| 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 | 53.3 | Low | 75.2 | Confident | 174 Ų | 174 | 103.4 Ų | 103.4 | 86% | 0.857 | 54% | 0.541 | S | S | * | . | 0 | 122.9 | 0 | -77 | 164.2 | 75.5 | 0 | 0 | 108.2 | Y5 | M1-Y5 HydrophobicContact CE-CD1 3.6Å; M1-Y5 HydrophobicContact CE-CE1 3.51Å | |||
| 2 | S | 60.7 | Low | 76.5 | Confident | 90 Ų | 90 | 100.8 Ų | 100.8 | 63% | 0.629 | 53% | 0.533 | S | S | * | . | trans | -55.8 | 137.7 | -175.9 | 167.4 | 0 | 0 | 0 | 0 | 111.7 | G4 Y5 | S2-G4 PolarHBondContact O-N 3.2Å; S2-G4 VanDerWaalsContact O-N 3.12Å; S2-G4 PolarHBondContact OG-N 3.03Å; S2-Y5 PolarHBondContact O-N 3.04Å | ||
| 3 | S | 66.5 | Low | 77.7 | Confident | 90 Ų | 90 | 95.9 Ų | 95.9 | 63% | 0.629 | 52% | 0.522 | S | S | * | . | H | α-helix | trans | -48.4 | -36.9 | 176.7 | -173.1 | 0 | 0 | 0 | 0 | 112.4 | Y5 K6 S7 | S3-Y5 PolarHBondContact O-N 2.91Å; S3-K6 PolarHBondContact O-N 3.33Å; S3-S7 PolarHBondContact O-N 2.94Å |
| 4 | G | 71.6 | Confident | 78.6 | Confident | 36 Ų | 36 | 95.9 Ų | 95.9 | 37% | 0.371 | 52% | 0.515 | S | S | . | . | H | α-helix | trans | -62.8 | -38.3 | 177.7 | 0 | 0 | 0 | 0 | 0 | 113.9 | S2 K6 S7 W8 | S2-G4 PolarHBondContact O-N 3.2Å; S2-G4 VanDerWaalsContact O-N 3.12Å; S2-G4 PolarHBondContact OG-N 3.03Å; G4-K6 VanDerWaalsContact C-N 3.34Å; G4-K6 PolarHBondContact O-N 3.45Å; G4-S7 PolarHBondContact O-N 3.48Å; G4-W8 PolarHBondContact O-N 3.32Å; G4-W8 VanDerWaalsContact O-N 3.16Å |
| 5 | Y | 74.9 | Confident | 79.6 | Confident | 137 Ų | 137 | 95.7 Ų | 95.7 | 54% | 0.537 | 51% | 0.512 | S | S | . | . | H | α-helix | trans | -67.8 | -34.3 | -178.8 | -177.3 | -104.6 | 0 | 0 | 0 | 112.4 | M1 S2 S3 I9 | M1-Y5 HydrophobicContact CE-CD1 3.6Å; M1-Y5 HydrophobicContact CE-CE1 3.51Å; S2-Y5 PolarHBondContact O-N 3.04Å; S3-Y5 PolarHBondContact O-N 2.91Å; Y5-I9 HydrophobicContact CD1-CD1 3.62Å; Y5-I9 HydrophobicContact CE1-CD1 3.19Å; Y5-I9 HydrophobicContact CE1-CG1 4.26Å; Y5-I9 HydrophobicContact CE2-CD1 4.35Å; Y5-I9 HydrophobicContact CG-CD1 4.38Å; Y5-I9 WeakPolarHBondContact O-CG1 3.46Å; Y5-I9 PolarHBondContact O-N 3.44Å |
| 6 | K | 76.8 | Confident | 80.6 | Confident | 123 Ų | 123 | 96.9 Ų | 96.9 | 54% | 0.535 | 52% | 0.517 | S | S | . | . | H | α-helix | trans | -67.3 | -41.6 | 175.5 | -68.2 | -175.5 | 177.1 | -174.7 | 0 | 111.9 | S3 G4 I9 L10 | S3-K6 PolarHBondContact O-N 3.33Å; G4-K6 VanDerWaalsContact C-N 3.34Å; G4-K6 PolarHBondContact O-N 3.45Å; K6-I9 PolarHBondContact O-N 3.29Å; K6-L10 WeakPolarHBondContact O-CG 3.46Å; K6-L10 PolarHBondContact O-N 3.49Å |
| 7 | S | 78.8 | Confident | 81.5 | Confident | 64 Ų | 64 | 100 Ų | 100 | 45% | 0.448 | 53% | 0.526 | S | S | . | . | H | α-helix | trans | -62.2 | -42.6 | 177.1 | 179.7 | 0 | 0 | 0 | 0 | 112.3 | S3 G4 I9 L10 L11 | S3-S7 PolarHBondContact O-N 2.94Å; G4-S7 PolarHBondContact O-N 3.48Å; S7-I9 PolarHBondContact O-N 3.49Å; S7-L10 PolarHBondContact O-N 2.99Å; S7-L11 WeakPolarHBondContact O-CB 3.37Å; S7-L11 PolarHBondContact O-N 3.39Å |
| 8 | W | 84.6 | Confident | 82.3 | Confident | 178 Ų | 178 | 102.2 Ų | 102.2 | 67% | 0.674 | 53% | 0.527 | S | S | * | . | H | α-helix | trans | -66.3 | -36.1 | 176.5 | -79.8 | 105.3 | 0 | 0 | 0 | 113.9 | G4 L11 T12 | G4-W8 PolarHBondContact O-N 3.32Å; G4-W8 VanDerWaalsContact O-N 3.16Å; W8-L11 HydrophobicContact CE3-CD2 4.08Å; W8-L11 HydrophobicContact CZ3-CD2 4.01Å; W8-T12 WeakPolarHBondContact O-CB 3.37Å; W8-T12 PolarHBondContact O-N 2.93Å; W8-T12 PolarHBondContact O-OG1 3.48Å |
| 9 | I | 87.3 | Confident | 83.1 | Confident | 88 Ų | 88 | 100.5 Ų | 100.5 | 45% | 0.451 | 52% | 0.521 | S | S | . | . | H | α-helix | trans | -65 | -46.1 | 174.1 | -71.6 | 167.3 | 0 | 0 | 0 | 110.6 | Y5 K6 S7 T12 G13 | Y5-I9 HydrophobicContact CD1-CD1 3.62Å; Y5-I9 HydrophobicContact CE1-CD1 3.19Å; Y5-I9 HydrophobicContact CE1-CG1 4.26Å; Y5-I9 HydrophobicContact CE2-CD1 4.35Å; Y5-I9 HydrophobicContact CG-CD1 4.38Å; Y5-I9 WeakPolarHBondContact O-CG1 3.46Å; Y5-I9 PolarHBondContact O-N 3.44Å; K6-I9 PolarHBondContact O-N 3.29Å; S7-I9 PolarHBondContact O-N 3.49Å; I9-T12 PolarHBondContact O-N 3.21Å; I9-G13 PolarHBondContact O-N 3.45Å |
| 10 | L | 85.6 | Confident | 83.8 | Confident | 74 Ų | 74 | 98.1 Ų | 98.1 | 39% | 0.387 | 52% | 0.517 | S | S | . | . | H | α-helix | trans | -60.6 | -46.9 | 177.7 | -72.7 | 169.2 | 0 | 0 | 0 | 111.2 | K6 S7 T12 G13 F14 | K6-L10 WeakPolarHBondContact O-CG 3.46Å; K6-L10 PolarHBondContact O-N 3.49Å; S7-L10 PolarHBondContact O-N 2.99Å; L10-T12 VanDerWaalsContact C-N 3.34Å; L10-T12 PolarHBondContact O-N 2.96Å; L10-G13 WeakPolarHBondContact O-CA 3.22Å; L10-G13 PolarHBondContact O-N 3.24Å; L10-G13 VanDerWaalsContact O-N 3.13Å; L10-F14 HydrophobicContact CB-CE2 4.41Å; L10-F14 WeakPolarHBondContact O-CD2 3.4Å; L10-F14 PolarHBondContact O-N 3.42Å |
| 11 | L | 87.1 | Confident | 84.5 | Confident | 83 Ų | 83 | 100.6 Ų | 100.6 | 44% | 0.435 | 52% | 0.521 | S | S | . | . | H | α-helix | trans | -58.1 | -45.6 | 176.5 | 179.6 | 62.4 | 0 | 0 | 0 | 111.9 | S7 W8 G13 F14 I15 | S7-L11 WeakPolarHBondContact O-CB 3.37Å; S7-L11 PolarHBondContact O-N 3.39Å; W8-L11 HydrophobicContact CE3-CD2 4.08Å; W8-L11 HydrophobicContact CZ3-CD2 4.01Å; L11-G13 VanDerWaalsContact C-N 3.3Å; L11-G13 PolarHBondContact O-N 2.98Å; L11-F14 PolarHBondContact O-N 3.38Å; L11-I15 HydrophobicContact CD1-CD1 4.23Å; L11-I15 HydrophobicContact CG-CD1 4.03Å; L11-I15 WeakPolarHBondContact O-CG1 3.38Å; L11-I15 PolarHBondContact O-N 2.87Å |
| 12 | T | 90.4 | Very high | 86.6 | Confident | 73 Ų | 73 | 96.4 Ų | 96.4 | 45% | 0.448 | 50% | 0.501 | S | S | . | . | H | α-helix | trans | -63.3 | -39.7 | 177.3 | -57.4 | 0 | 0 | 0 | 0 | 111 | W8 I9 L10 I15 L16 | W8-T12 WeakPolarHBondContact O-CB 3.37Å; W8-T12 PolarHBondContact O-N 2.93Å; W8-T12 PolarHBondContact O-OG1 3.48Å; I9-T12 PolarHBondContact O-N 3.21Å; L10-T12 VanDerWaalsContact C-N 3.34Å; L10-T12 PolarHBondContact O-N 2.96Å; T12-I15 PolarHBondContact O-N 2.96Å; T12-L16 HydrophobicContact CG2-CD1 4.15Å; T12-L16 HydrophobicContact CG2-CG 4.47Å; T12-L16 WeakPolarHBondContact O-CB 3.32Å; T12-L16 VanDerWaalsContact O-CG 3.3Å; T12-L16 WeakPolarHBondContact O-CG 3.5Å; T12-L16 PolarHBondContact O-N 3.44Å |
| 13 | G | 92.6 | Very high | 88.4 | Confident | 37 Ų | 37 | 97.6 Ų | 97.6 | 38% | 0.381 | 50% | 0.5 | S | S | . | . | H | α-helix | trans | -58.1 | -46.4 | 172.4 | 0 | 0 | 0 | 0 | 0 | 113 | I9 L10 L11 L16 F17 | I9-G13 PolarHBondContact O-N 3.45Å; L10-G13 WeakPolarHBondContact O-CA 3.22Å; L10-G13 PolarHBondContact O-N 3.24Å; L10-G13 VanDerWaalsContact O-N 3.13Å; L11-G13 VanDerWaalsContact C-N 3.3Å; L11-G13 PolarHBondContact O-N 2.98Å; G13-L16 PolarHBondContact O-N 2.65Å; G13-F17 WeakPolarHBondContact O-CB 3.42Å; G13-F17 PolarHBondContact O-N 3.19Å |
| 14 | F | 90.5 | Very high | 89.9 | Confident | 96 Ų | 96 | 98.4 Ų | 98.4 | 42% | 0.421 | 50% | 0.497 | S | S | . | . | H | α-helix | trans | -62.6 | -43.3 | 176.1 | -75.8 | -60.5 | 0 | 0 | 0 | 112.7 | L10 L11 F17 Y18 F267 | L10-F14 HydrophobicContact CB-CE2 4.41Å; L10-F14 WeakPolarHBondContact O-CD2 3.4Å; L10-F14 PolarHBondContact O-N 3.42Å; L11-F14 PolarHBondContact O-N 3.38Å; F14-F17 PolarHBondContact O-N 2.99Å; F14-Y18 WeakPolarHBondContact O-CB 3.46Å; F14-Y18 PolarHBondContact O-N 3.07Å; F14-F267 AromaticContact CE1-CD1 3.99Å; F14-F267 HydrophobicContact CE1-CD1 3.99Å; F14-F267 AromaticContact CE1-CE1 3.72Å; F14-F267 HydrophobicContact CE1-CE1 3.72Å; F14-F267 HydrophobicContact CE2-CD1 4.16Å; F14-F267 AromaticContact CZ-CD1 3.31Å; F14-F267 HydrophobicContact CZ-CD1 3.31Å; F14-F267 AromaticContact CZ-CE1 3.44Å; F14-F267 HydrophobicContact CZ-CE1 3.44Å; F14-F267 VanDerWaalsContact CZ-CE1 3.44Å; F14-F267 HydrophobicContact CZ-CG 4.49Å |
| 15 | I | 93.9 | Very high | 91.1 | Very high | 93 Ų | 93 | 97.8 Ų | 97.8 | 48% | 0.477 | 49% | 0.491 | S | S | . | . | H | α-helix | trans | -62.1 | -46 | 177.8 | -67.4 | 166.9 | 0 | 0 | 0 | 110.1 | L11 T12 F17 Y18 V19 | L11-I15 HydrophobicContact CD1-CD1 4.23Å; L11-I15 HydrophobicContact CG-CD1 4.03Å; L11-I15 WeakPolarHBondContact O-CG1 3.38Å; L11-I15 PolarHBondContact O-N 2.87Å; T12-I15 PolarHBondContact O-N 2.96Å; I15-F17 PolarHBondContact O-N 3.06Å; I15-Y18 PolarHBondContact O-N 3.25Å; I15-V19 HydrophobicContact CG2-CG2 4.48Å; I15-V19 VanDerWaalsContact O-CG2 3.32Å; I15-V19 WeakPolarHBondContact O-CG2 3.39Å; I15-V19 PolarHBondContact O-N 3.02Å |
| 16 | L | 95.9 | Very high | 92.2 | Very high | 114 Ų | 114 | 94.1 Ų | 94.1 | 60% | 0.597 | 49% | 0.488 | S | S | * | . | H | α-helix | trans | -62.5 | -42.8 | 177.7 | -72.5 | 172.1 | 0 | 0 | 0 | 112.1 | T12 G13 V19 A20 | T12-L16 HydrophobicContact CG2-CD1 4.15Å; T12-L16 HydrophobicContact CG2-CG 4.47Å; T12-L16 WeakPolarHBondContact O-CB 3.32Å; T12-L16 VanDerWaalsContact O-CG 3.3Å; T12-L16 WeakPolarHBondContact O-CG 3.5Å; T12-L16 PolarHBondContact O-N 3.44Å; G13-L16 PolarHBondContact O-N 2.65Å; L16-V19 PolarHBondContact O-N 2.99Å; L16-A20 WeakPolarHBondContact O-CB 3.29Å; L16-A20 PolarHBondContact O-N 3.42Å |
| 17 | F | 95.7 | Very high | 93.2 | Very high | 150 Ų | 150 | 93.6 Ų | 93.6 | 66% | 0.658 | 49% | 0.491 | S | S | * | . | H | α-helix | trans | -62.3 | -43.6 | 175.5 | 179.9 | -98.3 | 0 | 0 | 0 | 111.8 | G13 F14 I15 A20 Y21 | G13-F17 WeakPolarHBondContact O-CB 3.42Å; G13-F17 PolarHBondContact O-N 3.19Å; F14-F17 PolarHBondContact O-N 2.99Å; I15-F17 PolarHBondContact O-N 3.06Å; F17-A20 PolarHBondContact O-N 3.03Å; F17-Y21 WeakPolarHBondContact O-CB 3.46Å; F17-Y21 PolarHBondContact O-N 3.12Å |
| 18 | Y | 95 | Very high | 94.2 | Very high | 139 Ų | 139 | 93.5 Ų | 93.5 | 55% | 0.545 | 49% | 0.488 | S | S | . | . | H | α-helix | trans | -63.5 | -42.4 | 176.9 | -178.6 | -110.2 | 0 | 0 | 0 | 112.1 | F14 I15 A20 Y21 L22 | F14-Y18 WeakPolarHBondContact O-CB 3.46Å; F14-Y18 PolarHBondContact O-N 3.07Å; I15-Y18 PolarHBondContact O-N 3.25Å; Y18-A20 VanDerWaalsContact C-N 3.35Å; Y18-A20 PolarHBondContact O-N 3.38Å; Y18-Y21 WeakPolarHBondContact O-CB 3.35Å; Y18-Y21 PolarHBondContact O-N 3.24Å; Y18-L22 HydrophobicContact CD1-CD1 4.1Å; Y18-L22 HydrophobicContact CE1-CD1 3.54Å; Y18-L22 HydrophobicContact CE1-CG 4.16Å; Y18-L22 HydrophobicContact CE2-CD2 4.45Å; Y18-L22 HydrophobicContact CE2-CG 4.4Å; Y18-L22 WeakPolarHBondContact O-CG 3.34Å; Y18-L22 PolarHBondContact O-N 3.14Å |
| 19 | V | 97.6 | Very high | 94.8 | Very high | 70 Ų | 70 | 91.7 Ų | 91.7 | 42% | 0.424 | 49% | 0.485 | S | S | . | . | H | α-helix | trans | -61.1 | -44.4 | 173.6 | 170.6 | 0 | 0 | 0 | 0 | 110.9 | I15 L16 Y21 L22 L23 | I15-V19 HydrophobicContact CG2-CG2 4.48Å; I15-V19 VanDerWaalsContact O-CG2 3.32Å; I15-V19 WeakPolarHBondContact O-CG2 3.39Å; I15-V19 PolarHBondContact O-N 3.02Å; L16-V19 PolarHBondContact O-N 2.99Å; V19-Y21 VanDerWaalsContact C-N 3.33Å; V19-Y21 PolarHBondContact O-N 2.97Å; V19-L22 PolarHBondContact O-N 3.38Å; V19-L23 HydrophobicContact CG1-CD1 4.04Å; V19-L23 HydrophobicContact CG1-CG 4.39Å; V19-L23 WeakPolarHBondContact O-CG 3.39Å; V19-L23 PolarHBondContact O-N 3.42Å |
| 20 | A | 97.8 | Very high | 95.3 | Very high | 53 Ų | 53 | 90.3 Ų | 90.3 | 44% | 0.438 | 48% | 0.483 | S | S | . | . | H | α-helix | trans | -61.6 | -40.4 | 176.1 | 0 | 0 | 0 | 0 | 0 | 112.2 | L16 F17 Y18 L23 L24 | L16-A20 WeakPolarHBondContact O-CB 3.29Å; L16-A20 PolarHBondContact O-N 3.42Å; F17-A20 PolarHBondContact O-N 3.03Å; Y18-A20 VanDerWaalsContact C-N 3.35Å; Y18-A20 PolarHBondContact O-N 3.38Å; A20-L23 PolarHBondContact O-N 3.41Å; A20-L24 WeakPolarHBondContact O-CB 3.45Å; A20-L24 PolarHBondContact O-N 3.49Å |
| 21 | Y | 97.4 | Very high | 95.9 | Very high | 151 Ų | 151 | 90.9 Ų | 90.9 | 59% | 0.592 | 49% | 0.489 | S | S | * | . | H | α-helix | trans | -60.7 | -44.4 | 174.6 | 178.2 | -97.9 | 0 | 0 | 0 | 112 | F17 Y18 V19 L24 G25 | F17-Y21 WeakPolarHBondContact O-CB 3.46Å; F17-Y21 PolarHBondContact O-N 3.12Å; Y18-Y21 WeakPolarHBondContact O-CB 3.35Å; Y18-Y21 PolarHBondContact O-N 3.24Å; V19-Y21 VanDerWaalsContact C-N 3.33Å; V19-Y21 PolarHBondContact O-N 2.97Å; Y21-L24 PolarHBondContact O-N 2.9Å; Y21-G25 PolarHBondContact O-N 2.98Å |
| 22 | L | 97.9 | Very high | 96.4 | Very high | 85 Ų | 85 | 91.6 Ų | 91.6 | 45% | 0.445 | 49% | 0.493 | S | S | . | . | H | α-helix | trans | -65.4 | -40.9 | 175.7 | -69 | -179.2 | 0 | 0 | 0 | 112.6 | Y18 V19 L24 G25 A26 | Y18-L22 HydrophobicContact CD1-CD1 4.1Å; Y18-L22 HydrophobicContact CE1-CD1 3.54Å; Y18-L22 HydrophobicContact CE1-CG 4.16Å; Y18-L22 HydrophobicContact CE2-CD2 4.45Å; Y18-L22 HydrophobicContact CE2-CG 4.4Å; Y18-L22 WeakPolarHBondContact O-CG 3.34Å; Y18-L22 PolarHBondContact O-N 3.14Å; V19-L22 PolarHBondContact O-N 3.38Å; L22-L24 VanDerWaalsContact C-N 3.35Å; L22-G25 PolarHBondContact O-N 3.3Å; L22-A26 WeakPolarHBondContact O-CB 3.44Å; L22-A26 PolarHBondContact O-N 3.04Å |
| 23 | L | 98.2 | Very high | 96.7 | Very high | 116 Ų | 116 | 93 Ų | 93 | 61% | 0.607 | 49% | 0.494 | S | S | * | . | H | α-helix | trans | -64.4 | -40.3 | 176.9 | -71.7 | 173.4 | 0 | 0 | 0 | 111.8 | V19 A20 A26 L27 | V19-L23 HydrophobicContact CG1-CD1 4.04Å; V19-L23 HydrophobicContact CG1-CG 4.39Å; V19-L23 WeakPolarHBondContact O-CG 3.39Å; V19-L23 PolarHBondContact O-N 3.42Å; A20-L23 PolarHBondContact O-N 3.41Å; L23-A26 PolarHBondContact O-N 3.04Å; L23-L27 PolarHBondContact O-N 3.35Å |
| 24 | L | 97.9 | Very high | 96.9 | Very high | 106 Ų | 106 | 98.5 Ų | 98.5 | 56% | 0.555 | 50% | 0.503 | S | S | * | . | H | α-helix | trans | -61.1 | -48.4 | 173 | 178.5 | 64.8 | 0 | 0 | 0 | 110.7 | A20 Y21 L22 A26 L27 V28 | A20-L24 WeakPolarHBondContact O-CB 3.45Å; A20-L24 PolarHBondContact O-N 3.49Å; Y21-L24 PolarHBondContact O-N 2.9Å; L22-L24 VanDerWaalsContact C-N 3.35Å; L24-A26 PolarHBondContact O-N 3.49Å; L24-L27 PolarHBondContact O-N 3.43Å; L24-V28 HydrophobicContact CD1-CG2 4.34Å; L24-V28 WeakPolarHBondContact O-CG2 3.36Å; L24-V28 PolarHBondContact O-N 2.9Å |
| 25 | G | 97.6 | Very high | 97.3 | Very high | 24 Ų | 24 | 97.6 Ų | 97.6 | 25% | 0.247 | 51% | 0.507 | C | S | . | . | H | α-helix | trans | -57.6 | -46.2 | 176.2 | 0 | 0 | 0 | 0 | 0 | 112.4 | Y21 L22 L27 V28 F29 | Y21-G25 PolarHBondContact O-N 2.98Å; L22-G25 PolarHBondContact O-N 3.3Å; G25-L27 VanDerWaalsContact C-N 3.34Å; G25-L27 PolarHBondContact O-N 3.27Å; G25-V28 PolarHBondContact O-N 3.06Å; G25-F29 WeakPolarHBondContact O-CD2 3.47Å; G25-F29 PolarHBondContact O-N 2.61Å |
| 26 | A | 97.9 | Very high | 97.4 | Very high | 59 Ų | 59 | 97.3 Ų | 97.3 | 49% | 0.488 | 51% | 0.51 | S | S | . | . | H | α-helix | trans | -60.4 | -41.5 | 177.8 | 0 | 0 | 0 | 0 | 0 | 112.5 | L22 L23 L24 S30 | L22-A26 WeakPolarHBondContact O-CB 3.44Å; L22-A26 PolarHBondContact O-N 3.04Å; L23-A26 PolarHBondContact O-N 3.04Å; L24-A26 PolarHBondContact O-N 3.49Å; A26-S30 WeakPolarHBondContact O-CB 3.44Å; A26-S30 PolarHBondContact O-N 3.18Å |
| 27 | L | 98.2 | Very high | 97.4 | Very high | 112 Ų | 112 | 96.5 Ų | 96.5 | 59% | 0.586 | 50% | 0.503 | S | S | * | . | H | α-helix | trans | -64.8 | -45.9 | 176 | -179.6 | 64.8 | 0 | 0 | 0 | 111.5 | L23 L24 G25 S30 T31 | L23-L27 PolarHBondContact O-N 3.35Å; L24-L27 PolarHBondContact O-N 3.43Å; G25-L27 VanDerWaalsContact C-N 3.34Å; G25-L27 PolarHBondContact O-N 3.27Å; L27-S30 PolarHBondContact O-N 2.83Å; L27-T31 HydrophobicContact CD1-CG2 4.2Å; L27-T31 WeakPolarHBondContact O-CB 3.34Å; L27-T31 VanDerWaalsContact O-CG2 3.28Å; L27-T31 WeakPolarHBondContact O-CG2 3.42Å; L27-T31 PolarHBondContact O-N 3.18Å; L27-T31 PolarHBondContact O-OG1 3.33Å |
| 28 | V | 98.3 | Very high | 97.5 | Very high | 63 Ų | 63 | 93.1 Ų | 93.1 | 38% | 0.382 | 49% | 0.492 | S | S | . | . | H | α-helix | trans | -63.5 | -49.3 | 179.9 | 172.9 | 0 | 0 | 0 | 0 | 110.8 | L24 G25 S30 T31 I32 | L24-V28 HydrophobicContact CD1-CG2 4.34Å; L24-V28 WeakPolarHBondContact O-CG2 3.36Å; L24-V28 PolarHBondContact O-N 2.9Å; G25-V28 PolarHBondContact O-N 3.06Å; V28-S30 PolarHBondContact O-N 2.93Å; V28-T31 PolarHBondContact O-N 3.41Å; V28-T31 PolarHBondContact O-OG1 2.81Å; V28-I32 HydrophobicContact CG1-CD1 3.65Å; V28-I32 WeakPolarHBondContact O-CG1 3.48Å; V28-I32 PolarHBondContact O-N 3.31Å |
| 29 | F | 97.6 | Very high | 97.6 | Very high | 139 Ų | 139 | 93 Ų | 93 | 61% | 0.61 | 49% | 0.494 | S | S | * | . | H | α-helix | trans | -62 | -44.3 | 176.6 | -75.5 | -59.2 | 0 | 0 | 0 | 112.1 | G25 T31 I32 E33 | G25-F29 WeakPolarHBondContact O-CD2 3.47Å; G25-F29 PolarHBondContact O-N 2.61Å; F29-T31 VanDerWaalsContact C-N 3.26Å; F29-T31 PolarHBondContact O-N 2.9Å; F29-I32 PolarHBondContact O-N 3.32Å; F29-E33 WeakPolarHBondContact O-CB 3.44Å; F29-E33 PolarHBondContact O-N 2.92Å |
