.2 Ų | 122.2 | 80% | 0.798 | 72% | 0.715 | S | S | * | * | trans | -147.3 | 71.5 | 174.8 | 45.3 | 0 | 0 | 0 | 0 | 112.6 | ||||
| 128 | T | 37.7 | Very low | 51.4 | Low | 214 Ų | 214 | 125.3 Ų | 125.3 | 100% | 1.313 | 72% | 0.724 | S | S | * | * | trans | -163.6 | 0 | 134.7 | -61.1 | 0 | 0 | 0 | 0 | 107.8 |
Retrieved 128 of 128 residues in 130.8 ms
(Link to these results)