| 30 | S | 97.8 | Very high | 97.5 | Very high | 59 Ų | 59 | 94.7 Ų | 94.7 | 41% | 0.413 | 50% | 0.5 | S | S | . | . | H | α-helix | trans | -63.4 | -32.3 | 179.7 | -176.9 | 0 | 0 | 0 | 0 | 112.7 | A26 L27 V28 R34 | A26-S30 WeakPolarHBondContact O-CB 3.44Å; A26-S30 PolarHBondContact O-N 3.18Å; L27-S30 PolarHBondContact O-N 2.83Å; V28-S30 PolarHBondContact O-N 2.93Å; S30-R34 WeakPolarHBondContact O-CB 3.43Å |
| 31 | T | 97.8 | Very high | 97.3 | Very high | 86 Ų | 86 | 97.2 Ų | 97.2 | 53% | 0.528 | 50% | 0.501 | S | S | . | . | H | α-helix | trans | -79.5 | -33.4 | 179.2 | 50.6 | 0 | 0 | 0 | 0 | 112.9 | L27 V28 F29 P35 | L27-T31 HydrophobicContact CD1-CG2 4.2Å; L27-T31 WeakPolarHBondContact O-CB 3.34Å; L27-T31 VanDerWaalsContact O-CG2 3.28Å; L27-T31 WeakPolarHBondContact O-CG2 3.42Å; L27-T31 PolarHBondContact O-N 3.18Å; L27-T31 PolarHBondContact O-OG1 3.33Å; V28-T31 PolarHBondContact O-N 3.41Å; V28-T31 PolarHBondContact O-OG1 2.81Å; F29-T31 VanDerWaalsContact C-N 3.26Å; F29-T31 PolarHBondContact O-N 2.9Å; T31-P35 WeakPolarHBondContact O-CD 3.47Å |
| 32 | I | 97.8 | Very high | 97.2 | Very high | 99 Ų | 99 | 92.9 Ų | 92.9 | 51% | 0.508 | 49% | 0.493 | S | S | . | . | H | α-helix | trans | -83.3 | -45.9 | -179 | -64.2 | 172.6 | 0 | 0 | 0 | 111.7 | V28 F29 P35 | V28-I32 HydrophobicContact CG1-CD1 3.65Å; V28-I32 WeakPolarHBondContact O-CG1 3.48Å; V28-I32 PolarHBondContact O-N 3.31Å; F29-I32 PolarHBondContact O-N 3.32Å; I32-P35 WeakPolarHBondContact O-CD 3.43Å; I32-P35 WeakPolarHBondContact O-CG 3.36Å |
| 33 | E | 97.5 | Very high | 97.2 | Very high | 103 Ų | 103 | 92.9 Ų | 92.9 | 48% | 0.481 | 49% | 0.494 | S | S | . | . | H | α-helix | trans | -87.5 | -34.3 | -169.5 | -66.4 | -59.7 | 150.6 | 0 | 0 | 113.8 | F29 V36 E37 | F29-E33 WeakPolarHBondContact O-CB 3.44Å; F29-E33 PolarHBondContact O-N 2.92Å; E33-V36 WeakPolarHBondContact O-CB 3Å; E33-V36 PolarHBondContact O-N 3.33Å; E33-E37 PolarHBondContact O-N 3.3Å |
| 34 | R | 97.1 | Very high | 96.9 | Very high | 151 Ų | 151 | 92 Ų | 92 | 57% | 0.57 | 49% | 0.488 | S | S | * | . | H | α-helix | trans | -54.2 | -45.5 | -178.7 | -171.8 | 174.3 | -176.7 | 171.9 | 3.1 | 114.4 | S30 V36 E37 D38 | S30-R34 WeakPolarHBondContact O-CB 3.43Å; R34-V36 VanDerWaalsContact C-N 3.28Å; R34-V36 PolarHBondContact O-N 3.06Å; R34-E37 PolarHBondContact O-N 3.28Å; R34-D38 WeakPolarHBondContact O-CB 3.4Å; R34-D38 VanDerWaalsContact O-CG 3.32Å; R34-D38 PolarHBondContact O-N 2.9Å |
| 35 | P | 97.8 | Very high | 96.7 | Very high | 77 Ų | 77 | 92.8 Ų | 92.8 | 50% | 0.5 | 49% | 0.489 | S | S | . | . | H | α-helix | trans | -65.3 | -31.3 | 177.4 | 25.3 | -34.7 | 0 | 0 | 0 | 113.1 | T31 I32 K39 | T31-P35 WeakPolarHBondContact O-CD 3.47Å; I32-P35 WeakPolarHBondContact O-CD 3.43Å; I32-P35 WeakPolarHBondContact O-CG 3.36Å; P35-K39 WeakPolarHBondContact O-CB 3.4Å; P35-K39 PolarHBondContact O-N 2.86Å; P35-K39 VanDerWaalsContact O-N 3.12Å |
| 36 | V | 97 | Very high | 96.7 | Very high | 88 Ų | 88 | 95.5 Ų | 95.5 | 53% | 0.533 | 50% | 0.501 | S | S | . | . | H | α-helix | trans | -70.7 | -43.6 | 176.2 | -177.9 | 0 | 0 | 0 | 0 | 110.2 | E33 R34 K39 L40 | E33-V36 WeakPolarHBondContact O-CB 3Å; E33-V36 PolarHBondContact O-N 3.33Å; R34-V36 VanDerWaalsContact C-N 3.28Å; R34-V36 PolarHBondContact O-N 3.06Å; V36-K39 PolarHBondContact O-N 3.16Å; V36-L40 PolarHBondContact O-N 3.18Å |
| 37 | E | 96.1 | Very high | 96.5 | Very high | 96 Ų | 96 | 98.1 Ų | 98.1 | 45% | 0.449 | 51% | 0.506 | S | S | . | . | H | α-helix | trans | -60.7 | -48 | 175.3 | -171.7 | -167 | 172.6 | 0 | 0 | 111.8 | E33 R34 K39 L40 K41 | E33-E37 PolarHBondContact O-N 3.3Å; R34-E37 PolarHBondContact O-N 3.28Å; E37-K39 VanDerWaalsContact C-N 3.3Å; E37-K39 PolarHBondContact O-N 3.17Å; E37-L40 PolarHBondContact O-N 2.62Å; E37-K41 HydrophobicContact CG-CD 4.32Å; E37-K41 WeakPolarHBondContact O-CG 3.24Å; E37-K41 PolarHBondContact O-N 2.98Å; E37-K41 VanDerWaalsContact OE1-CE 3.24Å; E37-K41 WeakPolarHBondContact OE1-CE 3.28Å; E37-K41 IonicContact OE1-NZ 3.96Å; E37-K41 PolarHBondContact OE1-NZ 2.66Å |
| 38 | D | 97.1 | Very high | 96.2 | Very high | 80 Ų | 80 | 96.1 Ų | 96.1 | 43% | 0.428 | 49% | 0.492 | S | S | . | . | H | α-helix | trans | -62.9 | -39.1 | -179.7 | -73.9 | -24.7 | 0 | 0 | 0 | 111.1 | R34 K41 S42 | R34-D38 WeakPolarHBondContact O-CB 3.4Å; R34-D38 VanDerWaalsContact O-CG 3.32Å; R34-D38 PolarHBondContact O-N 2.9Å; D38-K41 PolarHBondContact O-N 2.76Å; D38-S42 PolarHBondContact O-N 3.37Å |
| 39 | K | 97.1 | Very high | 95.9 | Very high | 137 Ų | 137 | 99 Ų | 99 | 60% | 0.596 | 50% | 0.502 | S | S | * | . | H | α-helix | trans | -63.4 | -48.2 | 173.6 | -174.8 | 179.9 | 177.4 | -174.6 | 0 | 111.6 | P35 V36 E37 K41 S42 D43 | P35-K39 WeakPolarHBondContact O-CB 3.4Å; P35-K39 PolarHBondContact O-N 2.86Å; P35-K39 VanDerWaalsContact O-N 3.12Å; V36-K39 PolarHBondContact O-N 3.16Å; E37-K39 VanDerWaalsContact C-N 3.3Å; E37-K39 PolarHBondContact O-N 3.17Å; K39-K41 VanDerWaalsContact C-N 3.31Å; K39-K41 PolarHBondContact O-N 3.22Å; K39-S42 WeakPolarHBondContact O-CB 3.27Å; K39-S42 PolarHBondContact O-N 3.41Å; K39-S42 VanDerWaalsContact O-N 3.14Å; K39-D43 VanDerWaalsContact O-CG 3.28Å; K39-D43 PolarHBondContact O-N 2.76Å |
| 40 | L | 95.1 | Very high | 95.8 | Very high | 104 Ų | 104 | 97.1 Ų | 97.1 | 55% | 0.545 | 50% | 0.495 | S | S | . | . | H | α-helix | trans | -61.5 | -39.5 | 179.2 | -178.8 | 61.6 | 0 | 0 | 0 | 112 | V36 E37 D43 I44 | V36-L40 PolarHBondContact O-N 3.18Å; E37-L40 PolarHBondContact O-N 2.62Å; L40-D43 PolarHBondContact O-N 3.4Å; L40-I44 HydrophobicContact CD1-CD1 4.12Å; L40-I44 HydrophobicContact CD1-CG1 4.34Å; L40-I44 HydrophobicContact CG-CD1 4.07Å; L40-I44 WeakPolarHBondContact O-CG1 3.48Å; L40-I44 PolarHBondContact O-N 3.29Å |
| 41 | K | 94.1 | Very high | 95.6 | Very high | 106 Ų | 106 | 99 Ų | 99 | 46% | 0.461 | 50% | 0.496 | S | S | . | . | H | α-helix | trans | -60 | -46 | 173.5 | -79.8 | 170.5 | 170.6 | 165.4 | 0 | 111.6 | E37 D38 K39 Q45 | E37-K41 HydrophobicContact CG-CD 4.32Å; E37-K41 WeakPolarHBondContact O-CG 3.24Å; E37-K41 PolarHBondContact O-N 2.98Å; E37-K41 VanDerWaalsContact OE1-CE 3.24Å; E37-K41 WeakPolarHBondContact OE1-CE 3.28Å; E37-K41 IonicContact OE1-NZ 3.96Å; E37-K41 PolarHBondContact OE1-NZ 2.66Å; D38-K41 PolarHBondContact O-N 2.76Å; K39-K41 VanDerWaalsContact C-N 3.31Å; K39-K41 PolarHBondContact O-N 3.22Å; K41-Q45 VanDerWaalsContact O-CG 3.29Å; K41-Q45 WeakPolarHBondContact O-CG 3.32Å; K41-Q45 PolarHBondContact O-N 3.25Å |
| 42 | S | 96.4 | Very high | 95.4 | Very high | 60 Ų | 60 | 96.9 Ų | 96.9 | 42% | 0.42 | 48% | 0.481 | S | S | . | . | H | α-helix | trans | -61.6 | -46.9 | 176.2 | -175.5 | 0 | 0 | 0 | 0 | 111.4 | D38 K39 I44 Q45 V46 | D38-S42 PolarHBondContact O-N 3.37Å; K39-S42 WeakPolarHBondContact O-CB 3.27Å; K39-S42 PolarHBondContact O-N 3.41Å; K39-S42 VanDerWaalsContact O-N 3.14Å; S42-I44 PolarHBondContact O-N 3.49Å; S42-Q45 PolarHBondContact O-N 2.84Å; S42-V46 WeakPolarHBondContact O-CG2 3.23Å; S42-V46 PolarHBondContact O-N 3.15Å |
| 43 | D | 96.2 | Very high | 95.2 | Very high | 86 Ų | 86 | 99 Ų | 99 | 46% | 0.46 | 49% | 0.493 | S | S | . | . | H | α-helix | trans | -62 | -41.7 | -178.5 | -68.5 | -15.5 | 0 | 0 | 0 | 111.5 | K39 L40 V46 L47 | K39-D43 VanDerWaalsContact O-CG 3.28Å; K39-D43 PolarHBondContact O-N 2.76Å; L40-D43 PolarHBondContact O-N 3.4Å; D43-V46 PolarHBondContact O-N 2.8Å; D43-L47 WeakPolarHBondContact O-CB 3.4Å; D43-L47 PolarHBondContact O-N 2.87Å |
| 44 | I | 93.6 | Very high | 95 | Very high | 96 Ų | 96 | 101 Ų | 101 | 49% | 0.492 | 50% | 0.503 | S | S | . | . | H | α-helix | trans | -66.3 | -38.8 | 175.8 | -70.1 | 171.7 | 0 | 0 | 0 | 111.7 | L40 S42 L47 K48 | L40-I44 HydrophobicContact CD1-CD1 4.12Å; L40-I44 HydrophobicContact CD1-CG1 4.34Å; L40-I44 HydrophobicContact CG-CD1 4.07Å; L40-I44 WeakPolarHBondContact O-CG1 3.48Å; L40-I44 PolarHBondContact O-N 3.29Å; S42-I44 PolarHBondContact O-N 3.49Å; I44-L47 PolarHBondContact O-N 3.43Å; I44-K48 WeakPolarHBondContact O-CB 3.28Å; I44-K48 PolarHBondContact O-N 3.46Å |
| 45 | Q | 93.8 | Very high | 94.7 | Very high | 123 Ų | 123 | 95.4 Ų | 95.4 | 58% | 0.575 | 49% | 0.487 | S | S | * | . | H | α-helix | trans | -64.2 | -46.4 | 177.1 | -76.9 | 175.8 | -5 | 0 | 0 | 111.4 | K41 S42 L47 K48 E49 | K41-Q45 VanDerWaalsContact O-CG 3.29Å; K41-Q45 WeakPolarHBondContact O-CG 3.32Å; K41-Q45 PolarHBondContact O-N 3.25Å; S42-Q45 PolarHBondContact O-N 2.84Å; Q45-L47 VanDerWaalsContact C-N 3.33Å; Q45-L47 PolarHBondContact O-N 2.83Å; Q45-K48 WeakPolarHBondContact O-CB 3.35Å; Q45-K48 PolarHBondContact O-N 3.44Å; Q45-E49 WeakPolarHBondContact O-CG 3.32Å; Q45-E49 PolarHBondContact O-N 2.89Å |
| 46 | V | 95.9 | Very high | 94.3 | Very high | 81 Ų | 81 | 98.6 Ų | 98.6 | 49% | 0.491 | 51% | 0.509 | S | S | . | . | H | α-helix | trans | -59.3 | -45.9 | 175.8 | 172.4 | 0 | 0 | 0 | 0 | 110.7 | S42 D43 K48 E49 E50 | S42-V46 WeakPolarHBondContact O-CG2 3.23Å; S42-V46 PolarHBondContact O-N 3.15Å; D43-V46 PolarHBondContact O-N 2.8Å; V46-K48 VanDerWaalsContact C-N 3.32Å; V46-K48 PolarHBondContact O-N 2.93Å; V46-E49 PolarHBondContact O-N 2.95Å; V46-E50 WeakPolarHBondContact O-CB 3.46Å; V46-E50 PolarHBondContact O-N 3.01Å |
| 47 | L | 94.3 | Very high | 94.1 | Very high | 114 Ų | 114 | 97.4 Ų | 97.4 | 60% | 0.597 | 50% | 0.502 | S | S | * | . | H | α-helix | trans | -61.5 | -39.5 | 177.9 | -175.6 | 66.1 | 0 | 0 | 0 | 112.4 | D43 I44 Q45 F51 | D43-L47 WeakPolarHBondContact O-CB 3.4Å; D43-L47 PolarHBondContact O-N 2.87Å; I44-L47 PolarHBondContact O-N 3.43Å; Q45-L47 VanDerWaalsContact C-N 3.33Å; Q45-L47 PolarHBondContact O-N 2.83Å; L47-F51 WeakPolarHBondContact O-CB 3.34Å; L47-F51 PolarHBondContact O-N 3.44Å |
| 48 | K | 92.8 | Very high | 93.9 | Very high | 70 Ų | 70 | 97.8 Ų | 97.8 | 30% | 0.304 | 51% | 0.507 | S | S | . | . | H | α-helix | trans | -63.7 | -45.1 | 176.2 | -179.8 | -173.4 | 173.9 | -171.3 | 0 | 111.3 | I44 Q45 V46 F51 L52 L62 E63 | I44-K48 WeakPolarHBondContact O-CB 3.28Å; I44-K48 PolarHBondContact O-N 3.46Å; Q45-K48 WeakPolarHBondContact O-CB 3.35Å; Q45-K48 PolarHBondContact O-N 3.44Å; V46-K48 VanDerWaalsContact C-N 3.32Å; V46-K48 PolarHBondContact O-N 2.93Å; K48-F51 PolarHBondContact O-N 3.23Å; K48-L52 HydrophobicContact CG-CD1 4.15Å; K48-L52 VanDerWaalsContact O-CG 3.32Å; K48-L52 WeakPolarHBondContact O-CG 3.15Å; K48-L52 PolarHBondContact O-N 3.38Å; K48-L62 HydrophobicContact CG-CD2 4.24Å; K48-E63 IonicContact NZ-OE1 2.63Å; K48-E63 PolarHBondContact NZ-OE1 3.4Å |
| 49 | E | 92.1 | Very high | 93.5 | Very high | 125 Ų | 125 | 95.6 Ų | 95.6 | 58% | 0.584 | 50% | 0.5 | S | S | * | . | H | α-helix | trans | -64.8 | -42.6 | 177.9 | -72.2 | -179.3 | -177.8 | 0 | 0 | 111.7 | Q45 V46 F51 L52 N53 | Q45-E49 WeakPolarHBondContact O-CG 3.32Å; Q45-E49 PolarHBondContact O-N 2.89Å; V46-E49 PolarHBondContact O-N 2.95Å; E49-F51 PolarHBondContact O-N 2.98Å; E49-L52 PolarHBondContact O-N 3.26Å; E49-N53 WeakPolarHBondContact O-CB 3.31Å; E49-N53 PolarHBondContact O-N 2.82Å; E49-N53 PolarHBondContact O-ND2 2.91Å |
| 50 | E | 94.6 | Very high | 93.2 | Very high | 99 Ų | 99 | 92.8 Ų | 92.8 | 46% | 0.463 | 50% | 0.495 | S | S | . | . | H | α-helix | trans | -60 | -45.8 | 175.4 | -174.6 | 174.8 | -173.8 | 0 | 0 | 111.4 | V46 L52 N53 Q54 | V46-E50 WeakPolarHBondContact O-CB 3.46Å; V46-E50 PolarHBondContact O-N 3.01Å; E50-L52 PolarHBondContact O-N 3.17Å; E50-N53 PolarHBondContact O-N 3.17Å; E50-Q54 WeakPolarHBondContact O-CG 3.5Å; E50-Q54 PolarHBondContact O-N 3.47Å; E50-Q54 PolarHBondContact OE1-NE2 3.01Å |
| 51 | F | 94.5 | Very high | 93.1 | Very high | 97 Ų | 97 | 91 Ų | 91 | 43% | 0.425 | 49% | 0.491 | S | S | . | . | H | α-helix | trans | -62.7 | -42.9 | 177.2 | -176.5 | -91.5 | 0 | 0 | 0 | 112.2 | L47 K48 E49 N53 Q54 S55 L62 | L47-F51 WeakPolarHBondContact O-CB 3.34Å; L47-F51 PolarHBondContact O-N 3.44Å; K48-F51 PolarHBondContact O-N 3.23Å; E49-F51 PolarHBondContact O-N 2.98Å; F51-N53 VanDerWaalsContact C-N 3.32Å; F51-N53 PolarHBondContact O-N 3.37Å; F51-Q54 PolarHBondContact O-N 2.84Å; F51-S55 VanDerWaalsContact O-CB 3.22Å; F51-S55 WeakPolarHBondContact O-CB 3.36Å; F51-S55 PolarHBondContact O-N 2.79Å; F51-S55 PolarHBondContact O-OG 3.42Å; F51-L62 HydrophobicContact CD1-CD1 4.25Å; F51-L62 HydrophobicContact CD1-CD2 3.72Å; F51-L62 HydrophobicContact CE1-CD1 3.92Å; F51-L62 HydrophobicContact CE1-CD2 4.16Å |
| 52 | L | 93.7 | Very high | 93 | Very high | 42 Ų | 42 | 87.4 Ų | 87.4 | 22% | 0.22 | 48% | 0.477 | C | S | . | . | H | α-helix | trans | -65.7 | -34.8 | 177.5 | -72.9 | 171.3 | 0 | 0 | 0 | 112.3 | K48 E49 E50 S55 V57 A59 L62 | K48-L52 HydrophobicContact CG-CD1 4.15Å; K48-L52 VanDerWaalsContact O-CG 3.32Å; K48-L52 WeakPolarHBondContact O-CG 3.15Å; K48-L52 PolarHBondContact O-N 3.38Å; E49-L52 PolarHBondContact O-N 3.26Å; E50-L52 PolarHBondContact O-N 3.17Å; L52-S55 VanDerWaalsContact O-O 3.06Å; L52-V57 WeakPolarHBondContact CD2-O 2.98Å; L52-A59 HydrophobicContact CD1-CB 3.94Å; L52-A59 HydrophobicContact CD2-CB 4.36Å; L52-L62 HydrophobicContact CD2-CB 4.44Å; L52-L62 HydrophobicContact CD2-CD2 3.79Å; L52-L62 HydrophobicContact CG-CD2 4Å |
| 53 | N | 92.8 | Very high | 92.8 | Very high | 143 Ų | 143 | 89 Ų | 89 | 77% | 0.765 | 48% | 0.477 | S | S | * | . | H | α-helix | trans | -71 | -33.4 | 176 | -77.2 | -22 | 0 | 0 | 0 | 112.8 | E49 E50 F51 | E49-N53 WeakPolarHBondContact O-CB 3.31Å; E49-N53 PolarHBondContact O-N 2.82Å; E49-N53 PolarHBondContact O-ND2 2.91Å; E50-N53 PolarHBondContact O-N 3.17Å; F51-N53 VanDerWaalsContact C-N 3.32Å; F51-N53 PolarHBondContact O-N 3.37Å |
| 54 | Q | 93.6 | Very high | 92.7 | Very high | 147 Ų | 147 | 89 Ų | 89 | 69% | 0.687 | 48% | 0.477 | S | S | * | . | H | α-helix | trans | -85 | -14 | 179.7 | -69 | 177 | 7.9 | 0 | 0 | 113.5 | E50 F51 | E50-Q54 WeakPolarHBondContact O-CG 3.5Å; E50-Q54 PolarHBondContact O-N 3.47Å; E50-Q54 PolarHBondContact OE1-NE2 3.01Å; F51-Q54 PolarHBondContact O-N 2.84Å |
| 55 | S | 90.1 | Very high | 92.6 | Very high | 32 Ų | 32 | 90.7 Ų | 90.7 | 22% | 0.224 | 48% | 0.481 | C | S | . | . | S | Bend | trans | -119.7 | 161.9 | -172.4 | 68.8 | 0 | 0 | 0 | 0 | 112.9 | F51 L52 V57 | F51-S55 VanDerWaalsContact O-CB 3.22Å; F51-S55 WeakPolarHBondContact O-CB 3.36Å; F51-S55 PolarHBondContact O-N 2.79Å; F51-S55 PolarHBondContact O-OG 3.42Å; L52-S55 VanDerWaalsContact O-O 3.06Å; S55-V57 PolarHBondContact O-N 3.22Å |
| 56 | C | 89.8 | Confident | 92.4 | Very high | 145 Ų | 145 | 88.8 Ų | 88.8 | 98% | 0.98 | 48% | 0.475 | S | S | * | . | S | Bend | trans | -90.3 | 20 | 175.7 | -52.2 | 0 | 0 | 0 | 0 | 112.6 | ||
| 57 | V | 92.4 | Very high | 92.2 | Very high | 63 Ų | 63 | 91 Ų | 91 | 38% | 0.382 | 48% | 0.48 | S | S | . | . | trans | -92.6 | 135.3 | -171.4 | -176.9 | 0 | 0 | 0 | 0 | 110.4 | L52 S55 L62 | L52-V57 WeakPolarHBondContact CD2-O 2.98Å; S55-V57 PolarHBondContact O-N 3.22Å; V57-L62 HydrophobicContact CG1-CB 4.13Å | ||
| 58 | N | 91.3 | Very high | 92 | Very high | 103 Ų | 103 | 92.6 Ų | 92.6 | 55% | 0.551 | 48% | 0.482 | S | S | * | . | trans | -71.1 | 140.1 | 173.2 | -172.8 | 14 | 0 | 0 | 0 | 111 | T60 S61 L62 | N58-T60 VanDerWaalsContact C-N 3.3Å; N58-T60 PolarHBondContact O-N 3.17Å; N58-S61 WeakPolarHBondContact O-CB 3.23Å; N58-S61 PolarHBondContact O-N 3.2Å; N58-L62 PolarHBondContact O-N 2.99Å | ||
| 59 | A | 90.2 | Very high | 91.8 | Very high | 35 Ų | 35 | 91 Ų | 91 | 29% | 0.289 | 48% | 0.478 | S | S | . | . | H | α-helix | trans | -53.7 | -44.2 | -178.3 | 0 | 0 | 0 | 0 | 0 | 112.8 | L52 S61 L62 E63 | L52-A59 HydrophobicContact CD1-CB 3.94Å; L52-A59 HydrophobicContact CD2-CB 4.36Å; A59-S61 VanDerWaalsContact C-N 3.34Å; A59-S61 PolarHBondContact O-N 3.42Å; A59-L62 PolarHBondContact O-N 2.94Å; A59-E63 WeakPolarHBondContact O-CG 3.16Å; A59-E63 PolarHBondContact O-N 3.41Å |
| 60 | T | 91.1 | Very high | 91.5 | Very high | 77 Ų | 77 | 89.8 Ų | 89.8 | 47% | 0.472 | 48% | 0.475 | S | S | . | . | H | α-helix | trans | -65.3 | -36.3 | 178.8 | -45.1 | 0 | 0 | 0 | 0 | 112.5 | N58 E63 N64 | N58-T60 VanDerWaalsContact C-N 3.3Å; N58-T60 PolarHBondContact O-N 3.17Å; T60-E63 PolarHBondContact O-N 2.99Å; T60-N64 WeakPolarHBondContact O-CB 3.22Å; T60-N64 VanDerWaalsContact O-CG 3.3Å; T60-N64 PolarHBondContact O-N 2.96Å; T60-N64 PolarHBondContact O-ND2 3.49Å |
| 61 | S | 92.3 | Very high | 91.1 | Very high | 67 Ų | 67 | 90 Ų | 90 | 47% | 0.469 | 48% | 0.476 | S | S | . | . | H | α-helix | trans | -68.5 | -38.4 | 177.5 | -60.7 | 0 | 0 | 0 | 0 | 111.3 | N58 A59 F65 | N58-S61 WeakPolarHBondContact O-CB 3.23Å; N58-S61 PolarHBondContact O-N 3.2Å; A59-S61 VanDerWaalsContact C-N 3.34Å; A59-S61 PolarHBondContact O-N 3.42Å; S61-F65 WeakPolarHBondContact O-CB 3.07Å; S61-F65 PolarHBondContact O-N 2.76Å |
| 62 | L | 92.2 | Very high | 90.5 | Very high | 31 Ų | 31 | 86.5 Ų | 86.5 | 16% | 0.162 | 47% | 0.465 | C | S | . | . | H | α-helix | trans | -65.7 | -43.1 | 175 | -179.1 | 61.9 | 0 | 0 | 0 | 111.7 | K48 F51 L52 V57 N58 A59 F65 L66 | K48-L62 HydrophobicContact CG-CD2 4.24Å; F51-L62 HydrophobicContact CD1-CD1 4.25Å; F51-L62 HydrophobicContact CD1-CD2 3.72Å; F51-L62 HydrophobicContact CE1-CD1 3.92Å; F51-L62 HydrophobicContact CE1-CD2 4.16Å; L52-L62 HydrophobicContact CD2-CB 4.44Å; L52-L62 HydrophobicContact CD2-CD2 3.79Å; L52-L62 HydrophobicContact CG-CD2 4Å; V57-L62 HydrophobicContact CG1-CB 4.13Å; N58-L62 PolarHBondContact O-N 2.99Å; A59-L62 PolarHBondContact O-N 2.94Å; L62-F65 PolarHBondContact O-N 3.31Å; L62-L66 WeakPolarHBondContact O-CB 3.31Å; L62-L66 PolarHBondContact O-N 2.8Å |
| 63 | E | 91.7 | Very high | 89.9 | Confident | 92 Ų | 92 | 89.1 Ų | 89.1 | 43% | 0.43 | 48% | 0.479 | S | S | . | . | H | α-helix | trans | -62 | -48 | 176.7 | -75 | 174.3 | 176.4 | 0 | 0 | 112 | K48 A59 T60 F65 L66 E67 | K48-E63 IonicContact NZ-OE1 2.63Å; K48-E63 PolarHBondContact NZ-OE1 3.4Å; A59-E63 WeakPolarHBondContact O-CG 3.16Å; A59-E63 PolarHBondContact O-N 3.41Å; T60-E63 PolarHBondContact O-N 2.99Å; E63-F65 PolarHBondContact O-N 3.18Å; E63-L66 PolarHBondContact O-N 3.49Å; E63-E67 WeakPolarHBondContact O-CB 3.46Å; E63-E67 PolarHBondContact O-N 2.8Å |
| 64 | N | 93.9 | Very high | 89.1 | Confident | 87 Ų | 87 | 90.2 Ų | 90.2 | 47% | 0.465 | 48% | 0.477 | S | S | . | . | H | α-helix | trans | -60.9 | -35.7 | 176.6 | -74.1 | -21.9 | 0 | 0 | 0 | 112.3 | T60 K68 | T60-N64 WeakPolarHBondContact O-CB 3.22Å; T60-N64 VanDerWaalsContact O-CG 3.3Å; T60-N64 PolarHBondContact O-N 2.96Å; T60-N64 PolarHBondContact O-ND2 3.49Å; N64-K68 WeakPolarHBondContact O-CG 3.37Å; N64-K68 PolarHBondContact O-N 3.28Å |
| 65 | F | 91.4 | Very high | 88 | Confident | 131 Ų | 131 | 87.8 Ų | 87.8 | 58% | 0.575 | 46% | 0.462 | S | S | * | . | H | α-helix | trans | -68.2 | -48.7 | 174.4 | 176.1 | -105.1 | 0 | 0 | 0 | 111.1 | S61 L62 E63 E67 K68 V69 | S61-F65 WeakPolarHBondContact O-CB 3.07Å; S61-F65 PolarHBondContact O-N 2.76Å; L62-F65 PolarHBondContact O-N 3.31Å; E63-F65 PolarHBondContact O-N 3.18Å; F65-E67 VanDerWaalsContact C-N 3.32Å; F65-E67 PolarHBondContact O-N 3.1Å; F65-K68 PolarHBondContact O-N 3.41Å; F65-V69 HydrophobicContact CD1-CG2 4.12Å; F65-V69 HydrophobicContact CD2-CG2 4.33Å; F65-V69 HydrophobicContact CE1-CG2 3.69Å; F65-V69 HydrophobicContact CE2-CG2 3.91Å; F65-V69 HydrophobicContact CG-CG2 4.43Å; F65-V69 HydrophobicContact CZ-CG2 3.57Å; F65-V69 WeakPolarHBondContact O-CG2 3.49Å; F65-V69 PolarHBondContact O-N 2.83Å |
| 66 | L | 90.9 | Very high | 87 | Confident | 83 Ų | 83 | 87.5 Ų | 87.5 | 44% | 0.435 | 46% | 0.464 | S | S | . | . | H | α-helix | trans | -61.4 | -40.5 | 179.6 | -175.4 | 61.5 | 0 | 0 | 0 | 111.4 | L62 E63 K68 V69 L70 | L62-L66 WeakPolarHBondContact O-CB 3.31Å; L62-L66 PolarHBondContact O-N 2.8Å; E63-L66 PolarHBondContact O-N 3.49Å; L66-K68 VanDerWaalsContact C-N 3.35Å; L66-K68 PolarHBondContact O-N 3.14Å; L66-V69 PolarHBondContact O-N 3.47Å; L66-L70 HydrophobicContact CD1-CD1 4.32Å; L66-L70 HydrophobicContact CD1-CG 4.16Å; L66-L70 HydrophobicContact CG-CD1 3.93Å; L66-L70 HydrophobicContact CG-CG 4.23Å; L66-L70 WeakPolarHBondContact O-CB 3.16Å; L66-L70 VanDerWaalsContact O-CG 3.23Å; L66-L70 WeakPolarHBondContact O-CG 3.4Å; L66-L70 PolarHBondContact O-N 3.37Å |
| 67 | E | 91.2 | Very high | 86.2 | Confident | 129 Ų | 129 | 84.6 Ų | 84.6 | 60% | 0.603 | 44% | 0.438 | S | S | * | . | H | α-helix | trans | -58.4 | -46.2 | 175.2 | -173.3 | -179 | -176.4 | 0 | 0 | 111.3 | E63 F65 L70 Q71 | E63-E67 WeakPolarHBondContact O-CB 3.46Å; E63-E67 PolarHBondContact O-N 2.8Å; F65-E67 VanDerWaalsContact C-N 3.32Å; F65-E67 PolarHBondContact O-N 3.1Å; E67-L70 PolarHBondContact O-N 3.07Å; E67-Q71 VanDerWaalsContact O-CB 3.28Å; E67-Q71 WeakPolarHBondContact O-CB 3.03Å; E67-Q71 PolarHBondContact O-N 3.41Å |
| 68 | K | 89.3 | Confident | 85.2 | Confident | 147 Ų | 147 | 84.4 Ų | 84.4 | 64% | 0.639 | 44% | 0.439 | S | S | * | . | H | α-helix | trans | -66.1 | -38.9 | 176.9 | -71.8 | -179.2 | -179.1 | -175.5 | 0 | 112.7 | N64 F65 L66 Q71 A72 | N64-K68 WeakPolarHBondContact O-CG 3.37Å; N64-K68 PolarHBondContact O-N 3.28Å; F65-K68 PolarHBondContact O-N 3.41Å; L66-K68 VanDerWaalsContact C-N 3.35Å; L66-K68 PolarHBondContact O-N 3.14Å; K68-Q71 PolarHBondContact O-N 3.38Å; K68-A72 WeakPolarHBondContact O-CB 3.47Å; K68-A72 PolarHBondContact O-N 3.46Å |
| 69 | V | 88.7 | Confident | 84.1 | Confident | 36 Ų | 36 | 84.3 Ų | 84.3 | 22% | 0.218 | 44% | 0.438 | C | S | . | . | H | α-helix | trans | -64 | -46.4 | 175.5 | 168.2 | 0 | 0 | 0 | 0 | 110.6 | F65 L66 Q71 A72 N73 I79 | F65-V69 HydrophobicContact CD1-CG2 4.12Å; F65-V69 HydrophobicContact CD2-CG2 4.33Å; F65-V69 HydrophobicContact CE1-CG2 3.69Å; F65-V69 HydrophobicContact CE2-CG2 3.91Å; F65-V69 HydrophobicContact CG-CG2 4.43Å; F65-V69 HydrophobicContact CZ-CG2 3.57Å; F65-V69 WeakPolarHBondContact O-CG2 3.49Å; F65-V69 PolarHBondContact O-N 2.83Å; L66-V69 PolarHBondContact O-N 3.47Å; V69-Q71 VanDerWaalsContact C-N 3.33Å; V69-Q71 PolarHBondContact O-N 2.88Å; V69-A72 PolarHBondContact O-N 2.88Å; V69-N73 WeakPolarHBondContact O-CB 3.4Å; V69-N73 PolarHBondContact O-N 3.16Å; V69-I79 HydrophobicContact CB-CD1 4.14Å; V69-I79 HydrophobicContact CG1-CD1 4.13Å; V69-I79 HydrophobicContact CG2-CD1 3.83Å |
| 70 | L | 86.8 | Confident | 83.2 | Confident | 99 Ų | 99 | 89.1 Ų | 89.1 | 52% | 0.518 | 46% | 0.458 | S | S | . | . | H | α-helix | trans | -65.1 | -37.8 | 177.2 | -70.9 | 174.4 | 0 | 0 | 0 | 111.5 | L66 E67 N73 K74 | L66-L70 HydrophobicContact CD1-CD1 4.32Å; L66-L70 HydrophobicContact CD1-CG 4.16Å; L66-L70 HydrophobicContact CG-CD1 3.93Å; L66-L70 HydrophobicContact CG-CG 4.23Å; L66-L70 WeakPolarHBondContact O-CB 3.16Å; L66-L70 VanDerWaalsContact O-CG 3.23Å; L66-L70 WeakPolarHBondContact O-CG 3.4Å; L66-L70 PolarHBondContact O-N 3.37Å; E67-L70 PolarHBondContact O-N 3.07Å; L70-N73 PolarHBondContact O-N 2.96Å; L70-K74 WeakPolarHBondContact O-CB 3.44Å; L70-K74 PolarHBondContact O-N 3.42Å |
| 71 | Q | 85.3 | Confident | 81.4 | Confident | 105 Ų | 105 | 91.6 Ų | 91.6 | 49% | 0.491 | 48% | 0.475 | S | S | . | . | H | α-helix | trans | -63.6 | -43.6 | 174.6 | -170.1 | 179 | 27.8 | 0 | 0 | 111.4 | E67 K68 V69 K74 Y75 | E67-Q71 VanDerWaalsContact O-CB 3.28Å; E67-Q71 WeakPolarHBondContact O-CB 3.03Å; E67-Q71 PolarHBondContact O-N 3.41Å; K68-Q71 PolarHBondContact O-N 3.38Å; V69-Q71 VanDerWaalsContact C-N 3.33Å; V69-Q71 PolarHBondContact O-N 2.88Å; Q71-K74 PolarHBondContact O-N 2.93Å; Q71-Y75 HydrophobicContact CG-CE2 3.86Å; Q71-Y75 WeakPolarHBondContact O-CD2 3.34Å; Q71-Y75 WeakPolarHBondContact O-CE2 3.47Å |
| 72 | A | 81.3 | Confident | 79.4 | Confident | 22 Ų | 22 | 95.5 Ų | 95.5 | 18% | 0.182 | 49% | 0.491 | C | S | . | . | H | α-helix | trans | -65.2 | -41.5 | 174.6 | 0 | 0 | 0 | 0 | 0 | 112.2 | K68 V69 K74 Y75 I77 I79 | K68-A72 WeakPolarHBondContact O-CB 3.47Å; K68-A72 PolarHBondContact O-N 3.46Å; V69-A72 PolarHBondContact O-N 2.88Å; A72-K74 VanDerWaalsContact C-N 3.34Å; A72-K74 PolarHBondContact O-N 3.43Å; A72-Y75 WeakPolarHBondContact O-CB 3.39Å; A72-Y75 PolarHBondContact O-N 3.26Å; A72-I77 HydrophobicContact CB-CB 4.5Å; A72-I77 WeakPolarHBondContact O-CB 3.47Å; A72-I77 PolarHBondContact O-N 3.35Å; A72-I77 VanDerWaalsContact O-N 3.14Å; A72-I79 HydrophobicContact CB-CD1 3.98Å |
| 73 | N | 81.7 | Confident | 77.4 | Confident | 98 Ų | 98 | 95.6 Ų | 95.6 | 52% | 0.524 | 49% | 0.494 | S | S | . | . | H | α-helix | trans | -65.5 | -35.7 | 178.2 | -168 | 59.6 | 0 | 0 | 0 | 112.3 | V69 L70 Y75 G76 | V69-N73 WeakPolarHBondContact O-CB 3.4Å; V69-N73 PolarHBondContact O-N 3.16Å; L70-N73 PolarHBondContact O-N 2.96Å; N73-Y75 PolarHBondContact O-N 3.3Å; N73-Y75 VanDerWaalsContact O-N 3.16Å; N73-G76 WeakPolarHBondContact O-CA 3.47Å; N73-G76 PolarHBondContact O-N 3.45Å |
| 74 | K | 75.7 | Confident | 75.3 | Confident | 165 Ų | 165 | 96.5 Ų | 96.5 | 72% | 0.717 | 51% | 0.511 | S | S | * | . | H | α-helix | trans | -59.1 | -25.1 | 172.9 | -174.1 | 176.5 | 179.9 | 178 | 0 | 112.6 | L70 Q71 A72 G76 | L70-K74 WeakPolarHBondContact O-CB 3.44Å; L70-K74 PolarHBondContact O-N 3.42Å; Q71-K74 PolarHBondContact O-N 2.93Å; A72-K74 VanDerWaalsContact C-N 3.34Å; A72-K74 PolarHBondContact O-N 3.43Å; K74-G76 VanDerWaalsContact C-N 3.33Å |
| 75 | Y | 71.2 | Confident | 73.4 | Confident | 97 Ų | 97 | 94.6 Ų | 94.6 | 38% | 0.38 | 51% | 0.507 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -93.5 | 12.2 | 175.1 | -60.2 | -46.8 | 0 | 0 | 0 | 113.3 | Q71 A72 N73 I77 L113 | Q71-Y75 HydrophobicContact CG-CE2 3.86Å; Q71-Y75 WeakPolarHBondContact O-CD2 3.34Å; Q71-Y75 WeakPolarHBondContact O-CE2 3.47Å; A72-Y75 WeakPolarHBondContact O-CB 3.39Å; A72-Y75 PolarHBondContact O-N 3.26Å; N73-Y75 PolarHBondContact O-N 3.3Å; N73-Y75 VanDerWaalsContact O-N 3.16Å; Y75-I77 VanDerWaalsContact C-N 3.32Å; Y75-I77 PolarHBondContact O-N 2.93Å; Y75-L113 HydrophobicContact CD1-CD2 3.13Å; Y75-L113 HydrophobicContact CD2-CD2 4.34Å; Y75-L113 HydrophobicContact CE1-CD2 3.74Å; Y75-L113 HydrophobicContact CG-CD1 4.36Å; Y75-L113 HydrophobicContact CG-CD2 3.49Å; Y75-L113 VanDerWaalsContact CG-CD2 3.49Å |
| 76 | G | 68.8 | Low | 72.1 | Confident | 25 Ų | 25 | 91 Ų | 91 | 26% | 0.258 | 50% | 0.498 | S | S | . | . | T | Hydrogen-bonded Turn | trans | 75.9 | 14.7 | 179.5 | 0 | 0 | 0 | 0 | 0 | 114.2 | N73 K74 N88 | N73-G76 WeakPolarHBondContact O-CA 3.47Å; N73-G76 PolarHBondContact O-N 3.45Å; K74-G76 VanDerWaalsContact C-N 3.33Å; G76-N88 PolarHBondContact O-ND2 2.85Å |
| 77 | I | 73.6 | Confident | 71.4 | Confident | 85 Ų | 85 | 90.5 Ų | 90.5 | 44% | 0.436 | 50% | 0.502 | S | S | . | . | trans | -96.7 | 106.4 | -177.5 | -55.3 | 173.9 | 0 | 0 | 0 | 109.5 | A72 Y75 | A72-I77 HydrophobicContact CB-CB 4.5Å; A72-I77 WeakPolarHBondContact O-CB 3.47Å; A72-I77 PolarHBondContact O-N 3.35Å; A72-I77 VanDerWaalsContact O-N 3.14Å; Y75-I77 VanDerWaalsContact C-N 3.32Å; Y75-I77 PolarHBondContact O-N 2.93Å | ||
| 78 | S | 70.1 | Confident | 70.7 | Confident | 59 Ų | 59 | 86.3 Ų | 86.3 | 41% | 0.413 | 48% | 0.483 | S | S | . | . | trans | -78.9 | 125.5 | 173.3 | 70.9 | 0 | 0 | 0 | 0 | 111 | S83 | S78-S83 PolarHBondContact OG-OG 2.79Å; S78-S83 VanDerWaalsContact OG-OG 3.1Å | ||
| 79 | I | 68.1 | Low | 70.6 | Confident | 100 Ų | 100 | 84.6 Ų | 84.6 | 51% | 0.513 | 47% | 0.473 | S | S | . | . | trans | -86.7 | -9 | -180 | -62.7 | 171.8 | 0 | 0 | 0 | 112.2 | V69 A72 | V69-I79 HydrophobicContact CB-CD1 4.14Å; V69-I79 HydrophobicContact CG1-CD1 4.13Å; V69-I79 HydrophobicContact CG2-CD1 3.83Å; A72-I79 HydrophobicContact CB-CD1 3.98Å | ||
| 80 | L | 71.2 | Confident | 70.6 | Confident | 137 Ų | 137 | 84.6 Ų | 84.6 | 72% | 0.717 | 47% | 0.472 | S | S | * | . | trans | -72.8 | 129.8 | -174.1 | -67.5 | 168.1 | 0 | 0 | 0 | 112 | N82 S83 | L80-N82 VanDerWaalsContact C-N 3.32Å; L80-N82 PolarHBondContact O-N 2.92Å; L80-S83 VanDerWaalsContact O-CB 3.23Å; L80-S83 WeakPolarHBondContact O-CB 3.23Å; L80-S83 PolarHBondContact O-N 3.04Å; L80-S83 VanDerWaalsContact O-N 3.16Å; L80-S83 PolarHBondContact O-OG 3.23Å | ||
| 81 | P | 53.5 | Low | 70.8 | Confident | 128 Ų | 128 | 86.4 Ų | 86.4 | 83% | 0.831 | 48% | 0.481 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -73.5 | -12.9 | -163.4 | 26.3 | -34.8 | 0 | 0 | 0 | 115.6 | S83 | P81-S83 PolarHBondContact O-N 3.49Š|
| 82 | N | 50.3 | Low | 71.1 | Confident | 150 Ų | 150 | 81.8 Ų | 81.8 | 80% | 0.802 | 46% | 0.461 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -81.7 | 2.6 | 174.2 | -148.5 | 22.2 | 0 | 0 | 0 | 112.7 | L80 S84 | L80-N82 VanDerWaalsContact C-N 3.32Å; L80-N82 PolarHBondContact O-N 2.92Å; N82-S84 VanDerWaalsContact C-N 3.32Å; N82-S84 PolarHBondContact O-N 3.28Å; N82-S84 VanDerWaalsContact O-N 3.17Å |
| 83 | S | 51.6 | Low | 71.5 | Confident | 33 Ų | 33 | 81 Ų | 81 | 23% | 0.231 | 45% | 0.454 | C | S | . | . | trans | -81.2 | 75.5 | 168 | -60.8 | 0 | 0 | 0 | 0 | 109.6 | S78 L80 P81 A85 | S78-S83 PolarHBondContact OG-OG 2.79Å; S78-S83 VanDerWaalsContact OG-OG 3.1Å; L80-S83 VanDerWaalsContact O-CB 3.23Å; L80-S83 WeakPolarHBondContact O-CB 3.23Å; L80-S83 PolarHBondContact O-N 3.04Å; L80-S83 VanDerWaalsContact O-N 3.16Å; L80-S83 PolarHBondContact O-OG 3.23Å; P81-S83 PolarHBondContact O-N 3.49Å; S83-A85 PolarHBondContact O-N 3.13Å | ||
| 84 | S | 47.2 | Very low | 72 | Confident | 111 Ų | 111 | 78 Ų | 78 | 78% | 0.776 | 44% | 0.441 | S | S | * | . | trans | -67.2 | 54.8 | 150 | 56.5 | 0 | 0 | 0 | 0 | 108.8 | N82 | N82-S84 VanDerWaalsContact C-N 3.32Å; N82-S84 PolarHBondContact O-N 3.28Å; N82-S84 VanDerWaalsContact O-N 3.17Å | ||
| 85 | A | 53.9 | Low | 72.9 | Confident | 47 Ų | 47 | 73.9 Ų | 73.9 | 39% | 0.388 | 43% | 0.426 | S | S | . | . | trans | -83.6 | 124 | -165.2 | 0 | 0 | 0 | 0 | 0 | 108.8 | S83 S87 | S83-A85 PolarHBondContact O-N 3.13Å; A85-S87 PolarHBondContact O-N 3.13Å | ||
| 86 | S | 63.4 | Low | 74 | Confident | 54 Ų | 54 | 69.3 Ų | 69.3 | 38% | 0.378 | 41% | 0.408 | S | S | . | . | trans | -50.3 | 136.7 | 164.6 | 54.1 | 0 | 0 | 0 | 0 | 109.8 | N88 R229 | S86-N88 PolarHBondContact O-N 3.43Å; S86-R229 PolarHBondContact O-NH1 3.49Å; S86-R229 PolarHBondContact OG-NH1 3.32Å | ||
| 87 | S | 76.1 | Confident | 75.2 | Confident | 74 Ų | 74 | 69.7 Ų | 69.7 | 52% | 0.517 | 40% | 0.403 | S | S | . | . | trans | -45.2 | 134.3 | 177.6 | 179.6 | 0 | 0 | 0 | 0 | 112.1 | A85 W89 D90 | A85-S87 PolarHBondContact O-N 3.13Å; S87-W89 PolarHBondContact O-N 3.4Å; S87-W89 VanDerWaalsContact O-N 3.11Å; S87-W89 PolarHBondContact OG-N 3.04Å; S87-W89 VanDerWaalsContact OG-N 3.13Å; S87-D90 PolarHBondContact O-N 3.26Å; S87-D90 VanDerWaalsContact O-N 3.16Å | ||
| 88 | N | 77.6 | Confident | 76.3 | Confident | 40 Ų | 40 | 66.6 Ų | 66.6 | 21% | 0.214 | 39% | 0.39 | C | S | . | . | T | Hydrogen-bonded Turn | trans | -61.1 | -16.1 | 170.8 | -64.8 | -17.7 | 0 | 0 | 0 | 112.6 | G76 S86 S93 T110 | G76-N88 PolarHBondContact O-ND2 2.85Å; S86-N88 PolarHBondContact O-N 3.43Å; N88-S93 WeakPolarHBondContact O-CB 3.42Å; N88-T110 HydrophobicContact CB-CG2 4.34Å |
| 89 | W | 87.6 | Confident | 77.5 | Confident | 112 Ų | 112 | 64.8 Ų | 64.8 | 42% | 0.424 | 38% | 0.376 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -114.6 | 32.7 | 179 | -63.5 | 100.3 | 0 | 0 | 0 | 112 | S87 S94 F97 T110 | S87-W89 PolarHBondContact O-N 3.4Å; S87-W89 VanDerWaalsContact O-N 3.11Å; S87-W89 PolarHBondContact OG-N 3.04Å; S87-W89 VanDerWaalsContact OG-N 3.13Å; W89-S94 PolarHBondContact O-OG 2.94Å; W89-F97 HydrophobicContact CH2-CD1 4.02Å; W89-F97 HydrophobicContact CH2-CD2 4.38Å; W89-F97 HydrophobicContact CH2-CE1 4.1Å; W89-F97 HydrophobicContact CH2-CE2 4.46Å; W89-F97 HydrophobicContact CH2-CG 4.18Å; W89-F97 HydrophobicContact CH2-CZ 4.33Å; W89-F97 AromaticContact CZ3-CD1 3.85Å; W89-F97 HydrophobicContact CZ3-CD1 3.85Å; W89-F97 HydrophobicContact CZ3-CE1 4.28Å; W89-F97 HydrophobicContact CZ3-CG 4.13Å; W89-T110 HydrophobicContact CD2-CG2 4.36Å; W89-T110 HydrophobicContact CH2-CG2 4.07Å; W89-T110 HydrophobicContact CZ2-CG2 3.58Å |
| 90 | D | 88.3 | Confident | 78.8 | Confident | 36 Ų | 36 | 60.2 Ų | 60.2 | 19% | 0.193 | 35% | 0.352 | C | S | . | . | S | Bend | trans | -66.4 | 165.3 | 161.9 | 80.4 | -49.5 | 0 | 0 | 0 | 110.5 | S87 A92 S93 S94 | S87-D90 PolarHBondContact O-N 3.26Å; S87-D90 VanDerWaalsContact O-N 3.16Å; D90-A92 VanDerWaalsContact C-N 3.3Å; D90-A92 PolarHBondContact O-N 2.66Å; D90-S93 PolarHBondContact O-N 3.47Å; D90-S93 WeakPolarHBondContact OD1-CB 3.07Å; D90-S93 PolarHBondContact OD1-N 2.9Å; D90-S93 VanDerWaalsContact OD1-N 3.09Å; D90-S93 PolarHBondContact OD1-OG 3.02Å; D90-S94 VanDerWaalsContact O-CB 3.27Å; D90-S94 WeakPolarHBondContact O-CB 3.39Å; D90-S94 PolarHBondContact O-N 3.48Å; D90-S94 PolarHBondContact O-OG 3.35Å |
| 91 | L | 90.3 | Very high | 80 | Confident | 136 Ų | 136 | 55.7 Ų | 55.7 | 71% | 0.712 | 33% | 0.328 | S | S | * | . | H | α-helix | trans | -57.8 | -42.3 | -174.7 | 179.1 | 62.7 | 0 | 0 | 0 | 112.2 | S94 L95 | L91-S94 PolarHBondContact O-N 2.92Å; L91-L95 HydrophobicContact CD1-CD1 4.23Å; L91-L95 HydrophobicContact CD1-CG 4.24Å; L91-L95 HydrophobicContact CG-CD1 4.1Å; L91-L95 WeakPolarHBondContact O-CB 3.3Å; L91-L95 VanDerWaalsContact O-CG 3.26Å; L91-L95 WeakPolarHBondContact O-CG 3.21Å; L91-L95 PolarHBondContact O-N 3.17Å |
| 92 | A | 90.9 | Very high | 82 | Confident | 8 Ų | 8 | 50.2 Ų | 50.2 | 7% | 0.066 | 29% | 0.293 | C | S | . | . | H | α-helix | trans | -68.3 | -43.1 | -178.8 | 0 | 0 | 0 | 0 | 0 | 112.1 | D90 L95 F96 K233 | D90-A92 VanDerWaalsContact C-N 3.3Å; D90-A92 PolarHBondContact O-N 2.66Å; A92-L95 PolarHBondContact O-N 2.71Å; A92-F96 WeakPolarHBondContact O-CB 3.48Å; A92-F96 PolarHBondContact O-N 3.11Å; A92-K233 HydrophobicContact CB-CB 4.45Å |
| 93 | S | 90.1 | Very high | 84.2 | Confident | 5 Ų | 5 | 43.2 Ų | 43.2 | 4% | 0.035 | 26% | 0.255 | C | S | . | . | H | α-helix | trans | -69.5 | -34.1 | 175.2 | -57.6 | 0 | 0 | 0 | 0 | 112.5 | N88 D90 F96 F97 K233 | N88-S93 WeakPolarHBondContact O-CB 3.42Å; D90-S93 PolarHBondContact O-N 3.47Å; D90-S93 WeakPolarHBondContact OD1-CB 3.07Å; D90-S93 PolarHBondContact OD1-N 2.9Å; D90-S93 VanDerWaalsContact OD1-N 3.09Å; D90-S93 PolarHBondContact OD1-OG 3.02Å; S93-F96 WeakPolarHBondContact O-CB 3.4Å; S93-F96 PolarHBondContact O-N 2.63Å; S93-F97 WeakPolarHBondContact O-CB 3.29Å; S93-F97 PolarHBondContact O-N 3.43Å; S93-K233 PolarHBondContact OG-NZ 3.14Å |
| 94 | S | 93.3 | Very high | 86.3 | Confident | 36 Ų | 36 | 44.6 Ų | 44.6 | 25% | 0.252 | 26% | 0.263 | S | S | . | . | H | α-helix | trans | -66.8 | -40.9 | 175.3 | -57.2 | 0 | 0 | 0 | 0 | 111.8 | W89 D90 L91 F97 A98 | W89-S94 PolarHBondContact O-OG 2.94Å; D90-S94 VanDerWaalsContact O-CB 3.27Å; D90-S94 WeakPolarHBondContact O-CB 3.39Å; D90-S94 PolarHBondContact O-N 3.48Å; D90-S94 PolarHBondContact O-OG 3.35Å; L91-S94 PolarHBondContact O-N 2.92Å; S94-F97 PolarHBondContact O-N 3.15Å; S94-A98 WeakPolarHBondContact O-CB 3.06Å; S94-A98 PolarHBondContact O-N 3.47Å |
| 95 | L | 94.1 | Very high | 88.6 | Confident | 79 Ų | 79 | 39.8 Ų | 39.8 | 41% | 0.414 | 23% | 0.228 | S | C | . | . | H | α-helix | trans | -64.3 | -42.8 | 172.3 | -76 | 171.5 | 0 | 0 | 0 | 111.4 | L91 A92 A98 N99 | L91-L95 HydrophobicContact CD1-CD1 4.23Å; L91-L95 HydrophobicContact CD1-CG 4.24Å; L91-L95 HydrophobicContact CG-CD1 4.1Å; L91-L95 WeakPolarHBondContact O-CB 3.3Å; L91-L95 VanDerWaalsContact O-CG 3.26Å; L91-L95 WeakPolarHBondContact O-CG 3.21Å; L91-L95 PolarHBondContact O-N 3.17Å; A92-L95 PolarHBondContact O-N 2.71Å; L95-A98 PolarHBondContact O-N 3.01Å; L95-N99 WeakPolarHBondContact O-CB 3.09Å; L95-N99 PolarHBondContact O-N 3.47Å |
| 96 | F | 93.8 | Very high | 90.4 | Very high | 1 Ų | 1 | 39.7 Ų | 39.7 | 0% | 0.004 | 23% | 0.232 | C | C | . | . | H | α-helix | trans | -59.7 | -47 | 175.2 | -174.8 | -98.3 | 0 | 0 | 0 | 111.4 | A92 S93 N99 T100 Y107 V219 K233 V236 M237 L240 | A92-F96 WeakPolarHBondContact O-CB 3.48Å; A92-F96 PolarHBondContact O-N 3.11Å; S93-F96 WeakPolarHBondContact O-CB 3.4Å; S93-F96 PolarHBondContact O-N 2.63Å; F96-N99 PolarHBondContact O-N 3.01Å; F96-T100 HydrophobicContact CD1-CG2 4.2Å; F96-T100 HydrophobicContact CE1-CG2 3.95Å; F96-T100 HydrophobicContact CE2-CG2 4.48Å; F96-T100 HydrophobicContact CZ-CG2 4.12Å; F96-T100 VanDerWaalsContact O-CG2 3.26Å; F96-T100 WeakPolarHBondContact O-CG2 3.49Å; F96-T100 PolarHBondContact O-N 3.28Å; F96-T100 PolarHBondContact O-OG1 3.27Å; F96-Y107 AromaticContact CE1-CD2 3.89Å; F96-Y107 HydrophobicContact CE1-CD2 3.89Å; F96-Y107 AromaticContact CE1-CE2 3.79Å; F96-Y107 HydrophobicContact CE1-CE2 3.79Å; F96-Y107 HydrophobicContact CZ-CD2 4.16Å; F96-Y107 AromaticContact CZ-CE2 3.56Å; F96-Y107 HydrophobicContact CZ-CE2 3.56Å; F96-V219 HydrophobicContact CE1-CG1 3.98Å; F96-V219 HydrophobicContact CZ-CG1 4.33Å; F96-K233 HydrophobicContact CB-CD 4.16Å; F96-K233 HydrophobicContact CG-CD 4.25Å; F96-V236 HydrophobicContact CE2-CB 4.26Å; F96-V236 HydrophobicContact CE2-CG1 3.74Å; F96-V236 HydrophobicContact CZ-CG1 4.38Å; F96-M237 HydrophobicContact CD2-CB 4.42Å; F96-L240 HydrophobicContact CE2-CD1 4.1Å; F96-L240 HydrophobicContact CZ-CD1 4.37Å |
| 97 | F | 94.5 | Very high | 91.8 | Very high | 33 Ų | 33 | 37.4 Ų | 37.4 | 15% | 0.145 | 22% | 0.215 | C | C | . | . | H | α-helix | trans | -56.8 | -52.5 | 173.8 | 171.8 | -97.1 | 0 | 0 | 0 | 111.3 | W89 S93 S94 N99 T100 L101 T110 P112 | W89-F97 HydrophobicContact CH2-CD1 4.02Å; W89-F97 HydrophobicContact CH2-CD2 4.38Å; W89-F97 HydrophobicContact CH2-CE1 4.1Å; W89-F97 HydrophobicContact CH2-CE2 4.46Å; W89-F97 HydrophobicContact CH2-CG 4.18Å; W89-F97 HydrophobicContact CH2-CZ 4.33Å; W89-F97 AromaticContact CZ3-CD1 3.85Å; W89-F97 HydrophobicContact CZ3-CD1 3.85Å; W89-F97 HydrophobicContact CZ3-CE1 4.28Å; W89-F97 HydrophobicContact CZ3-CG 4.13Å; S93-F97 WeakPolarHBondContact O-CB 3.29Å; S93-F97 PolarHBondContact O-N 3.43Å; S94-F97 PolarHBondContact O-N 3.15Å; F97-N99 VanDerWaalsContact C-N 3.33Å; F97-N99 PolarHBondContact O-N 2.93Å; F97-T100 PolarHBondContact O-N 2.99Å; F97-T100 PolarHBondContact O-OG1 2.96Å; F97-L101 HydrophobicContact CE1-CD2 4.04Å; F97-L101 HydrophobicContact CZ-CD2 4.19Å; F97-L101 WeakPolarHBondContact O-CB 3.22Å; F97-L101 PolarHBondContact O-N 3.31Å; F97-T110 WeakPolarHBondContact CD2-O 3.45Å; F97-T110 WeakPolarHBondContact CE2-O 3.32Å; F97-P112 HydrophobicContact CZ-CG 4.48Å |
| 98 | A | 95.8 | Very high | 92.3 | Very high | 19 Ų | 19 | 36 Ų | 36 | 16% | 0.157 | 21% | 0.212 | C | C | . | . | H | α-helix | trans | -57.6 | -44.2 | 179.5 | 0 | 0 | 0 | 0 | 0 | 112.2 | S94 L95 L101 V102 Y124 | S94-A98 WeakPolarHBondContact O-CB 3.06Å; S94-A98 PolarHBondContact O-N 3.47Å; L95-A98 PolarHBondContact O-N 3.01Å; A98-L101 WeakPolarHBondContact O-CB 3.35Å; A98-L101 PolarHBondContact O-N 3.22Å; A98-V102 WeakPolarHBondContact O-CG2 3.46Å; A98-V102 PolarHBondContact O-N 3.49Å; A98-V102 VanDerWaalsContact O-N 3.09Å; A98-Y124 HydrophobicContact CB-CE1 3.95Å |
| 99 | N | 95.2 | Very high | 92.5 | Very high | 22 Ų | 22 | 36 Ų | 36 | 12% | 0.118 | 21% | 0.21 | C | C | . | . | H | α-helix | trans | -60.8 | -49.3 | 175.1 | 178.6 | 75.7 | 0 | 0 | 0 | 111.7 | L95 F96 F97 L101 V102 T103 M237 | L95-N99 WeakPolarHBondContact O-CB 3.09Å; L95-N99 PolarHBondContact O-N 3.47Å; F96-N99 PolarHBondContact O-N 3.01Å; F97-N99 VanDerWaalsContact C-N 3.33Å; F97-N99 PolarHBondContact O-N 2.93Å; N99-L101 PolarHBondContact O-N 2.9Å; N99-V102 WeakPolarHBondContact O-CG2 3.33Å; N99-V102 PolarHBondContact O-N 2.7Å; N99-T103 WeakPolarHBondContact O-CB 3.05Å; N99-T103 VanDerWaalsContact O-CG2 3.31Å; N99-T103 WeakPolarHBondContact O-CG2 3.44Å; N99-T103 PolarHBondContact O-N 3.05Å; N99-T103 PolarHBondContact O-OG1 2.82Å; N99-M237 HydrophobicContact CB-CG 3.68Å; N99-M237 HydrophobicContact CB-SD 4.02Å; N99-M237 VanDerWaalsContact CG-CG 3.46Å |
| 100 | T | 95.3 | Very high | 92.3 | Very high | 4 Ų | 4 | 31 Ų | 31 | 3% | 0.025 | 19% | 0.193 | C | C | . | . | H | α-helix | trans | -64.9 | -26.7 | 179.7 | 60.3 | 0 | 0 | 0 | 0 | 112.9 | F96 F97 T103 T104 V105 G106 Y107 L240 | F96-T100 HydrophobicContact CD1-CG2 4.2Å; F96-T100 HydrophobicContact CE1-CG2 3.95Å; F96-T100 HydrophobicContact CE2-CG2 4.48Å; F96-T100 HydrophobicContact CZ-CG2 4.12Å; F96-T100 VanDerWaalsContact O-CG2 3.26Å; F96-T100 WeakPolarHBondContact O-CG2 3.49Å; F96-T100 PolarHBondContact O-N 3.28Å; F96-T100 PolarHBondContact O-OG1 3.27Å; F97-T100 PolarHBondContact O-N 2.99Å; F97-T100 PolarHBondContact O-OG1 2.96Å; T100-T103 WeakPolarHBondContact CA-OG1 3.44Å; T100-T103 PolarHBondContact O-OG1 3.25Å; T100-T104 PolarHBondContact O-N 2.87Å; T100-V105 PolarHBondContact O-N 3.26Å; T100-G106 PolarHBondContact O-N 2.93Å; T100-Y107 HydrophobicContact CG2-CD2 3.74Å; T100-Y107 HydrophobicContact CG2-CE2 3.6Å; T100-L240 HydrophobicContact CG2-CD1 4.17Å |
| 101 | L | 96.3 | Very high | 92.4 | Very high | 41 Ų | 41 | 31.7 Ų | 31.7 | 22% | 0.215 | 20% | 0.198 | C | C | . | . | H | α-helix | trans | -72.8 | -47.7 | 175.9 | -178.7 | 60.1 | 0 | 0 | 0 | 111.4 | F97 A98 N99 T104 Y124 A125 | F97-L101 HydrophobicContact CE1-CD2 4.04Å; F97-L101 HydrophobicContact CZ-CD2 4.19Å; F97-L101 WeakPolarHBondContact O-CB 3.22Å; F97-L101 PolarHBondContact O-N 3.31Å; A98-L101 WeakPolarHBondContact O-CB 3.35Å; A98-L101 PolarHBondContact O-N 3.22Å; N99-L101 PolarHBondContact O-N 2.9Å; L101-T104 PolarHBondContact O-N 3.48Å; L101-Y124 HydrophobicContact CD2-CD1 3.85Å; L101-A125 HydrophobicContact CD1-CB 4.2Å; L101-A125 HydrophobicContact CG-CB 4.19Å |
| 102 | V | 96.8 | Very high | 92.4 | Very high | 13 Ų | 13 | 26.4 Ų | 26.4 | 8% | 0.079 | 17% | 0.172 | C | C | . | . | H | α-helix | trans | -78.5 | -24.8 | -178.8 | -58.3 | 0 | 0 | 0 | 0 | 113.6 | A98 N99 Y124 T132 | A98-V102 WeakPolarHBondContact O-CG2 3.46Å; A98-V102 PolarHBondContact O-N 3.49Å; A98-V102 VanDerWaalsContact O-N 3.09Å; N99-V102 WeakPolarHBondContact O-CG2 3.33Å; N99-V102 PolarHBondContact O-N 2.7Å; V102-Y124 HydrophobicContact CG1-CD1 3.93Å; V102-Y124 HydrophobicContact CG1-CE1 3.35Å; V102-T132 WeakPolarHBondContact CB-OG1 3.33Å; V102-T132 WeakPolarHBondContact CG2-OG1 3.48Å |
| 103 | T | 95.2 | Very high | 92.3 | Very high | 3 Ų | 3 | 29.7 Ų | 29.7 | 2% | 0.018 | 19% | 0.188 | C | C | . | . | T | Hydrogen-bonded Turn | trans | -82.2 | -1.1 | 170.8 | 55.3 | 0 | 0 | 0 | 0 | 112.8 | N99 T100 V105 T132 L244 | N99-T103 WeakPolarHBondContact O-CB 3.05Å; N99-T103 VanDerWaalsContact O-CG2 3.31Å; N99-T103 WeakPolarHBondContact O-CG2 3.44Å; N99-T103 PolarHBondContact O-N 3.05Å; N99-T103 PolarHBondContact O-OG1 2.82Å; T100-T103 WeakPolarHBondContact CA-OG1 3.44Å; T100-T103 PolarHBondContact O-OG1 3.25Å; T103-V105 PolarHBondContact O-N 3.45Å; T103-T132 HydrophobicContact CG2-CG2 4.2Å; T103-L244 HydrophobicContact CG2-CD2 4.2Å |
| 104 | T | 95.8 | Very high | 92.5 | Very high | 63 Ų | 63 | 32.7 Ų | 32.7 | 39% | 0.387 | 21% | 0.209 | S | C | . | . | T | Hydrogen-bonded Turn | trans | 62 | 15.4 | 179.2 | 67.7 | 0 | 0 | 0 | 0 | 115.5 | T100 L101 V129 | T100-T104 PolarHBondContact O-N 2.87Å; L101-T104 PolarHBondContact O-N 3.48Å; T104-V129 HydrophobicContact CG2-CB 4.4Å; T104-V129 HydrophobicContact CG2-CG1 3.75Å; T104-V129 HydrophobicContact CG2-CG2 3.69Å |
| 105 | V | 95.5 | Very high | 92.6 | Very high | 9 Ų | 9 | 36.9 Ų | 36.9 | 6% | 0.055 | 23% | 0.228 | C | C | . | . | trans | -69.7 | -52.8 | 173.2 | 180 | 0 | 0 | 0 | 0 | 110.4 | T100 T103 Y107 T209 T212 G214 | T100-V105 PolarHBondContact O-N 3.26Å; T103-V105 PolarHBondContact O-N 3.45Å; V105-Y107 HydrophobicContact CG1-CD1 4.11Å; V105-Y107 HydrophobicContact CG1-CD2 4.39Å; V105-Y107 HydrophobicContact CG1-CE1 3.75Å; V105-Y107 HydrophobicContact CG1-CE2 4.04Å; V105-Y107 HydrophobicContact CG1-CG 4.43Å; V105-T209 HydrophobicContact CG1-CG2 4.43Å; V105-T212 HydrophobicContact CG2-CG2 4.03Å; V105-G214 WeakPolarHBondContact O-CA 3.29Å | ||
| 106 | G | 93.2 | Very high | 92.7 | Very high | 45 Ų | 45 | 38.6 Ų | 38.6 | 46% | 0.464 | 24% | 0.242 | S | C | . | . | trans | 58 | 52.1 | 168.5 | 0 | 0 | 0 | 0 | 0 | 117.7 | T100 G108 | T100-G106 PolarHBondContact O-N 2.93Å; G106-G108 PolarHBondContact O-N 3.4Å | ||
| 107 | Y | 91.6 | Very high | 92.8 | Very high | 7 Ų | 7 | 39.3 Ų | 39.3 | 3% | 0.027 | 25% | 0.25 | C | S | . | . | trans | -50.2 | -25.4 | -178.1 | -62.6 | -64.2 | 0 | 0 | 0 | 117.2 | F96 T100 V105 H109 F205 T209 G214 G216 V219 L240 | F96-Y107 AromaticContact CE1-CD2 3.89Å; F96-Y107 HydrophobicContact CE1-CD2 3.89Å; F96-Y107 AromaticContact CE1-CE2 3.79Å; F96-Y107 HydrophobicContact CE1-CE2 3.79Å; F96-Y107 HydrophobicContact CZ-CD2 4.16Å; F96-Y107 AromaticContact CZ-CE2 3.56Å; F96-Y107 HydrophobicContact CZ-CE2 3.56Å; T100-Y107 HydrophobicContact CG2-CD2 3.74Å; T100-Y107 HydrophobicContact CG2-CE2 3.6Å; V105-Y107 HydrophobicContact CG1-CD1 4.11Å; V105-Y107 HydrophobicContact CG1-CD2 4.39Å; V105-Y107 HydrophobicContact CG1-CE1 3.75Å; V105-Y107 HydrophobicContact CG1-CE2 4.04Å; V105-Y107 HydrophobicContact CG1-CG 4.43Å; Y107-H109 WeakPolarHBondContact CB-ND1 3.47Å; Y107-H109 PolarHBondContact O-N 2.9Å; Y107-F205 HydrophobicContact CE1-CE2 4.15Å; Y107-F205 AromaticContact CZ-CE2 4Å; Y107-F205 WeakPolarHBondContact OH-CE2 3.39Å; Y107-T209 HydrophobicContact CE1-CG2 4.48Å; Y107-T209 WeakPolarHBondContact CE1-OG1 3.42Å; Y107-T209 WeakPolarHBondContact OH-CG2 2.98Å; Y107-T209 PolarHBondContact OH-OG1 3.45Å; Y107-G214 WeakPolarHBondContact CA-O 3.46Å; Y107-G216 WeakPolarHBondContact O-CA 3.38Å; Y107-V219 HydrophobicContact CD1-CG2 4.19Å; Y107-V219 HydrophobicContact CD2-CG2 4.41Å; Y107-V219 HydrophobicContact CG-CG2 3.97Å; Y107-L240 HydrophobicContact CE2-CD1 4.27Å | ||
| 108 | G | 86.4 | Confident | 92.9 | Very high | 43 Ų | 43 | 42.2 Ų | 42.2 | 44% | 0.443 | 26% | 0.263 | S | S | . | . | trans | 72 | -5.3 | 177.6 | 0 | 0 | 0 | 0 | 0 | 117 | G106 T110 T111 | G106-G108 PolarHBondContact O-N 3.4Å; G108-T110 VanDerWaalsContact C-N 3.25Å; G108-T110 PolarHBondContact O-N 3.3Å; G108-T111 WeakPolarHBondContact O-CG2 3.48Å | ||
| 109 | H | 82.4 | Confident | 93 | Very high | 40 Ų | 40 | 43.3 Ų | 43.3 | 19% | 0.185 | 27% | 0.272 | C | S | . | . | S | Bend | trans | -61.7 | -31.9 | 174.3 | 72.4 | -75.3 | 0 | 0 | 0 | 113.1 | Y107 V219 E222 | Y107-H109 WeakPolarHBondContact CB-ND1 3.47Å; Y107-H109 PolarHBondContact O-N 2.9Å; H109-V219 HydrophobicContact CB-CG2 4.16Å; H109-E222 IonicContact CD2-OE2 3.01Å; H109-E222 IonicContact NE2-OE1 3.96Å |
| 110 | T | 84.4 | Confident | 93.1 | Very high | 9 Ų | 9 | 48.6 Ų | 48.6 | 6% | 0.055 | 29% | 0.294 | C | S | . | . | S | Bend | trans | -122.8 | 122.8 | 171.5 | -57.4 | 0 | 0 | 0 | 0 | 108.5 | N88 W89 F97 G108 | N88-T110 HydrophobicContact CB-CG2 4.34Å; W89-T110 HydrophobicContact CD2-CG2 4.36Å; W89-T110 HydrophobicContact CH2-CG2 4.07Å; W89-T110 HydrophobicContact CZ2-CG2 3.58Å; F97-T110 WeakPolarHBondContact CD2-O 3.45Å; F97-T110 WeakPolarHBondContact CE2-O 3.32Å; G108-T110 VanDerWaalsContact C-N 3.25Å; G108-T110 PolarHBondContact O-N 3.3Å |
| 111 | T | 88.6 | Confident | 93.2 | Very high | 49 Ų | 49 | 49.2 Ų | 49.2 | 30% | 0.301 | 30% | 0.298 | S | S | . | . | trans | -134.1 | 148.7 | -178.9 | 52.1 | 0 | 0 | 0 | 0 | 111.9 | G108 L113 | G108-T111 WeakPolarHBondContact O-CG2 3.48Å; T111-L113 PolarHBondContact O-N 3.05Å | ||
| 112 | P | 91.4 | Very high | 93.2 | Very high | 26 Ų | 26 | 52.9 Ų | 52.9 | 17% | 0.169 | 32% | 0.317 | C | S | . | . | trans | -67.1 | 123.2 | 178 | 27.9 | -35.2 | 0 | 0 | 0 | 110.7 | F97 K118 | F97-P112 HydrophobicContact CZ-CG 4.48Å; P112-K118 HydrophobicContact CB-CG 4.39Å; P112-K118 HydrophobicContact CG-CG 4.18Å; P112-K118 WeakPolarHBondContact O-CE 3.44Å; P112-K118 WeakPolarHBondContact O-CG 3.3Å | ||
| 113 | L | 88.5 | Confident | 93.3 | Very high | 77 Ų | 77 | 58.9 Ų | 58.9 | 40% | 0.403 | 34% | 0.342 | S | S | . | . | trans | -88.6 | -37.6 | -177.9 | -55.4 | -178.9 | 0 | 0 | 0 | 112.5 | Y75 T111 K118 | Y75-L113 HydrophobicContact CD1-CD2 3.13Å; Y75-L113 HydrophobicContact CD2-CD2 4.34Å; Y75-L113 HydrophobicContact CE1-CD2 3.74Å; Y75-L113 HydrophobicContact CG-CD1 4.36Å; Y75-L113 HydrophobicContact CG-CD2 3.49Å; Y75-L113 VanDerWaalsContact CG-CD2 3.49Å; T111-L113 PolarHBondContact O-N 3.05Å; L113-K118 VanDerWaalsContact O-CE 3.31Å; L113-K118 WeakPolarHBondContact O-CE 2.96Å; L113-K118 PolarHBondContact O-NZ 3.09Å | ||
| 114 | S | 93.6 | Very high | 93.4 | Very high | 67 Ų | 67 | 63 Ų | 63 | 47% | 0.469 | 36% | 0.358 | S | S | . | . | S | Bend | trans | -75.1 | 147.9 | -179.3 | 65.3 | 0 | 0 | 0 | 0 | 111.7 | T116 G117 K118 | S114-T116 PolarHBondContact O-N 3.14Å; S114-G117 PolarHBondContact O-N 3.5Å; S114-G117 VanDerWaalsContact O-N 3.07Å; S114-G117 PolarHBondContact OG-N 2.91Å; S114-K118 WeakPolarHBondContact O-CG 3.36Å; S114-K118 PolarHBondContact O-N 3.12Å |
| 115 | D | 96.2 | Very high | 93.5 | Very high | 124 Ų | 124 | 61.1 Ų | 61.1 | 66% | 0.663 | 35% | 0.349 | S | S | * | . | H | α-helix | trans | -63.5 | -33.8 | 177.3 | -63.2 | -22.7 | 0 | 0 | 0 | 111.6 | K118 A119 | D115-K118 PolarHBondContact O-N 3.36Å; D115-K118 IonicContact OD1-NZ 2.66Å; D115-K118 PolarHBondContact OD1-NZ 2.59Å; D115-A119 WeakPolarHBondContact O-CB 3.3Å; D115-A119 PolarHBondContact O-N 3.06Å |
| 116 | T | 96.7 | Very high | 93.6 | Very high | 115 Ų | 115 | 66.3 Ų | 66.3 | 71% | 0.706 | 38% | 0.376 | S | S | * | . | H | α-helix | trans | -62 | -44.4 | 170.6 | -49 | 0 | 0 | 0 | 0 | 112.1 | S114 A119 F120 | S114-T116 PolarHBondContact O-N 3.14Å; T116-A119 PolarHBondContact O-N 2.81Å; T116-F120 WeakPolarHBondContact O-CB 3.44Å; T116-F120 PolarHBondContact O-N 2.92Å |
| 117 | G | 95.6 | Very high | 93.8 | Very high | 17 Ų | 17 | 70.5 Ų | 70.5 | 18% | 0.175 | 39% | 0.387 | C | S | . | . | H | α-helix | trans | -66.1 | -39 | 178.4 | 0 | 0 | 0 | 0 | 0 | 112.4 | S114 S121 | S114-G117 PolarHBondContact O-N 3.5Å; S114-G117 VanDerWaalsContact O-N 3.07Å; S114-G117 PolarHBondContact OG-N 2.91Å; G117-S121 WeakPolarHBondContact O-CB 3.42Å; G117-S121 PolarHBondContact O-N 2.85Å; G117-S121 PolarHBondContact O-OG 2.83Å |
| 118 | K | 96 | Very high | 94.1 | Very high | 93 Ų | 93 | 70.7 Ų | 70.7 | 40% | 0.404 | 39% | 0.391 | S | S | . | . | H | α-helix | trans | -63.8 | -49.1 | 173.9 | -67.2 | 170.1 | -165.4 | 155.8 | 0 | 111.1 | P112 L113 S114 D115 F120 S121 I122 | P112-K118 HydrophobicContact CB-CG 4.39Å; P112-K118 HydrophobicContact CG-CG 4.18Å; P112-K118 WeakPolarHBondContact O-CE 3.44Å; P112-K118 WeakPolarHBondContact O-CG 3.3Å; L113-K118 VanDerWaalsContact O-CE 3.31Å; L113-K118 WeakPolarHBondContact O-CE 2.96Å; L113-K118 PolarHBondContact O-NZ 3.09Å; S114-K118 WeakPolarHBondContact O-CG 3.36Å; S114-K118 PolarHBondContact O-N 3.12Å; D115-K118 PolarHBondContact O-N 3.36Å; D115-K118 IonicContact OD1-NZ 2.66Å; D115-K118 PolarHBondContact OD1-NZ 2.59Å; K118-F120 PolarHBondContact O-N 3.42Å; K118-S121 PolarHBondContact O-N 2.87Å; K118-I122 WeakPolarHBondContact O-CG1 3.48Å; K118-I122 PolarHBondContact O-N 3.06Å; K118-I122 VanDerWaalsContact O-N 3.1Å |
| 119 | A | 97.8 | Very high | 94.6 | Very high | 42 Ų | 42 | 70.4 Ų | 70.4 | 35% | 0.347 | 38% | 0.38 | S | S | . | . | H | α-helix | trans | -59.5 | -46.7 | 177.2 | 0 | 0 | 0 | 0 | 0 | 111.6 | D115 T116 S121 I122 F123 | D115-A119 WeakPolarHBondContact O-CB 3.3Å; D115-A119 PolarHBondContact O-N 3.06Å; T116-A119 PolarHBondContact O-N 2.81Å; A119-S121 VanDerWaalsContact C-N 3.33Å; A119-S121 PolarHBondContact O-N 3.49Å; A119-I122 WeakPolarHBondContact O-CB 3.4Å; A119-I122 PolarHBondContact O-N 2.99Å; A119-F123 WeakPolarHBondContact O-CD2 3.28Å; A119-F123 PolarHBondContact O-N 3.41Å |
| 120 | F | 97.6 | Very high | 95.3 | Very high | 134 Ų | 134 | 72.1 Ų | 72.1 | 59% | 0.588 | 40% | 0.395 | S | S | * | . | H | α-helix | trans | -59.2 | -43.6 | 175.9 | 178.1 | -100.4 | 0 | 0 | 0 | 112.1 | T116 K118 I122 F123 Y124 | T116-F120 WeakPolarHBondContact O-CB 3.44Å; T116-F120 PolarHBondContact O-N 2.92Å; K118-F120 PolarHBondContact O-N 3.42Å; F120-I122 VanDerWaalsContact C-N 3.28Å; F120-I122 PolarHBondContact O-N 3.13Å; F120-F123 PolarHBondContact O-N 3.14Å; F120-Y124 HydrophobicContact CE1-CD2 4.4Å; F120-Y124 HydrophobicContact CE1-CG 4.29Å; F120-Y124 HydrophobicContact CZ-CD2 4.16Å; F120-Y124 HydrophobicContact CZ-CG 4.45Å; F120-Y124 VanDerWaalsContact O-CB 3.24Å; F120-Y124 WeakPolarHBondContact O-CB 3.48Å; F120-Y124 PolarHBondContact O-N 3.4Å |
| 121 | S | 97 | Very high | 95.9 | Very high | 16 Ų | 16 | 78 Ų | 78 | 11% | 0.112 | 42% | 0.42 | C | S | . | . | H | α-helix | trans | -61.6 | -36.6 | 179.3 | -58.8 | 0 | 0 | 0 | 0 | 112.4 | G117 K118 A119 A125 | G117-S121 WeakPolarHBondContact O-CB 3.42Å; G117-S121 PolarHBondContact O-N 2.85Å; G117-S121 PolarHBondContact O-OG 2.83Å; K118-S121 PolarHBondContact O-N 2.87Å; A119-S121 VanDerWaalsContact C-N 3.33Å; A119-S121 PolarHBondContact O-N 3.49Å; S121-A125 VanDerWaalsContact O-CB 3.27Å; S121-A125 WeakPolarHBondContact O-CB 3.48Å; S121-A125 PolarHBondContact O-N 2.96Å |
| 122 | I | 97.6 | Very high | 96.2 | Very high | 119 Ų | 119 | 76.4 Ų | 76.4 | 61% | 0.61 | 41% | 0.41 | S | S | * | . | H | α-helix | trans | -61.9 | -52.6 | 174.5 | -66.1 | 165.2 | 0 | 0 | 0 | 110.5 | K118 A119 F120 Y124 A125 L126 | K118-I122 WeakPolarHBondContact O-CG1 3.48Å; K118-I122 PolarHBondContact O-N 3.06Å; K118-I122 VanDerWaalsContact O-N 3.1Å; A119-I122 WeakPolarHBondContact O-CB 3.4Å; A119-I122 PolarHBondContact O-N 2.99Å; F120-I122 VanDerWaalsContact C-N 3.28Å; F120-I122 PolarHBondContact O-N 3.13Å; I122-Y124 VanDerWaalsContact C-N 3.35Å; I122-Y124 PolarHBondContact O-N 3.11Å; I122-A125 PolarHBondContact O-N 3.42Å; I122-L126 WeakPolarHBondContact O-CB 3.3Å; I122-L126 PolarHBondContact O-N 3.16Å |
| 123 | F | 97.8 | Very high | 96.3 | Very high | 139 Ų | 139 | 79.4 Ų | 79.4 | 61% | 0.61 | 42% | 0.423 | S | S | * | . | H | α-helix | trans | -64.6 | -39.5 | 179.7 | -71.3 | -68.4 | 0 | 0 | 0 | 112.5 | A119 F120 L126 L127 | A119-F123 WeakPolarHBondContact O-CD2 3.28Å; A119-F123 PolarHBondContact O-N 3.41Å; F120-F123 PolarHBondContact O-N 3.14Å; F123-L126 PolarHBondContact O-N 3.01Å; F123-L127 PolarHBondContact O-N 3.35Å |
| 124 | Y | 97.9 | Very high | 96.6 | Very high | 89 Ų | 89 | 81.3 Ų | 81.3 | 35% | 0.349 | 43% | 0.433 | S | S | . | . | H | α-helix | trans | -65.1 | -44.2 | 178.5 | -176.3 | -104.9 | 0 | 0 | 0 | 111.8 | A98 L101 V102 F120 I122 G128 | A98-Y124 HydrophobicContact CB-CE1 3.95Å; L101-Y124 HydrophobicContact CD2-CD1 3.85Å; V102-Y124 HydrophobicContact CG1-CD1 3.93Å; V102-Y124 HydrophobicContact CG1-CE1 3.35Å; F120-Y124 HydrophobicContact CE1-CD2 4.4Å; F120-Y124 HydrophobicContact CE1-CG 4.29Å; F120-Y124 HydrophobicContact CZ-CD2 4.16Å; F120-Y124 HydrophobicContact CZ-CG 4.45Å; F120-Y124 VanDerWaalsContact O-CB 3.24Å; F120-Y124 WeakPolarHBondContact O-CB 3.48Å; F120-Y124 PolarHBondContact O-N 3.4Å; I122-Y124 VanDerWaalsContact C-N 3.35Å; I122-Y124 PolarHBondContact O-N 3.11Å; Y124-G128 WeakPolarHBondContact O-CA 3.38Å; Y124-G128 PolarHBondContact O-N 3.43Å |
| 125 | A | 97.3 | Very high | 96.7 | Very high | 23 Ų | 23 | 80.4 Ų | 80.4 | 19% | 0.19 | 42% | 0.424 | C | S | . | . | H | α-helix | trans | -67.4 | -39.1 | 176.6 | 0 | 0 | 0 | 0 | 0 | 112.3 | L101 S121 I122 L127 G128 V129 | L101-A125 HydrophobicContact CD1-CB 4.2Å; L101-A125 HydrophobicContact CG-CB 4.19Å; S121-A125 VanDerWaalsContact O-CB 3.27Å; S121-A125 WeakPolarHBondContact O-CB 3.48Å; S121-A125 PolarHBondContact O-N 2.96Å; I122-A125 PolarHBondContact O-N 3.42Å; A125-L127 VanDerWaalsContact C-N 3.27Å; A125-L127 PolarHBondContact O-N 3.03Å; A125-G128 PolarHBondContact O-N 3.12Å; A125-V129 HydrophobicContact CB-CG2 4.48Å; A125-V129 WeakPolarHBondContact O-CB 3.1Å; A125-V129 WeakPolarHBondContact O-CG2 3.28Å; A125-V129 PolarHBondContact O-N 2.83Å |
| 126 | L | 97.4 | Very high | 96.6 | Very high | 118 Ų | 118 | 74.7 Ų | 74.7 | 62% | 0.618 | 39% | 0.394 | S | S | * | . | H | α-helix | trans | -57.2 | -39.6 | 179.2 | -178.9 | 65.8 | 0 | 0 | 0 | 112.6 | I122 F123 P130 | I122-L126 WeakPolarHBondContact O-CB 3.3Å; I122-L126 PolarHBondContact O-N 3.16Å; F123-L126 PolarHBondContact O-N 3.01Å; L126-P130 WeakPolarHBondContact O-CD 3.29Å; L126-P130 WeakPolarHBondContact O-CG 3.46Å |
| 127 | L | 97.4 | Very high | 96.4 | Very high | 134 Ų | 134 | 70.8 Ų | 70.8 | 70% | 0.702 | 37% | 0.37 | S | S | * | . | H | α-helix | trans | -90.2 | -37.2 | 177.7 | -61.2 | 177.8 | 0 | 0 | 0 | 112.4 | F123 A125 F131 | F123-L127 PolarHBondContact O-N 3.35Å; A125-L127 VanDerWaalsContact C-N 3.27Å; A125-L127 PolarHBondContact O-N 3.03Å; L127-F131 WeakPolarHBondContact O-CB 3.34Å; L127-F131 PolarHBondContact O-N 3.1Å |
| 128 | G | 97.7 | Very high | 96.3 | Very high | 10 Ų | 10 | 72 Ų | 72 | 10% | 0.103 | 38% | 0.378 | C | S | . | . | H | α-helix | trans | -73.2 | -37.7 | -173.2 | 0 | 0 | 0 | 0 | 0 | 113.9 | Y124 A125 F131 T132 | Y124-G128 WeakPolarHBondContact O-CA 3.38Å; Y124-G128 PolarHBondContact O-N 3.43Å; A125-G128 PolarHBondContact O-N 3.12Å; G128-F131 PolarHBondContact O-N 2.94Å; G128-T132 VanDerWaalsContact O-CB 3.3Å; G128-T132 WeakPolarHBondContact O-CB 3.49Å; G128-T132 PolarHBondContact O-N 2.93Å; G128-T132 PolarHBondContact O-OG1 3.49Å |
| 129 | V | 97.1 | Very high | 96.2 | Very high | 37 Ų | 37 | 69.8 Ų | 69.8 | 22% | 0.224 | 37% | 0.374 | C | S | . | . | H | α-helix | trans | -65.6 | -50.7 | 179.7 | 173.9 | 0 | 0 | 0 | 0 | 111.5 | T104 A125 F131 T132 M133 | T104-V129 HydrophobicContact CG2-CB 4.4Å; T104-V129 HydrophobicContact CG2-CG1 3.75Å; T104-V129 HydrophobicContact CG2-CG2 3.69Å; A125-V129 HydrophobicContact CB-CG2 4.48Å; A125-V129 WeakPolarHBondContact O-CB 3.1Å; A125-V129 WeakPolarHBondContact O-CG2 3.28Å; A125-V129 PolarHBondContact O-N 2.83Å; V129-F131 VanDerWaalsContact C-N 3.33Å; V129-F131 PolarHBondContact O-N 2.96Å; V129-T132 PolarHBondContact O-N 3.31Å; V129-M133 WeakPolarHBondContact O-CG 3.43Å; V129-M133 PolarHBondContact O-N 3.35Å |
| 130 | P | 97.5 | Very high | 96 | Very high | 77 Ų | 77 | 67.9 Ų | 67.9 | 50% | 0.5 | 36% | 0.358 | S | S | . | . | H | α-helix | trans | -60 | -41.6 | 175 | -24 | 34.4 | 0 | 0 | 0 | 112.9 | L126 T132 M133 L134 | L126-P130 WeakPolarHBondContact O-CD 3.29Å; L126-P130 WeakPolarHBondContact O-CG 3.46Å; P130-T132 PolarHBondContact O-N 3.26Å; P130-M133 PolarHBondContact O-N 3.37Å; P130-L134 PolarHBondContact O-N 2.99Å |
| 131 | F | 96.6 | Very high | 95.7 | Very high | 133 Ų | 133 | 66.1 Ų | 66.1 | 58% | 0.583 | 35% | 0.352 | S | S | * | . | H | α-helix | trans | -61.7 | -44 | 176.7 | 177.1 | -102.3 | 0 | 0 | 0 | 111.9 | L127 G128 V129 M133 L134 V135 | L127-F131 WeakPolarHBondContact O-CB 3.34Å; L127-F131 PolarHBondContact O-N 3.1Å; G128-F131 PolarHBondContact O-N 2.94Å; V129-F131 VanDerWaalsContact C-N 3.33Å; V129-F131 PolarHBondContact O-N 2.96Å; F131-M133 PolarHBondContact O-N 3.3Å; F131-L134 WeakPolarHBondContact O-CB 3.29Å; F131-L134 PolarHBondContact O-N 3.37Å; F131-V135 HydrophobicContact CD1-CG2 4.39Å; F131-V135 HydrophobicContact CE1-CG2 3.95Å; F131-V135 HydrophobicContact CE2-CG2 4.16Å; F131-V135 HydrophobicContact CZ-CG2 3.82Å; F131-V135 WeakPolarHBondContact O-CG2 3.38Å; F131-V135 PolarHBondContact O-N 2.94Å |
| 132 | T | 95.6 | Very high | 95.5 | Very high | 14 Ų | 14 | 75.4 Ų | 75.4 | 9% | 0.086 | 38% | 0.384 | C | S | . | . | H | α-helix | trans | -63.4 | -42.4 | 177.5 | -58.5 | 0 | 0 | 0 | 0 | 111.1 | V102 T103 G128 V129 P130 L134 V135 L136 | V102-T132 WeakPolarHBondContact CB-OG1 3.33Å; V102-T132 WeakPolarHBondContact CG2-OG1 3.48Å; T103-T132 HydrophobicContact CG2-CG2 4.2Å; G128-T132 VanDerWaalsContact O-CB 3.3Å; G128-T132 WeakPolarHBondContact O-CB 3.49Å; G128-T132 PolarHBondContact O-N 2.93Å; G128-T132 PolarHBondContact O-OG1 3.49Å; V129-T132 PolarHBondContact O-N 3.31Å; P130-T132 PolarHBondContact O-N 3.26Å; T132-L134 VanDerWaalsContact C-N 3.35Å; T132-L134 PolarHBondContact O-N 3.21Å; T132-V135 PolarHBondContact O-N 2.93Å; T132-L136 VanDerWaalsContact O-CB 3.28Å; T132-L136 WeakPolarHBondContact O-CB 3.45Å; T132-L136 PolarHBondContact O-N 3.24Å |
| 133 | M | 93.4 | Very high | 95.2 | Very high | 89 Ų | 89 | 71.9 Ų | 71.9 | 44% | 0.438 | 37% | 0.366 | S | S | . | . | H | α-helix | trans | -62.7 | -39.1 | 175.3 | -74.9 | -66.4 | 171 | 0 | 0 | 112.6 | V129 P130 F131 L136 T137 | V129-M133 WeakPolarHBondContact O-CG 3.43Å; V129-M133 PolarHBondContact O-N 3.35Å; P130-M133 PolarHBondContact O-N 3.37Å; F131-M133 PolarHBondContact O-N 3.3Å; M133-L136 PolarHBondContact O-N 3.49Å; M133-L136 HydrophobicContact SD-CD2 4.39Å; M133-T137 WeakPolarHBondContact O-CB 2.95Å; M133-T137 PolarHBondContact O-N 3.35Å; M133-T137 PolarHBondContact O-OG1 2.86Å |
| 134 | L | 95.1 | Very high | 94.8 | Very high | 118 Ų | 118 | 66 Ų | 66 | 62% | 0.618 | 34% | 0.341 | S | S | * | . | H | α-helix | trans | -62.9 | -48.3 | 174.5 | 180 | 67 | 0 | 0 | 0 | 111.5 | P130 F131 T132 L136 T137 A138 | P130-L134 PolarHBondContact O-N 2.99Å; F131-L134 WeakPolarHBondContact O-CB 3.29Å; F131-L134 PolarHBondContact O-N 3.37Å; T132-L134 VanDerWaalsContact C-N 3.35Å; T132-L134 PolarHBondContact O-N 3.21Å; L134-L136 PolarHBondContact O-N 3.47Å; L134-T137 PolarHBondContact O-N 3.48Å; L134-A138 PolarHBondContact O-N 3.43Å |
| 135 | V | 95.6 | Very high | 94.3 | Very high | 47 Ų | 47 | 68.1 Ų | 68.1 | 29% | 0.285 | 35% | 0.354 | S | S | . | . | H | α-helix | trans | -61.1 | -45.9 | 177.7 | 174 | 0 | 0 | 0 | 0 | 110.6 | F131 T132 T137 A138 C139 F241 | F131-V135 HydrophobicContact CD1-CG2 4.39Å; F131-V135 HydrophobicContact CE1-CG2 3.95Å; F131-V135 HydrophobicContact CE2-CG2 4.16Å; F131-V135 HydrophobicContact CZ-CG2 3.82Å; F131-V135 WeakPolarHBondContact O-CG2 3.38Å; F131-V135 PolarHBondContact O-N 2.94Å; T132-V135 PolarHBondContact O-N 2.93Å; V135-T137 VanDerWaalsContact C-N 3.3Å; V135-T137 PolarHBondContact O-N 3.12Å; V135-A138 PolarHBondContact O-N 2.88Å; V135-C139 WeakPolarHBondContact O-CB 3.4Å; V135-C139 PolarHBondContact O-N 3.23Å; V135-C139 PolarHBondContact O-SG 3.17Å; V135-F241 HydrophobicContact CG1-CZ 4.01Å |
| 136 | L | 93.4 | Very high | 94 | Very high | 5 Ų | 5 | 71 Ų | 71 | 3% | 0.026 | 37% | 0.37 | C | S | . | . | H | α-helix | trans | -58.3 | -43.9 | 177.7 | -169.4 | 66.6 | 0 | 0 | 0 | 111.4 | T132 M133 L134 C139 V140 L244 M245 Y248 | T132-L136 VanDerWaalsContact O-CB 3.28Å; T132-L136 WeakPolarHBondContact O-CB 3.45Å; T132-L136 PolarHBondContact O-N 3.24Å; M133-L136 PolarHBondContact O-N 3.49Å; M133-L136 HydrophobicContact SD-CD2 4.39Å; L134-L136 PolarHBondContact O-N 3.47Å; L136-C139 PolarHBondContact O-N 2.96Å; L136-V140 WeakPolarHBondContact O-CB 3.37Å; L136-V140 WeakPolarHBondContact O-CG2 3.36Å; L136-V140 PolarHBondContact O-N 2.92Å; L136-L244 HydrophobicContact CD1-CG 4.42Å; L136-L244 HydrophobicContact CD2-CD2 4.16Å; L136-L244 HydrophobicContact CD2-CG 4.01Å; L136-M245 VanDerWaalsContact CD1-CA 3.47Å; L136-M245 HydrophobicContact CD1-CB 3.82Å; L136-M245 HydrophobicContact CD1-CG 4.31Å; L136-Y248 HydrophobicContact CD2-CD1 4.38Å; L136-Y248 HydrophobicContact CD2-CG 4.2Å; L136-Y248 HydrophobicContact CG-CD1 4.06Å; L136-Y248 HydrophobicContact CG-CG 4.33Å |
| 137 | T | 92.8 | Very high | 93.8 | Very high | 32 Ų | 32 | 67.4 Ų | 67.4 | 20% | 0.196 | 35% | 0.353 | C | S | . | . | H | α-helix | trans | -63.3 | -51.3 | 178.7 | -57.5 | 0 | 0 | 0 | 0 | 111.5 | M133 L134 V135 C139 V140 Q141 | M133-T137 WeakPolarHBondContact O-CB 2.95Å; M133-T137 PolarHBondContact O-N 3.35Å; M133-T137 PolarHBondContact O-OG1 2.86Å; L134-T137 PolarHBondContact O-N 3.48Å; V135-T137 VanDerWaalsContact C-N 3.3Å; V135-T137 PolarHBondContact O-N 3.12Å; T137-C139 VanDerWaalsContact C-N 3.32Å; T137-C139 PolarHBondContact O-N 3.01Å; T137-V140 PolarHBondContact O-N 3.28Å; T137-Q141 HydrophobicContact CG2-CG 4.39Å; T137-Q141 WeakPolarHBondContact O-CB 3.4Å; T137-Q141 WeakPolarHBondContact O-CG 3.44Å; T137-Q141 PolarHBondContact O-N 2.9Å |
| 138 | A | 94.3 | Very high | 93.4 | Very high | 43 Ų | 43 | 61.1 Ų | 61.1 | 36% | 0.355 | 32% | 0.32 | S | S | . | . | H | α-helix | trans | -61.3 | -39.9 | 179.4 | 0 | 0 | 0 | 0 | 0 | 112.4 | L134 V135 R142 | L134-A138 PolarHBondContact O-N 3.43Å; V135-A138 PolarHBondContact O-N 2.88Å; A138-R142 WeakPolarHBondContact O-CG 3.34Å; A138-R142 PolarHBondContact O-N 3.28Å |
| 139 | C | 93.6 | Very high | 92.9 | Very high | 47 Ų | 47 | 63.4 Ų | 63.4 | 32% | 0.318 | 33% | 0.327 | S | S | . | . | H | α-helix | trans | -64.1 | -47.6 | 175.8 | -74.8 | 0 | 0 | 0 | 0 | 111.9 | V135 L136 T137 R142 L143 M245 | V135-C139 WeakPolarHBondContact O-CB 3.4Å; V135-C139 PolarHBondContact O-N 3.23Å; V135-C139 PolarHBondContact O-SG 3.17Å; L136-C139 PolarHBondContact O-N 2.96Å; T137-C139 VanDerWaalsContact C-N 3.32Å; T137-C139 PolarHBondContact O-N 3.01Å; C139-R142 PolarHBondContact O-N 3.48Å; C139-L143 WeakPolarHBondContact O-CB 3.31Å; C139-L143 PolarHBondContact O-N 3.47Å; C139-M245 HydrophobicContact CB-SD 3.96Å |
| 140 | V | 93.8 | Very high | 92.5 | Very high | 1 Ų | 1 | 63.2 Ų | 63.2 | 1% | 0.006 | 33% | 0.332 | C | S | . | . | H | α-helix | trans | -68 | -40 | -179.4 | 166.8 | 0 | 0 | 0 | 0 | 112 | L136 T137 R142 L143 M144 M245 Y248 L249 R252 | L136-V140 WeakPolarHBondContact O-CB 3.37Å; L136-V140 WeakPolarHBondContact O-CG2 3.36Å; L136-V140 PolarHBondContact O-N 2.92Å; T137-V140 PolarHBondContact O-N 3.28Å; V140-R142 VanDerWaalsContact C-N 3.31Å; V140-R142 PolarHBondContact O-N 3.26Å; V140-L143 CarbonylContact O-C 3.55Å; V140-L143 PolarHBondContact O-N 2.89Å; V140-L143 VanDerWaalsContact O-N 3.08Å; V140-M144 HydrophobicContact CG1-CG 4.18Å; V140-M144 WeakPolarHBondContact O-CG 3.35Å; V140-M144 PolarHBondContact O-N 3.49Å; V140-M245 HydrophobicContact CG2-CB 4.49Å; V140-M245 HydrophobicContact CG2-CG 3.55Å; V140-M245 VanDerWaalsContact CG2-O 3.3Å; V140-M245 WeakPolarHBondContact CG2-O 3.24Å; V140-Y248 HydrophobicContact CB-CD1 3.58Å; V140-Y248 HydrophobicContact CB-CE1 3.95Å; V140-Y248 HydrophobicContact CG1-CD1 3.75Å; V140-Y248 HydrophobicContact CG1-CE1 4.02Å; V140-Y248 HydrophobicContact CG2-CD1 3.51Å; V140-Y248 HydrophobicContact CG2-CE1 4.37Å; V140-Y248 HydrophobicContact CG2-CG 4.32Å; V140-L249 HydrophobicContact CG1-CB 4.16Å; V140-L249 HydrophobicContact CG1-CD1 4.01Å; V140-L249 HydrophobicContact CG2-CB 4.46Å; V140-R252 HydrophobicContact CG1-CG 4.28Å |
| 141 | Q | 91.2 | Very high | 92.1 | Very high | 98 Ų | 98 | 61.5 Ų | 61.5 | 46% | 0.458 | 32% | 0.321 | S | S | . | . | H | α-helix | trans | -56.6 | -45.6 | 174.5 | -77 | 175.4 | -34.7 | 0 | 0 | 111.6 | T137 L143 M144 | T137-Q141 HydrophobicContact CG2-CG 4.39Å; T137-Q141 WeakPolarHBondContact O-CB 3.4Å; T137-Q141 WeakPolarHBondContact O-CG 3.44Å; T137-Q141 PolarHBondContact O-N 2.9Å; Q141-L143 VanDerWaalsContact C-N 3.33Å; Q141-L143 PolarHBondContact O-N 3.32Å; Q141-M144 PolarHBondContact O-N 3.43Å |
| 142 | R | 92.2 | Very high | 91.7 | Very high | 211 Ų | 211 | 55.4 Ų | 55.4 | 80% | 0.796 | 29% | 0.294 | S | S | * | . | H | α-helix | trans | -65.2 | -36.6 | 175.2 | -72 | -175.5 | 177.9 | -178.4 | 0.9 | 112.9 | A138 C139 V140 P146 | A138-R142 WeakPolarHBondContact O-CG 3.34Å; A138-R142 PolarHBondContact O-N 3.28Å; C139-R142 PolarHBondContact O-N 3.48Å; V140-R142 VanDerWaalsContact C-N 3.31Å; V140-R142 PolarHBondContact O-N 3.26Å; R142-P146 VanDerWaalsContact O-CD 3.23Å; R142-P146 WeakPolarHBondContact O-CD 3.48Å |
| 143 | L | 92.3 | Very high | 91.3 | Very high | 44 Ų | 44 | 57.9 Ų | 57.9 | 23% | 0.23 | 31% | 0.307 | C | S | . | . | H | α-helix | trans | -74.9 | -26.7 | 180 | -168.8 | 63 | 0 | 0 | 0 | 112.6 | C139 V140 Q141 H145 P146 V147 M245 M246 L249 | C139-L143 WeakPolarHBondContact O-CB 3.31Å; C139-L143 PolarHBondContact O-N 3.47Å; V140-L143 CarbonylContact O-C 3.55Å; V140-L143 PolarHBondContact O-N 2.89Å; V140-L143 VanDerWaalsContact O-N 3.08Å; Q141-L143 VanDerWaalsContact C-N 3.33Å; Q141-L143 PolarHBondContact O-N 3.32Å; L143-H145 VanDerWaalsContact C-N 3.3Å; L143-H145 PolarHBondContact O-N 2.81Å; L143-P146 VanDerWaalsContact O-CD 3.24Å; L143-P146 WeakPolarHBondContact O-CD 3.45Å; L143-P146 WeakPolarHBondContact O-CG 3.49Å; L143-V147 HydrophobicContact CD1-CG2 3.55Å; L143-V147 HydrophobicContact CG-CB 4.4Å; L143-V147 HydrophobicContact CG-CG2 3.69Å; L143-V147 VanDerWaalsContact O-CB 3.27Å; L143-V147 WeakPolarHBondContact O-CB 3.47Å; L143-V147 WeakPolarHBondContact O-CG2 3.3Å; L143-V147 PolarHBondContact O-N 3.29Å; L143-M245 HydrophobicContact CD2-CE 3.84Å; L143-M245 HydrophobicContact CD2-SD 4.33Å; L143-M246 HydrophobicContact CD2-SD 3.99Å; L143-L249 HydrophobicContact CD2-CD2 4.16Å; L143-L249 HydrophobicContact CG-CD2 4.49Å |
| 144 | M | 89.2 | Confident | 90.9 | Very high | 17 Ų | 17 | 58.8 Ų | 58.8 | 8% | 0.084 | 31% | 0.311 | C | S | . | . | H | α-helix | trans | -60.8 | -37.2 | 179.6 | -84 | -173.5 | 71.5 | 0 | 0 | 112.3 | V140 Q141 T148 Y149 L249 R252 | V140-M144 HydrophobicContact CG1-CG 4.18Å; V140-M144 WeakPolarHBondContact O-CG 3.35Å; V140-M144 PolarHBondContact O-N 3.49Å; Q141-M144 PolarHBondContact O-N 3.43Å; M144-T148 WeakPolarHBondContact O-CA 3.36Å; M144-T148 VanDerWaalsContact O-CB 3.3Å; M144-T148 WeakPolarHBondContact O-CB 3.45Å; M144-T148 PolarHBondContact O-N 3.45Å; M144-Y149 HydrophobicContact CB-CD2 4.16Å; M144-Y149 HydrophobicContact CB-CE2 3.94Å; M144-Y149 HydrophobicContact CE-CE2 3.84Å; M144-Y149 WeakPolarHBondContact O-CD2 3.43Å; M144-Y149 PolarHBondContact O-N 3.05Å; M144-L249 HydrophobicContact CB-CD1 4.47Å; M144-L249 HydrophobicContact CG-CD1 3.5Å; M144-R252 HydrophobicContact SD-CB 4.04Å; M144-R252 HydrophobicContact SD-CG 4.38Å |
| 145 | H | 86.8 | Confident | 90.5 | Very high | 133 Ų | 133 | 54 Ų | 54 | 62% | 0.616 | 29% | 0.288 | S | S | * | . | I | π-helix | trans | -58.8 | -59.4 | 179.4 | -172.8 | -76.6 | 0 | 0 | 0 | 112.7 | L143 Y149 G150 | L143-H145 VanDerWaalsContact C-N 3.3Å; L143-H145 PolarHBondContact O-N 2.81Å; H145-Y149 PolarHBondContact O-N 3.46Å; H145-G150 PolarHBondContact O-N 3.34Å |
| 146 | P | 91.6 | Very high | 90.1 | Very high | 82 Ų | 82 | 57.5 Ų | 57.5 | 53% | 0.532 | 30% | 0.296 | S | S | . | . | I | π-helix | trans | -71.8 | -30.4 | 178.8 | 28 | -35.5 | 0 | 0 | 0 | 114 | R142 L143 P151 | R142-P146 VanDerWaalsContact O-CD 3.23Å; R142-P146 WeakPolarHBondContact O-CD 3.48Å; L143-P146 VanDerWaalsContact O-CD 3.24Å; L143-P146 WeakPolarHBondContact O-CD 3.45Å; L143-P146 WeakPolarHBondContact O-CG 3.49Å; P146-P151 VanDerWaalsContact O-CD 3.31Å; P146-P151 WeakPolarHBondContact O-CD 3.32Å |
| 147 | V | 91.9 | Very high | 89.8 | Confident | 43 Ų | 43 | 65 Ų | 65 | 26% | 0.261 | 33% | 0.331 | S | S | . | . | I | π-helix | trans | -92.2 | -33.8 | -172.6 | -178.6 | 0 | 0 | 0 | 0 | 113 | L143 P151 H170 L174 L249 | L143-V147 HydrophobicContact CD1-CG2 3.55Å; L143-V147 HydrophobicContact CG-CB 4.4Å; L143-V147 HydrophobicContact CG-CG2 3.69Å; L143-V147 VanDerWaalsContact O-CB 3.27Å; L143-V147 WeakPolarHBondContact O-CB 3.47Å; L143-V147 WeakPolarHBondContact O-CG2 3.3Å; L143-V147 PolarHBondContact O-N 3.29Å; V147-P151 WeakPolarHBondContact O-CG 3.34Å; V147-H170 PolarHBondContact O-CE1 2.81Å; V147-L174 HydrophobicContact CG1-CD1 3.91Å; V147-L249 HydrophobicContact CB-CD2 4.25Å; V147-L249 HydrophobicContact CG1-CD2 3.75Å |
| 148 | T | 89.6 | Confident | 89.6 | Confident | 2 Ų | 2 | 73.6 Ų | 73.6 | 1% | 0.012 | 36% | 0.36 | C | S | . | . | I | π-helix | trans | -109.5 | -59.1 | -176.4 | -54.7 | 0 | 0 | 0 | 0 | 112 | M144 I152 H170 | M144-T148 WeakPolarHBondContact O-CA 3.36Å; M144-T148 VanDerWaalsContact O-CB 3.3Å; M144-T148 WeakPolarHBondContact O-CB 3.45Å; M144-T148 PolarHBondContact O-N 3.45Å; T148-I152 HydrophobicContact CG2-CD1 3.79Å; T148-I152 WeakPolarHBondContact O-CB 3.33Å; T148-I152 WeakPolarHBondContact O-CD1 3.36Å; T148-I152 WeakPolarHBondContact O-CG1 3.28Å; T148-I152 PolarHBondContact O-N 2.94Å; T148-H170 WeakPolarHBondContact CA-NE2 3.4Å |
| 149 | Y | 87.6 | Confident | 89.3 | Confident | 59 Ų | 59 | 77.3 Ų | 77.3 | 23% | 0.231 | 37% | 0.372 | C | S | . | . | I | π-helix | trans | -64.4 | -49.9 | -174.1 | -68.5 | -84.7 | 0 | 0 | 0 | 112.1 | M144 H145 I152 D153 | M144-Y149 HydrophobicContact CB-CD2 4.16Å; M144-Y149 HydrophobicContact CB-CE2 3.94Å; M144-Y149 HydrophobicContact CE-CE2 3.84Å; M144-Y149 WeakPolarHBondContact O-CD2 3.43Å; M144-Y149 PolarHBondContact O-N 3.05Å; H145-Y149 PolarHBondContact O-N 3.46Å; Y149-I152 PolarHBondContact O-N 3.34Å; Y149-D153 PolarHBondContact O-N 2.9Å |
| 150 | G | 88.2 | Confident | 88.9 | Confident | 33 Ų | 33 | 78 Ų | 78 | 34% | 0.34 | 39% | 0.387 | S | S | . | . | H | α-helix | trans | -56.7 | -52.3 | -179.2 | 0 | 0 | 0 | 0 | 0 | 114.2 | H145 I152 D153 M154 | H145-G150 PolarHBondContact O-N 3.34Å; G150-I152 VanDerWaalsContact C-N 3.35Å; G150-I152 PolarHBondContact O-N 3.48Å; G150-D153 PolarHBondContact O-N 3.11Å; G150-M154 WeakPolarHBondContact O-CB 3.44Å; G150-M154 PolarHBondContact O-N 2.76Å |
| 151 | P | 88.9 | Confident | 88.6 | Confident | 40 Ų | 40 | 80.4 Ų | 80.4 | 26% | 0.26 | 40% | 0.4 | S | S | . | . | H | α-helix | trans | -64.7 | -34.3 | 178.7 | -28.6 | 39 | 0 | 0 | 0 | 114 | P146 V147 C155 | P146-P151 VanDerWaalsContact O-CD 3.31Å; P146-P151 WeakPolarHBondContact O-CD 3.32Å; V147-P151 WeakPolarHBondContact O-CG 3.34Å; P151-C155 PolarHBondContact O-N 2.84Å; P151-C155 PolarHBondContact O-SG 3.48Å |
| 152 | I | 88.4 | Confident | 88.5 | Confident | 6 Ų | 6 | 81.5 Ų | 81.5 | 3% | 0.031 | 41% | 0.409 | C | S | . | . | H | α-helix | trans | -64.9 | -49 | 174.9 | -69.2 | 170.7 | 0 | 0 | 0 | 109.9 | T148 Y149 G150 M154 C155 R156 A166 H170 | T148-I152 HydrophobicContact CG2-CD1 3.79Å; T148-I152 WeakPolarHBondContact O-CB 3.33Å; T148-I152 WeakPolarHBondContact O-CD1 3.36Å; T148-I152 WeakPolarHBondContact O-CG1 3.28Å; T148-I152 PolarHBondContact O-N 2.94Å; Y149-I152 PolarHBondContact O-N 3.34Å; G150-I152 VanDerWaalsContact C-N 3.35Å; G150-I152 PolarHBondContact O-N 3.48Å; I152-M154 VanDerWaalsContact C-N 3.3Å; I152-M154 PolarHBondContact O-N 3.36Å; I152-C155 PolarHBondContact O-N 3.3Å; I152-C155 VanDerWaalsContact O-N 3.14Å; I152-R156 HydrophobicContact CG2-CG 4.47Å; I152-R156 WeakPolarHBondContact O-CG 3.49Å; I152-R156 PolarHBondContact O-N 2.98Å; I152-A166 HydrophobicContact CG2-CB 4.39Å; I152-H170 HydrophobicContact CD1-CB 4.26Å; I152-H170 HydrophobicContact CG1-CB 3.64Å |
| 153 | D | 86.9 | Confident | 88.2 | Confident | 65 Ų | 65 | 74.8 Ų | 74.8 | 35% | 0.348 | 39% | 0.392 | S | S | . | . | H | α-helix | trans | -64.6 | -36.6 | 178.6 | -75.9 | -24.4 | 0 | 0 | 0 | 112 | Y149 G150 R156 Q157 | Y149-D153 PolarHBondContact O-N 2.9Å; G150-D153 PolarHBondContact O-N 3.11Å; D153-R156 PolarHBondContact O-N 3.29Å; D153-R156 IonicContact OD1-NH1 3.95Å; D153-Q157 WeakPolarHBondContact O-CB 3.27Å; D153-Q157 VanDerWaalsContact O-CG 3.28Å; D153-Q157 WeakPolarHBondContact O-CG 3.45Å; D153-Q157 PolarHBondContact O-N 3.48Å |
| 154 | M | 85.7 | Confident | 87.9 | Confident | 108 Ų | 108 | 76.4 Ų | 76.4 | 53% | 0.532 | 40% | 0.401 | S | S | . | . | H | α-helix | trans | -60.9 | -45.7 | 171.7 | -174 | -174.1 | 69 | 0 | 0 | 111.5 | G150 I152 R156 Q157 R158 | G150-M154 WeakPolarHBondContact O-CB 3.44Å; G150-M154 PolarHBondContact O-N 2.76Å; I152-M154 VanDerWaalsContact C-N 3.3Å; I152-M154 PolarHBondContact O-N 3.36Å; M154-R156 VanDerWaalsContact C-N 3.31Å; M154-R156 PolarHBondContact O-N 3Å; M154-Q157 PolarHBondContact O-N 3.44Å; M154-R158 HydrophobicContact CG-CG 3.91Å; M154-R158 WeakPolarHBondContact O-CB 3.26Å; M154-R158 WeakPolarHBondContact O-CG 3.39Å; M154-R158 PolarHBondContact O-N 2.82Å |
| 155 | C | 86.8 | Confident | 87.9 | Confident | 19 Ų | 19 | 77.4 Ų | 77.4 | 13% | 0.128 | 41% | 0.412 | C | S | . | . | H | α-helix | trans | -62.2 | -40.7 | 176.8 | -70.8 | 0 | 0 | 0 | 0 | 111.5 | P151 I152 I159 G160 L161 A166 | P151-C155 PolarHBondContact O-N 2.84Å; P151-C155 PolarHBondContact O-SG 3.48Å; I152-C155 PolarHBondContact O-N 3.3Å; I152-C155 VanDerWaalsContact O-N 3.14Å; C155-I159 WeakPolarHBondContact O-CA 3.27Å; C155-I159 VanDerWaalsContact O-CB 3.29Å; C155-I159 WeakPolarHBondContact O-CB 3.49Å; C155-I159 PolarHBondContact O-N 2.83Å; C155-G160 PolarHBondContact O-N 3.32Å; C155-L161 HydrophobicContact CB-CD1 4.19Å; C155-A166 HydrophobicContact CB-CB 4.49Å |
| 156 | R | 87.8 | Confident | 88 | Confident | 119 Ų | 119 | 71.1 Ų | 71.1 | 45% | 0.449 | 38% | 0.383 | S | S | . | . | H | α-helix | trans | -65.3 | -47.2 | 177.5 | -68.8 | 174.7 | 72.5 | -157.2 | 4.9 | 111.8 | I152 D153 M154 G160 A166 | I152-R156 HydrophobicContact CG2-CG 4.47Å; I152-R156 WeakPolarHBondContact O-CG 3.49Å; I152-R156 PolarHBondContact O-N 2.98Å; D153-R156 PolarHBondContact O-N 3.29Å; D153-R156 IonicContact OD1-NH1 3.95Å; M154-R156 VanDerWaalsContact C-N 3.31Å; M154-R156 PolarHBondContact O-N 3Å; R156-G160 VanDerWaalsContact O-CA 3.3Å; R156-G160 WeakPolarHBondContact O-CA 3.39Å; R156-G160 PolarHBondContact O-N 2.82Å; R156-G160 VanDerWaalsContact O-N 3.17Å; R156-A166 HydrophobicContact CG-CB 3.89Å |
| 157 | Q | 87.3 | Confident | 87.9 | Confident | 163 Ų | 163 | 67.7 Ų | 67.7 | 76% | 0.762 | 36% | 0.36 | S | S | * | . | H | α-helix | trans | -77.3 | -37.7 | -175.6 | -68.1 | 176.6 | 14.8 | 0 | 0 | 113.5 | D153 M154 | D153-Q157 WeakPolarHBondContact O-CB 3.27Å; D153-Q157 VanDerWaalsContact O-CG 3.28Å; D153-Q157 WeakPolarHBondContact O-CG 3.45Å; D153-Q157 PolarHBondContact O-N 3.48Å; M154-Q157 PolarHBondContact O-N 3.44Å |
| 158 | R | 88.7 | Confident | 87.9 | Confident | 213 Ų | 213 | 67.3 Ų | 67.3 | 80% | 0.804 | 36% | 0.362 | S | S | * | . | H | α-helix | trans | -88.3 | -39.4 | -175.7 | -65 | -72.3 | -169.1 | 176.7 | 0.2 | 113.1 | M154 | M154-R158 HydrophobicContact CG-CG 3.91Å; M154-R158 WeakPolarHBondContact O-CB 3.26Å; M154-R158 WeakPolarHBondContact O-CG 3.39Å; M154-R158 PolarHBondContact O-N 2.82Å |
| 159 | I | 86.4 | Confident | 88 | Confident | 120 Ų | 120 | 70.2 Ų | 70.2 | 62% | 0.615 | 38% | 0.379 | S | S | * | . | H | α-helix | trans | -104.4 | -17.3 | -171.6 | -53 | 170 | 0 | 0 | 0 | 111 | C155 L161 | C155-I159 WeakPolarHBondContact O-CA 3.27Å; C155-I159 VanDerWaalsContact O-CB 3.29Å; C155-I159 WeakPolarHBondContact O-CB 3.49Å; C155-I159 PolarHBondContact O-N 2.83Å; I159-L161 VanDerWaalsContact C-N 3.3Å; I159-L161 HydrophobicContact CB-CD1 3.81Å; I159-L161 HydrophobicContact CB-CG 4.46Å; I159-L161 HydrophobicContact CD1-CD1 4.17Å; I159-L161 HydrophobicContact CG2-CD1 3.53Å; I159-L161 HydrophobicContact CG2-CG 3.99Å |
| 160 | G | 87 | Confident | 88.3 | Confident | 61 Ų | 61 | 68.1 Ų | 68.1 | 63% | 0.629 | 37% | 0.372 | S | S | * | . | trans | 72.1 | 24 | 179.4 | 0 | 0 | 0 | 0 | 0 | 113.4 | C155 R156 | C155-G160 PolarHBondContact O-N 3.32Å; R156-G160 VanDerWaalsContact O-CA 3.3Å; R156-G160 WeakPolarHBondContact O-CA 3.39Å; R156-G160 PolarHBondContact O-N 2.82Å; R156-G160 VanDerWaalsContact O-N 3.17Å | ||
| 161 | L | 87.4 | Confident | 88.6 | Confident | 53 Ų | 53 | 68 Ų | 68 | 28% | 0.277 | 36% | 0.362 | S | S | . | . | trans | -68.1 | 140.6 | 177.2 | -82.4 | 139.5 | 0 | 0 | 0 | 111.4 | C155 I159 A165 A166 | C155-L161 HydrophobicContact CB-CD1 4.19Å; I159-L161 VanDerWaalsContact C-N 3.3Å; I159-L161 HydrophobicContact CB-CD1 3.81Å; I159-L161 HydrophobicContact CB-CG 4.46Å; I159-L161 HydrophobicContact CD1-CD1 4.17Å; I159-L161 HydrophobicContact CG2-CD1 3.53Å; I159-L161 HydrophobicContact CG2-CG 3.99Å; L161-A165 HydrophobicContact CD2-CB 3.96Å; L161-A166 HydrophobicContact CB-CB 4.1Å | ||
| 162 | D | 88.8 | Confident | 88.8 | Confident | 120 Ų | 120 | 68.7 Ų | 68.7 | 64% | 0.642 | 37% | 0.371 | S | S | * | . | trans | -55.6 | 145.8 | 168.4 | -72.6 | -30.3 | 0 | 0 | 0 | 110.8 | L164 A165 A166 | D162-L164 PolarHBondContact O-N 3.25Å; D162-L164 VanDerWaalsContact O-N 3.14Å; D162-A165 HydrophobicContact CB-CB 4.43Å; D162-A165 PolarHBondContact O-N 3.45Å; D162-A165 VanDerWaalsContact O-N 3.12Å; D162-A166 WeakPolarHBondContact O-CB 3.37Å; D162-A166 PolarHBondContact O-N 2.86Å | ||
| 163 | P | 84.4 | Confident | 89.2 | Confident | 70 Ų | 70 | 72.5 Ų | 72.5 | 46% | 0.455 | 39% | 0.391 | S | S | . | . | H | α-helix | trans | -59.1 | -32.7 | -174.9 | 23.2 | -33.9 | 0 | 0 | 0 | 113.1 | T167 | P163-T167 PolarHBondContact O-N 3.19Å; P163-T167 VanDerWaalsContact O-N 3.16Å; P163-T167 PolarHBondContact O-OG1 3.45Å |
| 164 | L | 87 | Confident | 89.6 | Confident | 78 Ų | 78 | 69.8 Ų | 69.8 | 41% | 0.408 | 38% | 0.376 | S | S | . | . | H | α-helix | trans | -68.5 | -48.8 | 177.7 | -164.2 | 68.7 | 0 | 0 | 0 | 111.5 | D162 T167 A168 L260 H261 | D162-L164 PolarHBondContact O-N 3.25Å; D162-L164 VanDerWaalsContact O-N 3.14Å; L164-T167 PolarHBondContact O-N 3.43Å; L164-A168 PolarHBondContact O-N 2.97Å; L164-A168 VanDerWaalsContact O-N 3.13Å; L164-L260 HydrophobicContact CD1-CB 4.39Å; L164-H261 HydrophobicContact CD1-CB 4.38Å; L164-H261 WeakPolarHBondContact CD1-CE1 3.39Å; L164-H261 WeakPolarHBondContact CD1-ND1 3.3Å; L164-H261 WeakPolarHBondContact CD1-NE2 3.43Å; L164-H261 WeakPolarHBondContact CG-NE2 3.47Å |
| 165 | A | 88.9 | Confident | 90.1 | Very high | 39 Ų | 39 | 68.1 Ų | 68.1 | 32% | 0.322 | 37% | 0.369 | S | S | . | . | H | α-helix | trans | -66.5 | -41.4 | 177.7 | 0 | 0 | 0 | 0 | 0 | 111.7 | L161 D162 T167 A168 V169 | L161-A165 HydrophobicContact CD2-CB 3.96Å; D162-A165 HydrophobicContact CB-CB 4.43Å; D162-A165 PolarHBondContact O-N 3.45Å; D162-A165 VanDerWaalsContact O-N 3.12Å; A165-T167 VanDerWaalsContact C-N 3.33Å; A165-T167 PolarHBondContact O-N 2.92Å; A165-A168 PolarHBondContact O-N 3.44Å; A165-V169 WeakPolarHBondContact O-CB 3.31Å; A165-V169 VanDerWaalsContact O-CG2 3.27Å; A165-V169 WeakPolarHBondContact O-CG2 3.26Å; A165-V169 PolarHBondContact O-N 3.18Å |
| 166 | A | 90.1 | Very high | 90.6 | Very high | 1 Ų | 1 | 72.1 Ų | 72.1 | 1% | 0.008 | 39% | 0.389 | C | S | . | . | H | α-helix | trans | -59.5 | -43.4 | 177.9 | 0 | 0 | 0 | 0 | 0 | 111.8 | I152 C155 R156 L161 D162 H170 | I152-A166 HydrophobicContact CG2-CB 4.39Å; C155-A166 HydrophobicContact CB-CB 4.49Å; R156-A166 HydrophobicContact CG-CB 3.89Å; L161-A166 HydrophobicContact CB-CB 4.1Å; D162-A166 WeakPolarHBondContact O-CB 3.37Å; D162-A166 PolarHBondContact O-N 2.86Å; A166-H170 WeakPolarHBondContact O-CB 3.35Å; A166-H170 PolarHBondContact O-N 2.91Å |
| 167 | T | 89.5 | Confident | 91 | Very high | 9 Ų | 9 | 71.5 Ų | 71.5 | 6% | 0.055 | 39% | 0.394 | C | S | . | . | H | α-helix | trans | -67.4 | -42.5 | 178.1 | -54.1 | 0 | 0 | 0 | 0 | 111.7 | P163 L164 A165 H170 F171 M257 L260 | P163-T167 PolarHBondContact O-N 3.19Å; P163-T167 VanDerWaalsContact O-N 3.16Å; P163-T167 PolarHBondContact O-OG1 3.45Å; L164-T167 PolarHBondContact O-N 3.43Å; A165-T167 VanDerWaalsContact C-N 3.33Å; A165-T167 PolarHBondContact O-N 2.92Å; T167-H170 PolarHBondContact O-N 3.36Å; T167-F171 WeakPolarHBondContact O-CB 3.38Å; T167-F171 PolarHBondContact O-N 2.91Å; T167-M257 HydrophobicContact CG2-CB 3.86Å; T167-M257 HydrophobicContact CG2-CG 4.04Å; T167-L260 HydrophobicContact CG2-CD1 4Å |
| 168 | A | 91 | Very high | 91.5 | Very high | 35 Ų | 35 | 64 Ų | 64 | 29% | 0.289 | 36% | 0.359 | S | S | . | . | H | α-helix | trans | -65.1 | -45.1 | 178 | 0 | 0 | 0 | 0 | 0 | 112.4 | L164 A165 F171 A172 | L164-A168 PolarHBondContact O-N 2.97Å; L164-A168 VanDerWaalsContact O-N 3.13Å; A165-A168 PolarHBondContact O-N 3.44Å; A168-F171 PolarHBondContact O-N 3.44Å; A168-A172 WeakPolarHBondContact O-CB 3.38Å; A168-A172 PolarHBondContact O-N 3.37Å |
| 169 | V | 91.9 | Very high | 91.9 | Very high | 63 Ų | 63 | 56.7 Ų | 56.7 | 38% | 0.382 | 34% | 0.338 | S | S | . | . | H | α-helix | trans | -63.3 | -45.5 | 176.4 | 170.9 | 0 | 0 | 0 | 0 | 110.6 | A165 F171 A172 I173 | A165-V169 WeakPolarHBondContact O-CB 3.31Å; A165-V169 VanDerWaalsContact O-CG2 3.27Å; A165-V169 WeakPolarHBondContact O-CG2 3.26Å; A165-V169 PolarHBondContact O-N 3.18Å; V169-F171 PolarHBondContact O-N 2.91Å; V169-A172 PolarHBondContact O-N 2.82Å; V169-I173 HydrophobicContact CG1-CD1 3.78Å; V169-I173 HydrophobicContact CG1-CG1 4.49Å; V169-I173 WeakPolarHBondContact O-CG1 3.41Å; V169-I173 PolarHBondContact O-N 3.2Å |
| 170 | H | 92.9 | Very high | 92.4 | Very high | 15 Ų | 15 | 54.8 Ų | 54.8 | 7% | 0.069 | 33% | 0.328 | C | S | . | . | H | α-helix | trans | -58.6 | -48 | 176.1 | 173.8 | 68.3 | 0 | 0 | 0 | 111.6 | V147 T148 I152 A166 T167 A172 I173 L174 | V147-H170 PolarHBondContact O-CE1 2.81Å; T148-H170 WeakPolarHBondContact CA-NE2 3.4Å; I152-H170 HydrophobicContact CD1-CB 4.26Å; I152-H170 HydrophobicContact CG1-CB 3.64Å; A166-H170 WeakPolarHBondContact O-CB 3.35Å; A166-H170 PolarHBondContact O-N 2.91Å; T167-H170 PolarHBondContact O-N 3.36Å; H170-A172 VanDerWaalsContact C-N 3.34Å; H170-A172 PolarHBondContact O-N 3.46Å; H170-I173 PolarHBondContact O-N 3.17Å; H170-L174 WeakPolarHBondContact O-CB 3.37Å; H170-L174 PolarHBondContact O-N 3.3Å |
| 171 | F | 94.1 | Very high | 92.9 | Very high | 30 Ų | 30 | 53.6 Ų | 53.6 | 13% | 0.132 | 32% | 0.316 | C | S | . | . | H | α-helix | trans | -59.6 | -43.7 | 177.6 | 177.6 | -97.5 | 0 | 0 | 0 | 112.1 | T167 A168 V169 I173 L174 L175 V250 A253 F254 M257 | T167-F171 WeakPolarHBondContact O-CB 3.38Å; T167-F171 PolarHBondContact O-N 2.91Å; A168-F171 PolarHBondContact O-N 3.44Å; V169-F171 PolarHBondContact O-N 2.91Å; F171-I173 VanDerWaalsContact C-N 3.34Å; F171-I173 PolarHBondContact O-N 3.01Å; F171-L174 PolarHBondContact O-N 3.49Å; F171-L175 HydrophobicContact CE1-CD2 4.25Å; F171-L175 VanDerWaalsContact O-CB 3.3Å; F171-L175 WeakPolarHBondContact O-CB 3.34Å; F171-L175 PolarHBondContact O-N 2.72Å; F171-V250 HydrophobicContact CE2-CG1 4.01Å; F171-V250 HydrophobicContact CZ-CG1 4.35Å; F171-A253 HydrophobicContact CD2-CB 4.02Å; F171-F254 HydrophobicContact CD2-CB 4.39Å; F171-F254 HydrophobicContact CE1-CD2 4.44Å; F171-F254 HydrophobicContact CE2-CB 3.56Å; F171-F254 HydrophobicContact CE2-CD2 4.37Å; F171-F254 HydrophobicContact CE2-CG 4.47Å; F171-F254 HydrophobicContact CZ-CB 3.91Å; F171-F254 AromaticContact CZ-CD2 3.94Å; F171-F254 HydrophobicContact CZ-CD2 3.94Å; F171-F254 HydrophobicContact CZ-CG 4.38Å; F171-M257 HydrophobicContact CB-CE 3.67Å; F171-M257 HydrophobicContact CD1-CE 3.02Å; F171-M257 HydrophobicContact CD2-CE 3.97Å; F171-M257 HydrophobicContact CE1-CE 3.54Å; F171-M257 HydrophobicContact CE2-CE 4.4Å; F171-M257 HydrophobicContact CG-CE 3.25Å; F171-M257 HydrophobicContact CZ-CE 4.2Å |
| 172 | A | 95.1 | Very high | 93.4 | Very high | 56 Ų | 56 | 53.2 Ų | 53.2 | 46% | 0.463 | 31% | 0.313 | S | S | . | . | H | α-helix | trans | -61.5 | -42 | 177.6 | 0 | 0 | 0 | 0 | 0 | 112.1 | A168 V169 H170 L176 | A168-A172 WeakPolarHBondContact O-CB 3.38Å; A168-A172 PolarHBondContact O-N 3.37Å; V169-A172 PolarHBondContact O-N 2.82Å; H170-A172 VanDerWaalsContact C-N 3.34Å; H170-A172 PolarHBondContact O-N 3.46Å; A172-L176 WeakPolarHBondContact O-CB 3.12Å; A172-L176 PolarHBondContact O-N 3.07Å |
| 173 | I | 95.1 | Very high | 93.8 | Very high | 86 Ų | 86 | 48.6 Ų | 48.6 | 44% | 0.441 | 29% | 0.287 | S | S | . | . | H | α-helix | trans | -66.4 | -46 | 175.9 | -66.8 | 167.5 | 0 | 0 | 0 | 110.7 | V169 H170 F171 L175 L176 L177 | V169-I173 HydrophobicContact CG1-CD1 3.78Å; V169-I173 HydrophobicContact CG1-CG1 4.49Å; V169-I173 WeakPolarHBondContact O-CG1 3.41Å; V169-I173 PolarHBondContact O-N 3.2Å; H170-I173 PolarHBondContact O-N 3.17Å; F171-I173 VanDerWaalsContact C-N 3.34Å; F171-I173 PolarHBondContact O-N 3.01Å; I173-L175 VanDerWaalsContact C-N 3.35Å; I173-L175 PolarHBondContact O-N 3.04Å; I173-L176 PolarHBondContact O-N 3.35Å; I173-L177 HydrophobicContact CG2-CD1 4.02Å; I173-L177 HydrophobicContact CG2-CG 4.35Å; I173-L177 WeakPolarHBondContact O-CG 3.39Å; I173-L177 PolarHBondContact O-N 2.94Å |
| 174 | L | 95.6 | Very high | 94.5 | Very high | 7 Ų | 7 | 47.5 Ų | 47.5 | 4% | 0.037 | 28% | 0.279 | C | S | . | . | H | α-helix | trans | -59.1 | -46.8 | 177.9 | 179.2 | 66.5 | 0 | 0 | 0 | 110.9 | V147 H170 F171 L176 L177 V178 L249 V250 A253 | V147-L174 HydrophobicContact CG1-CD1 3.91Å; H170-L174 WeakPolarHBondContact O-CB 3.37Å; H170-L174 PolarHBondContact O-N 3.3Å; F171-L174 PolarHBondContact O-N 3.49Å; L174-L176 PolarHBondContact O-N 3.03Å; L174-L177 PolarHBondContact O-N 2.93Å; L174-V178 HydrophobicContact CD1-CG2 4.39Å; L174-V178 WeakPolarHBondContact O-CG2 3.39Å; L174-V178 PolarHBondContact O-N 3.34Å; L174-L249 HydrophobicContact CD1-CD2 4.26Å; L174-L249 HydrophobicContact CD2-CG 4.43Å; L174-V250 HydrophobicContact CD2-CG2 4.46Å; L174-V250 HydrophobicContact CG-CG2 4.39Å; L174-A253 HydrophobicContact CD2-CB 3.71Å |
| 175 | L | 96.5 | Very high | 95 | Very high | 73 Ų | 73 | 48 Ų | 48 | 38% | 0.382 | 29% | 0.285 | S | S | . | . | H | α-helix | trans | -59.7 | -46.1 | 177 | -178.5 | 64.7 | 0 | 0 | 0 | 111.1 | F171 I173 L177 V178 V179 V250 | F171-L175 HydrophobicContact CE1-CD2 4.25Å; F171-L175 VanDerWaalsContact O-CB 3.3Å; F171-L175 WeakPolarHBondContact O-CB 3.34Å; F171-L175 PolarHBondContact O-N 2.72Å; I173-L175 VanDerWaalsContact C-N 3.35Å; I173-L175 PolarHBondContact O-N 3.04Å; L175-L177 PolarHBondContact O-N 2.91Å; L175-V178 PolarHBondContact O-N 2.93Å; L175-V179 HydrophobicContact CD1-CG2 4.35Å; L175-V179 WeakPolarHBondContact O-CB 3.41Å; L175-V179 VanDerWaalsContact O-CG2 3.28Å; L175-V179 WeakPolarHBondContact O-CG2 3.49Å; L175-V179 PolarHBondContact O-N 3.24Å; L175-V250 HydrophobicContact CD1-CG1 4.21Å |
| 176 | L | 97.3 | Very high | 95.4 | Very high | 103 Ų | 103 | 46.9 Ų | 46.9 | 54% | 0.539 | 27% | 0.274 | S | S | . | . | H | α-helix | trans | -59.4 | -46.3 | 176.5 | 178.7 | 65.2 | 0 | 0 | 0 | 111.7 | A172 I173 L174 V178 V179 L180 | A172-L176 WeakPolarHBondContact O-CB 3.12Å; A172-L176 PolarHBondContact O-N 3.07Å; I173-L176 PolarHBondContact O-N 3.35Å; L174-L176 PolarHBondContact O-N 3.03Å; L176-V178 PolarHBondContact O-N 3.44Å; L176-V179 PolarHBondContact O-N 3.13Å; L176-L180 HydrophobicContact CD1-CD1 4.02Å; L176-L180 HydrophobicContact CD1-CG 4.24Å; L176-L180 HydrophobicContact CG-CD1 4.01Å; L176-L180 WeakPolarHBondContact O-CB 3.36Å; L176-L180 VanDerWaalsContact O-CG 3.28Å; L176-L180 WeakPolarHBondContact O-CG 3.4Å; L176-L180 PolarHBondContact O-N 3.44Å |
| 177 | L | 97.1 | Very high | 95.8 | Very high | 107 Ų | 107 | 46.8 Ų | 46.8 | 56% | 0.56 | 27% | 0.274 | S | S | * | . | H | α-helix | trans | -64.2 | -39.2 | 178.9 | -70.5 | 176.1 | 0 | 0 | 0 | 112.1 | I173 L174 L175 G181 | I173-L177 HydrophobicContact CG2-CD1 4.02Å; I173-L177 HydrophobicContact CG2-CG 4.35Å; I173-L177 WeakPolarHBondContact O-CG 3.39Å; I173-L177 PolarHBondContact O-N 2.94Å; L174-L177 PolarHBondContact O-N 2.93Å; L175-L177 PolarHBondContact O-N 2.91Å; L177-G181 PolarHBondContact O-N 3.32Å |
| 178 | V | 96.8 | Very high | 96.2 | Very high | 4 Ų | 4 | 49.3 Ų | 49.3 | 2% | 0.024 | 29% | 0.289 | C | S | . | . | H | α-helix | trans | -67.9 | -45 | 176.3 | 170.2 | 0 | 0 | 0 | 0 | 111 | L174 L175 L176 L180 G181 F182 F183 M246 M247 V250 | L174-V178 HydrophobicContact CD1-CG2 4.39Å; L174-V178 WeakPolarHBondContact O-CG2 3.39Å; L174-V178 PolarHBondContact O-N 3.34Å; L175-V178 PolarHBondContact O-N 2.93Å; L176-V178 PolarHBondContact O-N 3.44Å; V178-L180 VanDerWaalsContact C-N 3.33Å; V178-L180 PolarHBondContact O-N 3.41Å; V178-G181 PolarHBondContact O-N 2.98Å; V178-F182 HydrophobicContact CG1-CB 4.45Å; V178-F182 WeakPolarHBondContact O-CA 3.37Å; V178-F182 WeakPolarHBondContact O-CB 3.33Å; V178-F182 PolarHBondContact O-N 2.95Å; V178-F183 HydrophobicContact CG1-CE2 4.12Å; V178-M246 HydrophobicContact CG2-CB 4.34Å; V178-M246 HydrophobicContact CG2-CE 3.67Å; V178-M247 HydrophobicContact CG1-SD 4.39Å; V178-V250 HydrophobicContact CB-CG2 4.13Å; V178-V250 HydrophobicContact CG1-CG2 4.15Å; V178-V250 HydrophobicContact CG2-CG2 3.76Å |
| 179 | V | 97.4 | Very high | 96.4 | Very high | 60 Ų | 60 | 51 Ų | 51 | 36% | 0.364 | 30% | 0.296 | S | S | . | . | I | π-helix | trans | -58.3 | -46.4 | 175.2 | 169.6 | 0 | 0 | 0 | 0 | 110.7 | L175 L176 F183 V184 | L175-V179 HydrophobicContact CD1-CG2 4.35Å; L175-V179 WeakPolarHBondContact O-CB 3.41Å; L175-V179 VanDerWaalsContact O-CG2 3.28Å; L175-V179 WeakPolarHBondContact O-CG2 3.49Å; L175-V179 PolarHBondContact O-N 3.24Å; L176-V179 PolarHBondContact O-N 3.13Å; V179-F183 WeakPolarHBondContact O-CA 3.35Å; V179-F183 VanDerWaalsContact O-CB 3.3Å; V179-F183 WeakPolarHBondContact O-CB 3.39Å; V179-F183 PolarHBondContact O-N 2.88Å; V179-F183 VanDerWaalsContact O-N 3.14Å; V179-V184 HydrophobicContact CG1-CG2 4.27Å; V179-V184 PolarHBondContact O-N 3.06Å |
| 180 | L | 97.7 | Very high | 96.6 | Very high | 80 Ų | 80 | 48.5 Ų | 48.5 | 42% | 0.419 | 28% | 0.279 | S | S | . | . | I | π-helix | trans | -67.2 | -48.2 | 178.7 | -68.3 | 173.8 | 0 | 0 | 0 | 112.3 | L176 V178 V184 V185 | L176-L180 HydrophobicContact CD1-CD1 4.02Å; L176-L180 HydrophobicContact CD1-CG 4.24Å; L176-L180 HydrophobicContact CG-CD1 4.01Å; L176-L180 WeakPolarHBondContact O-CB 3.36Å; L176-L180 VanDerWaalsContact O-CG 3.28Å; L176-L180 WeakPolarHBondContact O-CG 3.4Å; L176-L180 PolarHBondContact O-N 3.44Å; V178-L180 VanDerWaalsContact C-N 3.33Å; V178-L180 PolarHBondContact O-N 3.41Å; L180-V184 HydrophobicContact CD2-CB 4.49Å; L180-V184 HydrophobicContact CD2-CG2 4.36Å; L180-V185 WeakPolarHBondContact O-CB 3.49Å; L180-V185 VanDerWaalsContact O-CG2 3.3Å; L180-V185 WeakPolarHBondContact O-CG2 3.3Å; L180-V185 PolarHBondContact O-N 3.31Å |
| 181 | G | 97.3 | Very high | 96.8 | Very high | 36 Ų | 36 | 49 Ų | 49 | 37% | 0.371 | 29% | 0.285 | S | S | . | . | I | π-helix | trans | -79.5 | -28.9 | -171.8 | 0 | 0 | 0 | 0 | 0 | 115.3 | L177 V178 P186 | L177-G181 PolarHBondContact O-N 3.32Å; V178-G181 PolarHBondContact O-N 2.98Å; G181-P186 VanDerWaalsContact O-CD 3.3Å; G181-P186 WeakPolarHBondContact O-CD 3.31Å; G181-P186 WeakPolarHBondContact O-CG 3.21Å |
| 182 | F | 97.6 | Very high | 96.8 | Very high | 46 Ų | 46 | 54.4 Ų | 54.4 | 20% | 0.202 | 31% | 0.31 | C | S | . | . | I | π-helix | trans | -116.6 | -12.7 | -174 | -71.6 | -90.8 | 0 | 0 | 0 | 114.3 | V178 L210 Y239 L242 G243 M246 | V178-F182 HydrophobicContact CG1-CB 4.45Å; V178-F182 WeakPolarHBondContact O-CA 3.37Å; V178-F182 WeakPolarHBondContact O-CB 3.33Å; V178-F182 PolarHBondContact O-N 2.95Å; F182-L210 HydrophobicContact CB-CD1 4.01Å; F182-Y239 HydrophobicContact CD1-CE2 4.23Å; F182-Y239 PolarHBondContact O-OH 3.49Å; F182-Y239 VanDerWaalsContact O-OH 3.06Å; F182-L242 HydrophobicContact CE1-CB 4.11Å; F182-G243 VanDerWaalsContact CD1-CA 3.48Å; F182-M246 HydrophobicContact CD2-CB 4.26Å; F182-M246 HydrophobicContact CD2-CG 4.09Å; F182-M246 HydrophobicContact CE1-CG 4.01Å; F182-M246 HydrophobicContact CE2-CB 4.15Å; F182-M246 HydrophobicContact CE2-CE 4.46Å; F182-M246 HydrophobicContact CE2-CG 3.48Å; F182-M246 VanDerWaalsContact CE2-CG 3.48Å; F182-M246 HydrophobicContact CZ-CB 4.29Å; F182-M246 HydrophobicContact CZ-CG 3.42Å; F182-M246 VanDerWaalsContact CZ-CG 3.42Å |
| 183 | F | 97.5 | Very high | 96.7 | Very high | 23 Ų | 23 | 55.3 Ų | 55.3 | 10% | 0.101 | 31% | 0.306 | C | S | . | . | I | π-helix | trans | -115.1 | -59.7 | 174.8 | -61.2 | -106.1 | 0 | 0 | 0 | 111.1 | V178 V179 A187 C206 F207 L210 M247 | V178-F183 HydrophobicContact CG1-CE2 4.12Å; V179-F183 WeakPolarHBondContact O-CA 3.35Å; V179-F183 VanDerWaalsContact O-CB 3.3Å; V179-F183 WeakPolarHBondContact O-CB 3.39Å; V179-F183 PolarHBondContact O-N 2.88Å; V179-F183 VanDerWaalsContact O-N 3.14Å; F183-A187 WeakPolarHBondContact O-CB 3.5Å; F183-A187 PolarHBondContact O-N 3.34Å; F183-C206 HydrophobicContact CD1-CB 4.24Å; F183-F207 HydrophobicContact CD1-CB 4.37Å; F183-F207 HydrophobicContact CE1-CB 4.13Å; F183-F207 AromaticContact CE1-CD2 3.9Å; F183-F207 HydrophobicContact CE1-CD2 3.9Å; F183-F207 HydrophobicContact CE1-CG 4.47Å; F183-L210 HydrophobicContact CE2-CD1 4.22Å; F183-L210 HydrophobicContact CZ-CB 4.45Å; F183-L210 HydrophobicContact CZ-CD1 4.17Å; F183-M247 HydrophobicContact CE2-SD 3.86Å; F183-M247 HydrophobicContact CZ-SD 3.69Å |
| 184 | V | 97.9 | Very high | 96.6 | Very high | 47 Ų | 47 | 51.3 Ų | 51.3 | 29% | 0.285 | 29% | 0.286 | S | S | . | . | I | π-helix | trans | -68.7 | -53.4 | -173 | 178.8 | 0 | 0 | 0 | 0 | 112 | V179 L180 A187 V188 F199 | V179-V184 HydrophobicContact CG1-CG2 4.27Å; V179-V184 PolarHBondContact O-N 3.06Å; L180-V184 HydrophobicContact CD2-CB 4.49Å; L180-V184 HydrophobicContact CD2-CG2 4.36Å; V184-A187 PolarHBondContact O-N 3.2Å; V184-V188 WeakPolarHBondContact O-CG2 3.47Å; V184-V188 PolarHBondContact O-N 2.81Å; V184-F199 HydrophobicContact CG1-CZ 4.42Å |
| 185 | V | 97.8 | Very high | 96.1 | Very high | 88 Ų | 88 | 57.6 Ų | 57.6 | 53% | 0.533 | 32% | 0.319 | S | S | . | . | H | α-helix | trans | -61.7 | -49.5 | -179.1 | 167.9 | 0 | 0 | 0 | 0 | 111.5 | L180 A187 V188 V189 | L180-V185 WeakPolarHBondContact O-CB 3.49Å; L180-V185 VanDerWaalsContact O-CG2 3.3Å; L180-V185 WeakPolarHBondContact O-CG2 3.3Å; L180-V185 PolarHBondContact O-N 3.31Å; V185-A187 VanDerWaalsContact C-N 3.32Å; V185-A187 PolarHBondContact O-N 2.98Å; V185-V188 PolarHBondContact O-N 2.98Å; V185-V189 WeakPolarHBondContact O-CG2 3.48Å; V185-V189 PolarHBondContact O-N 2.85Å; V185-V189 VanDerWaalsContact O-N 3.13Å |
| 186 | P | 97.6 | Very high | 95.8 | Very high | 15 Ų | 15 | 59 Ų | 59 | 10% | 0.097 | 33% | 0.331 | C | S | . | . | H | α-helix | trans | -61.9 | -36.8 | 175.3 | -26.9 | 38.6 | 0 | 0 | 0 | 112.9 | G181 V188 V189 F190 Y239 | G181-P186 VanDerWaalsContact O-CD 3.3Å; G181-P186 WeakPolarHBondContact O-CD 3.31Å; G181-P186 WeakPolarHBondContact O-CG 3.21Å; P186-V188 VanDerWaalsContact C-N 3.34Å; P186-V188 PolarHBondContact O-N 3.34Å; P186-V189 CarbonylContact O-C 3.54Å; P186-V189 WeakPolarHBondContact O-CB 3.49Å; P186-V189 PolarHBondContact O-N 3.32Å; P186-V189 VanDerWaalsContact O-N 3.13Å; P186-F190 HydrophobicContact CB-CD2 4.17Å; P186-F190 HydrophobicContact CB-CE2 4.01Å; P186-F190 WeakPolarHBondContact O-CD2 3.49Å; P186-F190 PolarHBondContact O-N 2.92Å; P186-Y239 HydrophobicContact CB-CE2 3.91Å; P186-Y239 HydrophobicContact CG-CD2 4.39Å; P186-Y239 HydrophobicContact CG-CE2 3.73Å |
| 187 | A | 97.8 | Very high | 95.7 | Very high | 0 Ų | 0 | 55.1 Ų | 55.1 | 0% | 0 | 31% | 0.309 | C | S | . | . | H | α-helix | trans | -62.9 | -39.3 | 176.7 | 0 | 0 | 0 | 0 | 0 | 112.7 | F183 V184 V185 V189 F190 S191 F199 A202 I203 | F183-A187 WeakPolarHBondContact O-CB 3.5Å; F183-A187 PolarHBondContact O-N 3.34Å; V184-A187 PolarHBondContact O-N 3.2Å; V185-A187 VanDerWaalsContact C-N 3.32Å; V185-A187 PolarHBondContact O-N 2.98Å; A187-V189 VanDerWaalsContact C-N 3.34Å; A187-F190 PolarHBondContact O-N 3.49Å; A187-S191 VanDerWaalsContact O-CB 3.32Å; A187-S191 WeakPolarHBondContact O-CB 3.37Å; A187-S191 PolarHBondContact O-N 2.87Å; A187-S191 PolarHBondContact O-OG 3.34Å; A187-F199 HydrophobicContact CB-CD2 4.15Å; A187-F199 HydrophobicContact CB-CE2 3.75Å; A187-F199 HydrophobicContact CB-CZ 4.45Å; A187-A202 HydrophobicContact CB-CB 3.93Å; A187-A202 VanDerWaalsContact O-CB 3.23Å; A187-A202 WeakPolarHBondContact O-CB 3.35Å; A187-I203 HydrophobicContact CB-CB 4.2Å; A187-I203 HydrophobicContact CB-CD1 4.47Å; A187-I203 HydrophobicContact CB-CG1 3.33Å |
| 188 | V | 97.7 | Very high | 95.7 | Very high | 62 Ų | 62 | 52.6 Ų | 52.6 | 38% | 0.376 | 30% | 0.301 | S | S | . | . | H | α-helix | trans | -59 | -48.5 | 171.4 | 173.6 | 0 | 0 | 0 | 0 | 110 | V184 V185 P186 S191 H192 F199 | V184-V188 WeakPolarHBondContact O-CG2 3.47Å; V184-V188 PolarHBondContact O-N 2.81Å; V185-V188 PolarHBondContact O-N 2.98Å; P186-V188 VanDerWaalsContact C-N 3.34Å; P186-V188 PolarHBondContact O-N 3.34Å; V188-S191 PolarHBondContact O-N 2.92Å; V188-S191 PolarHBondContact O-OG 3.31Å; V188-H192 PolarHBondContact O-CD2 3.39Å; V188-H192 PolarHBondContact O-N 2.94Å; V188-F199 HydrophobicContact CG2-CD2 4.29Å; V188-F199 HydrophobicContact CG2-CE2 3.7Å |
| 189 | V | 96.5 | Very high | 95.7 | Very high | 71 Ų | 71 | 57 Ų | 57 | 43% | 0.43 | 32% | 0.319 | S | S | . | . | H | α-helix | trans | -59.9 | -49.7 | 179.3 | 174.1 | 0 | 0 | 0 | 0 | 111.7 | V185 P186 A187 S191 H192 I193 | V185-V189 WeakPolarHBondContact O-CG2 3.48Å; V185-V189 PolarHBondContact O-N 2.85Å; V185-V189 VanDerWaalsContact O-N 3.13Å; P186-V189 CarbonylContact O-C 3.54Å; P186-V189 WeakPolarHBondContact O-CB 3.49Å; P186-V189 PolarHBondContact O-N 3.32Å; P186-V189 VanDerWaalsContact O-N 3.13Å; A187-V189 VanDerWaalsContact C-N 3.34Å; V189-S191 PolarHBondContact O-N 3.38Å; V189-H192 PolarHBondContact O-N 3.48Å; V189-H192 VanDerWaalsContact O-N 3.17Å; V189-I193 HydrophobicContact CG1-CD1 3.59Å; V189-I193 HydrophobicContact CG1-CG1 4.37Å; V189-I193 WeakPolarHBondContact O-CG1 3.35Å; V189-I193 PolarHBondContact O-N 3.03Å |
| 190 | F | 96.2 | Very high | 95.7 | Very high | 10 Ų | 10 | 60.2 Ų | 60.2 | 4% | 0.044 | 33% | 0.334 | C | S | . | . | H | α-helix | trans | -62.7 | -41.5 | 179.2 | -75.5 | -60.1 | 0 | 0 | 0 | 112 | P186 A187 H192 I193 E194 W197 A202 F205 P220 Y232 V236 Y239 | P186-F190 HydrophobicContact CB-CD2 4.17Å; P186-F190 HydrophobicContact CB-CE2 4.01Å; P186-F190 WeakPolarHBondContact O-CD2 3.49Å; P186-F190 PolarHBondContact O-N 2.92Å; A187-F190 PolarHBondContact O-N 3.49Å; F190-H192 PolarHBondContact O-N 2.96Å; F190-I193 PolarHBondContact O-N 2.92Å; F190-E194 WeakPolarHBondContact O-CA 3.39Å; F190-E194 VanDerWaalsContact O-CB 3.31Å; F190-E194 WeakPolarHBondContact O-CB 3.48Å; F190-E194 PolarHBondContact O-N 2.92Å; F190-W197 HydrophobicContact CB-CE3 4.07Å; F190-W197 HydrophobicContact CB-CZ3 4.12Å; F190-W197 HydrophobicContact CD1-CZ3 4.36Å; F190-W197 HydrophobicContact CG-CZ3 4.28Å; F190-A202 HydrophobicContact CB-CB 3.95Å; F190-F205 HydrophobicContact CD1-CE1 4.46Å; F190-F205 AromaticContact CD2-CD1 3.98Å; F190-F205 HydrophobicContact CD2-CD1 3.98Å; F190-F205 AromaticContact CD2-CE1 3.96Å; F190-F205 HydrophobicContact CD2-CE1 3.96Å; F190-F205 HydrophobicContact CE1-CE1 4.11Å; F190-F205 HydrophobicContact CE2-CD1 4.07Å; F190-F205 AromaticContact CE2-CE1 3.58Å; F190-F205 HydrophobicContact CE2-CE1 3.58Å; F190-F205 HydrophobicContact CG-CD1 4.38Å; F190-F205 HydrophobicContact CG-CE1 4.41Å; F190-F205 HydrophobicContact CZ-CD1 4.5Å; F190-F205 AromaticContact CZ-CE1 3.67Å; F190-F205 HydrophobicContact CZ-CE1 3.67Å; F190-F205 HydrophobicContact CZ-CZ 4.5Å; F190-P220 HydrophobicContact CD1-CB 4.25Å; F190-P220 HydrophobicContact CE1-CB 3.88Å; F190-P220 HydrophobicContact CE1-CG 4.22Å; F190-Y232 VanDerWaalsContact CD1-OH 3.3Å; F190-Y232 WeakPolarHBondContact CD1-OH 3.39Å; F190-Y232 HydrophobicContact CE1-CE2 4.13Å; F190-Y232 WeakPolarHBondContact CE1-OH 3.4Å; F190-V236 HydrophobicContact CE1-CG2 3.92Å; F190-V236 HydrophobicContact CZ-CG2 4.18Å; F190-Y239 HydrophobicContact CE2-CD1 4.12Å; F190-Y239 AromaticContact CE2-CE1 3.73Å; F190-Y239 HydrophobicContact CE2-CE1 3.73Å; F190-Y239 AromaticContact CZ-CD1 3.99Å; F190-Y239 HydrophobicContact CZ-CD1 3.99Å; F190-Y239 HydrophobicContact CZ-CE1 4.02Å |
| 191 | S | 96.1 | Very high | 95.7 | Very high | 26 Ų | 26 | 58 Ų | 58 | 18% | 0.182 | 32% | 0.323 | C | S | . | . | H | α-helix | trans | -64.2 | -23.1 | 177.1 | 70.4 | 0 | 0 | 0 | 0 | 113.8 | A187 V188 V189 | A187-S191 VanDerWaalsContact O-CB 3.32Å; A187-S191 WeakPolarHBondContact O-CB 3.37Å; A187-S191 PolarHBondContact O-N 2.87Å; A187-S191 PolarHBondContact O-OG 3.34Å; V188-S191 PolarHBondContact O-N 2.92Å; V188-S191 PolarHBondContact O-OG 3.31Å; V189-S191 PolarHBondContact O-N 3.38Å |
| 192 | H | 93.9 | Very high | 95.7 | Very high | 143 Ų | 143 | 56.3 Ų | 56.3 | 66% | 0.662 | 31% | 0.305 | S | S | * | . | H | α-helix | trans | -88.5 | -31.3 | 174.8 | -78.4 | -58 | 0 | 0 | 0 | 113.8 | V188 V189 F190 | V188-H192 PolarHBondContact O-CD2 3.39Å; V188-H192 PolarHBondContact O-N 2.94Å; V189-H192 PolarHBondContact O-N 3.48Å; V189-H192 VanDerWaalsContact O-N 3.17Å; F190-H192 PolarHBondContact O-N 2.96Å |
| 193 | I | 92.9 | Very high | 95.7 | Very high | 74 Ų | 74 | 56.7 Ų | 56.7 | 38% | 0.379 | 31% | 0.309 | S | S | . | . | H | α-helix | trans | -83.2 | -39.3 | 179.3 | -65 | 174.9 | 0 | 0 | 0 | 110.6 | V189 F190 D195 Y232 | V189-I193 HydrophobicContact CG1-CD1 3.59Å; V189-I193 HydrophobicContact CG1-CG1 4.37Å; V189-I193 WeakPolarHBondContact O-CG1 3.35Å; V189-I193 PolarHBondContact O-N 3.03Å; F190-I193 PolarHBondContact O-N 2.92Å; I193-D195 PolarHBondContact O-N 3.29Å; I193-Y232 HydrophobicContact CD1-CE2 4.07Å; I193-Y232 HydrophobicContact CG2-CE1 4.05Å; I193-Y232 HydrophobicContact CG2-CE2 4.09Å |
| 194 | E | 93.2 | Very high | 95.7 | Very high | 2 Ų | 2 | 59.5 Ų | 59.5 | 1% | 0.009 | 32% | 0.319 | C | S | . | . | S | Bend | trans | -97.5 | 85.6 | -179.7 | -60.8 | -65 | 168.5 | 0 | 0 | 109.8 | F190 T196 W197 P220 G221 K223 Q226 Y232 | F190-E194 WeakPolarHBondContact O-CA 3.39Å; F190-E194 VanDerWaalsContact O-CB 3.31Å; F190-E194 WeakPolarHBondContact O-CB 3.48Å; F190-E194 PolarHBondContact O-N 2.92Å; E194-T196 PolarHBondContact O-N 3.31Å; E194-W197 HydrophobicContact CB-CB 4Å; E194-W197 HydrophobicContact CB-CD2 3.55Å; E194-W197 HydrophobicContact CB-CE3 4.09Å; E194-W197 HydrophobicContact CB-CG 3.51Å; E194-W197 HydrophobicContact CG-CD2 3.83Å; E194-W197 HydrophobicContact CG-CE3 4.07Å; E194-W197 HydrophobicContact CG-CG 4.32Å; E194-W197 HydrophobicContact CG-CH2 4.41Å; E194-W197 HydrophobicContact CG-CZ2 4.17Å; E194-W197 HydrophobicContact CG-CZ3 4.35Å; E194-W197 WeakPolarHBondContact O-CB 3.49Å; E194-W197 PolarHBondContact O-N 3.33Å; E194-P220 WeakPolarHBondContact OE1-CA 3.33Å; E194-G221 PolarHBondContact OE1-N 2.65Å; E194-K223 WeakPolarHBondContact OE2-CE 3.27Å; E194-K223 IonicContact OE2-NZ 2.61Å; E194-Q226 PolarHBondContact OE1-NE2 2.67Å; E194-Q226 PolarHBondContact OE2-NE2 3.24Å; E194-Y232 VanDerWaalsContact OE1-CE1 3.29Å; E194-Y232 WeakPolarHBondContact OE1-CE1 3.38Å; E194-Y232 PolarHBondContact OE1-OH 3.45Å |
| 195 | D | 86.6 | Confident | 95.7 | Very high | 140 Ų | 140 | 57.2 Ų | 57.2 | 75% | 0.749 | 31% | 0.305 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -50.5 | -14.7 | -177.4 | -53.4 | -53.6 | 0 | 0 | 0 | 117 | I193 | I193-D195 PolarHBondContact O-N 3.29Š|
| 196 | T | 89.5 | Confident | 95.7 | Very high | 101 Ų | 101 | 53 Ų | 53 | 62% | 0.62 | 28% | 0.28 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -99.9 | -7.6 | -177.7 | 49.4 | 0 | 0 | 0 | 0 | 111.8 | E194 K223 | E194-T196 PolarHBondContact O-N 3.31Å; T196-K223 WeakPolarHBondContact OG1-CE 3.24Å; T196-K223 PolarHBondContact OG1-NZ 3.43Å |
| 197 | W | 95 | Very high | 95.7 | Very high | 23 Ų | 23 | 57.3 Ų | 57.3 | 9% | 0.087 | 30% | 0.297 | C | S | . | . | trans | -96.6 | 127.7 | -177.5 | -64.7 | 12.4 | 0 | 0 | 0 | 108.4 | F190 E194 D201 A202 F205 Y218 P220 | F190-W197 HydrophobicContact CB-CE3 4.07Å; F190-W197 HydrophobicContact CB-CZ3 4.12Å; F190-W197 HydrophobicContact CD1-CZ3 4.36Å; F190-W197 HydrophobicContact CG-CZ3 4.28Å; E194-W197 HydrophobicContact CB-CB 4Å; E194-W197 HydrophobicContact CB-CD2 3.55Å; E194-W197 HydrophobicContact CB-CE3 4.09Å; E194-W197 HydrophobicContact CB-CG 3.51Å; E194-W197 HydrophobicContact CG-CD2 3.83Å; E194-W197 HydrophobicContact CG-CE3 4.07Å; E194-W197 HydrophobicContact CG-CG 4.32Å; E194-W197 HydrophobicContact CG-CH2 4.41Å; E194-W197 HydrophobicContact CG-CZ2 4.17Å; E194-W197 HydrophobicContact CG-CZ3 4.35Å; E194-W197 WeakPolarHBondContact O-CB 3.49Å; E194-W197 PolarHBondContact O-N 3.33Å; W197-D201 HydrophobicContact CB-CB 4.17Å; W197-A202 HydrophobicContact CE3-CB 4.29Å; W197-F205 HydrophobicContact CE3-CB 4.48Å; W197-F205 HydrophobicContact CH2-CB 4.18Å; W197-F205 HydrophobicContact CH2-CD1 4.08Å; W197-F205 AromaticContact CH2-CD2 3.84Å; W197-F205 HydrophobicContact CH2-CD2 3.84Å; W197-F205 HydrophobicContact CH2-CE2 4.3Å; W197-F205 AromaticContact CH2-CG 3.73Å; W197-F205 HydrophobicContact CH2-CG 3.73Å; W197-F205 HydrophobicContact CZ3-CB 3.75Å; W197-F205 AromaticContact CZ3-CD1 3.64Å; W197-F205 HydrophobicContact CZ3-CD1 3.64Å; W197-F205 HydrophobicContact CZ3-CD2 4.16Å; W197-F205 HydrophobicContact CZ3-CE1 4.33Å; W197-F205 AromaticContact CZ3-CG 3.54Å; W197-F205 HydrophobicContact CZ3-CG 3.54Å; W197-Y218 AromaticContact CD1-CD1 3.81Å; W197-Y218 AromaticContact CD1-CE1 3.92Å; W197-Y218 AromaticContact CD2-CD1 3.95Å; W197-Y218 HydrophobicContact CD2-CD1 3.95Å; W197-Y218 AromaticContact CE2-CD1 3.54Å; W197-Y218 HydrophobicContact CG-CD1 4.15Å; W197-Y218 HydrophobicContact CG-CE1 4.33Å; W197-Y218 AromaticContact CZ2-CD1 3.93Å; W197-Y218 HydrophobicContact CZ2-CD1 3.93Å; W197-Y218 HydrophobicContact CZ2-CG 4.33Å; W197-Y218 AromaticContact NE1-CD1 3.49Å; W197-P220 HydrophobicContact CH2-CB 4.23Å | ||
| 198 | S | 96.9 | Very high | 95.6 | Very high | 54 Ų | 54 | 57.5 Ų | 57.5 | 38% | 0.378 | 30% | 0.298 | S | S | . | . | trans | -71.2 | 166.3 | 162.9 | 73.1 | 0 | 0 | 0 | 0 | 110.3 | L200 D201 A202 | S198-L200 PolarHBondContact O-N 3.12Å; S198-L200 PolarHBondContact OG-N 2.84Å; S198-D201 VanDerWaalsContact CB-OD2 3.27Å; S198-D201 WeakPolarHBondContact CB-OD2 3.4Å; S198-D201 PolarHBondContact N-OD2 3.46Å; S198-D201 PolarHBondContact O-N 3.09Å; S198-D201 PolarHBondContact OG-N 3.3Å; S198-D201 PolarHBondContact OG-OD2 3.42Å; S198-A202 PolarHBondContact O-N 3.16Å | ||
| 199 | F | 97.1 | Very high | 95.6 | Very high | 95 Ų | 95 | 54.7 Ų | 54.7 | 42% | 0.417 | 28% | 0.281 | S | S | . | . | H | α-helix | trans | -58.3 | -34.3 | 172.1 | 178.8 | -107 | 0 | 0 | 0 | 112.5 | V184 A187 V188 A202 I203 | V184-F199 HydrophobicContact CG1-CZ 4.42Å; A187-F199 HydrophobicContact CB-CD2 4.15Å; A187-F199 HydrophobicContact CB-CE2 3.75Å; A187-F199 HydrophobicContact CB-CZ 4.45Å; V188-F199 HydrophobicContact CG2-CD2 4.29Å; V188-F199 HydrophobicContact CG2-CE2 3.7Å; F199-A202 PolarHBondContact O-N 3.03Å; F199-I203 HydrophobicContact CD1-CD1 4.14Å; F199-I203 HydrophobicContact CE1-CD1 3.31Å; F199-I203 HydrophobicContact CE1-CG1 4.02Å; F199-I203 HydrophobicContact CE2-CD1 4.21Å; F199-I203 HydrophobicContact CE2-CG1 4.21Å; F199-I203 HydrophobicContact CZ-CD1 3.37Å; F199-I203 HydrophobicContact CZ-CG1 3.86Å; F199-I203 PolarHBondContact O-N 2.87Å |
| 200 | L | 97.2 | Very high | 95.6 | Very high | 128 Ų | 128 | 51.5 Ų | 51.5 | 67% | 0.67 | 26% | 0.262 | S | S | * | . | H | α-helix | trans | -65.6 | -45.2 | 176.1 | -179.2 | 65.5 | 0 | 0 | 0 | 111 | S198 A202 I203 Y204 | S198-L200 PolarHBondContact O-N 3.12Å; S198-L200 PolarHBondContact OG-N 2.84Å; L200-A202 VanDerWaalsContact C-N 3.27Å; L200-A202 PolarHBondContact O-N 2.83Å; L200-I203 PolarHBondContact O-N 3.32Å; L200-Y204 WeakPolarHBondContact O-CB 3.31Å; L200-Y204 PolarHBondContact O-N 2.95Å |
| 201 | D | 97.3 | Very high | 95.6 | Very high | 35 Ų | 35 | 53.1 Ų | 53.1 | 19% | 0.187 | 27% | 0.274 | C | S | . | . | H | α-helix | trans | -61 | -39.6 | 176.9 | -58.1 | -45.8 | 0 | 0 | 0 | 111.1 | W197 S198 Y204 F205 Y218 | W197-D201 HydrophobicContact CB-CB 4.17Å; S198-D201 VanDerWaalsContact CB-OD2 3.27Å; S198-D201 WeakPolarHBondContact CB-OD2 3.4Å; S198-D201 PolarHBondContact N-OD2 3.46Å; S198-D201 PolarHBondContact O-N 3.09Å; S198-D201 PolarHBondContact OG-N 3.3Å; S198-D201 PolarHBondContact OG-OD2 3.42Å; D201-Y204 PolarHBondContact O-N 3.46Å; D201-F205 VanDerWaalsContact O-CB 3.31Å; D201-F205 WeakPolarHBondContact O-CB 3.36Å; D201-F205 PolarHBondContact O-N 3.13Å; D201-Y218 HydrophobicContact CB-CD1 4.35Å; D201-Y218 HydrophobicContact CB-CE1 3.76Å; D201-Y218 HydrophobicContact CB-CE2 4.18Å; D201-Y218 PolarHBondContact OD1-OH 2.87Å |
| 202 | A | 97.8 | Very high | 95.6 | Very high | 0 Ų | 0 | 54.2 Ų | 54.2 | 0% | 0 | 28% | 0.28 | C | S | . | . | H | α-helix | trans | -67.9 | -42.7 | 177.5 | 0 | 0 | 0 | 0 | 0 | 112.8 | A187 F190 W197 S198 F199 L200 F205 C206 | A187-A202 HydrophobicContact CB-CB 3.93Å; A187-A202 VanDerWaalsContact O-CB 3.23Å; A187-A202 WeakPolarHBondContact O-CB 3.35Å; F190-A202 HydrophobicContact CB-CB 3.95Å; W197-A202 HydrophobicContact CE3-CB 4.29Å; S198-A202 PolarHBondContact O-N 3.16Å; F199-A202 PolarHBondContact O-N 3.03Å; L200-A202 VanDerWaalsContact C-N 3.27Å; L200-A202 PolarHBondContact O-N 2.83Å; A202-F205 PolarHBondContact O-N 3.32Å; A202-C206 PolarHBondContact O-N 3.36Å; A202-C206 PolarHBondContact O-SG 3.34Å; A202-C206 VanDerWaalsContact O-SG 3.35Å |
| 203 | I | 97.9 | Very high | 95.7 | Very high | 54 Ų | 54 | 51.6 Ų | 51.6 | 28% | 0.277 | 27% | 0.27 | S | S | . | . | H | α-helix | trans | -62.5 | -45.4 | 172.2 | -80.7 | -169.3 | 0 | 0 | 0 | 110.5 | A187 F199 L200 F205 C206 F207 | A187-I203 HydrophobicContact CB-CB 4.2Å; A187-I203 HydrophobicContact CB-CD1 4.47Å; A187-I203 HydrophobicContact CB-CG1 3.33Å; F199-I203 HydrophobicContact CD1-CD1 4.14Å; F199-I203 HydrophobicContact CE1-CD1 3.31Å; F199-I203 HydrophobicContact CE1-CG1 4.02Å; F199-I203 HydrophobicContact CE2-CD1 4.21Å; F199-I203 HydrophobicContact CE2-CG1 4.21Å; F199-I203 HydrophobicContact CZ-CD1 3.37Å; F199-I203 HydrophobicContact CZ-CG1 3.86Å; F199-I203 PolarHBondContact O-N 2.87Å; L200-I203 PolarHBondContact O-N 3.32Å; I203-F205 VanDerWaalsContact C-N 3.34Å; I203-F205 PolarHBondContact O-N 2.97Å; I203-C206 WeakPolarHBondContact O-CB 3.48Å; I203-C206 PolarHBondContact O-N 3.08Å; I203-F207 PolarHBondContact O-N 2.82Å |
| 204 | Y | 97.9 | Very high | 95.8 | Very high | 81 Ų | 81 | 48.4 Ų | 48.4 | 32% | 0.318 | 25% | 0.254 | S | S | . | . | H | α-helix | trans | -59.8 | -46.1 | 179 | 167.7 | -101.3 | 0 | 0 | 0 | 110.7 | L200 D201 C206 F207 I208 L215 D217 Y218 | L200-Y204 WeakPolarHBondContact O-CB 3.31Å; L200-Y204 PolarHBondContact O-N 2.95Å; D201-Y204 PolarHBondContact O-N 3.46Å; Y204-C206 PolarHBondContact O-N 3.35Å; Y204-F207 PolarHBondContact O-N 3.11Å; Y204-F207 VanDerWaalsContact O-N 3.15Å; Y204-I208 HydrophobicContact CD1-CD1 4.23Å; Y204-I208 HydrophobicContact CD2-CG2 3.92Å; Y204-I208 HydrophobicContact CE1-CD1 3.73Å; Y204-I208 HydrophobicContact CE1-CG2 4.37Å; Y204-I208 HydrophobicContact CE2-CG2 3.56Å; Y204-I208 HydrophobicContact CG-CG2 4.48Å; Y204-I208 WeakPolarHBondContact O-CG1 3.4Å; Y204-I208 PolarHBondContact O-N 3.32Å; Y204-L215 WeakPolarHBondContact OH-CD1 3.49Å; Y204-D217 WeakPolarHBondContact CE1-OD2 3.36Å; Y204-D217 PolarHBondContact OH-OD2 3.47Å; Y204-Y218 AromaticContact CD1-CD2 3.72Å; Y204-Y218 HydrophobicContact CD1-CD2 3.72Å; Y204-Y218 AromaticContact CD1-CE2 3.94Å; Y204-Y218 HydrophobicContact CD1-CE2 3.94Å; Y204-Y218 AromaticContact CE1-CD2 3.72Å; Y204-Y218 HydrophobicContact CE1-CD2 3.72Å; Y204-Y218 AromaticContact CE1-CE2 3.98Å; Y204-Y218 HydrophobicContact CE1-CE2 3.98Å |
| 205 | F | 97.5 | Very high | 95.8 | Very high | 0 Ų | 0 | 53 Ų | 53 | 0% | 0 | 28% | 0.279 | C | S | . | . | H | α-helix | trans | -54.2 | -51.9 | 172 | 164.7 | -102.2 | 0 | 0 | 0 | 111.7 | Y107 F190 W197 D201 A202 I203 F207 I208 T209 Y218 P220 Y239 | Y107-F205 HydrophobicContact CE1-CE2 4.15Å; Y107-F205 AromaticContact CZ-CE2 4Å; Y107-F205 WeakPolarHBondContact OH-CE2 3.39Å; F190-F205 HydrophobicContact CD1-CE1 4.46Å; F190-F205 AromaticContact CD2-CD1 3.98Å; F190-F205 HydrophobicContact CD2-CD1 3.98Å; F190-F205 AromaticContact CD2-CE1 3.96Å; F190-F205 HydrophobicContact CD2-CE1 3.96Å; F190-F205 HydrophobicContact CE1-CE1 4.11Å; F190-F205 HydrophobicContact CE2-CD1 4.07Å; F190-F205 AromaticContact CE2-CE1 3.58Å; F190-F205 HydrophobicContact CE2-CE1 3.58Å; F190-F205 HydrophobicContact CG-CD1 4.38Å; F190-F205 HydrophobicContact CG-CE1 4.41Å; F190-F205 HydrophobicContact CZ-CD1 4.5Å; F190-F205 AromaticContact CZ-CE1 3.67Å; F190-F205 HydrophobicContact CZ-CE1 3.67Å; F190-F205 HydrophobicContact CZ-CZ 4.5Å; W197-F205 HydrophobicContact CE3-CB 4.48Å; W197-F205 HydrophobicContact CH2-CB 4.18Å; W197-F205 HydrophobicContact CH2-CD1 4.08Å; W197-F205 AromaticContact CH2-CD2 3.84Å; W197-F205 HydrophobicContact CH2-CD2 3.84Å; W197-F205 HydrophobicContact CH2-CE2 4.3Å; W197-F205 AromaticContact CH2-CG 3.73Å; W197-F205 HydrophobicContact CH2-CG 3.73Å; W197-F205 HydrophobicContact CZ3-CB 3.75Å; W197-F205 AromaticContact CZ3-CD1 3.64Å; W197-F205 HydrophobicContact CZ3-CD1 3.64Å; W197-F205 HydrophobicContact CZ3-CD2 4.16Å; W197-F205 HydrophobicContact CZ3-CE1 4.33Å; W197-F205 AromaticContact CZ3-CG 3.54Å; W197-F205 HydrophobicContact CZ3-CG 3.54Å; D201-F205 VanDerWaalsContact O-CB 3.31Å; D201-F205 WeakPolarHBondContact O-CB 3.36Å; D201-F205 PolarHBondContact O-N 3.13Å; A202-F205 PolarHBondContact O-N 3.32Å; I203-F205 VanDerWaalsContact C-N 3.34Å; I203-F205 PolarHBondContact O-N 2.97Å; F205-F207 VanDerWaalsContact C-N 3.26Å; F205-F207 PolarHBondContact O-N 3.16Å; F205-I208 WeakPolarHBondContact O-CG1 3.4Å; F205-T209 WeakPolarHBondContact CD2-OG1 3.33Å; F205-T209 VanDerWaalsContact CE2-OG1 3.22Å; F205-T209 WeakPolarHBondContact CE2-OG1 3.15Å; F205-T209 HydrophobicContact CZ-CG2 4.43Å; F205-T209 WeakPolarHBondContact O-CB 3.47Å; F205-T209 PolarHBondContact O-N 3.32Å; F205-T209 PolarHBondContact O-OG1 2.76Å; F205-Y218 WeakPolarHBondContact CD2-O 3.27Å; F205-P220 HydrophobicContact CE1-CG 4.37Å; F205-P220 VanDerWaalsContact CE2-CD 3.48Å; F205-P220 HydrophobicContact CE2-CG 4.24Å; F205-P220 HydrophobicContact CZ-CG 3.73Å; F205-Y239 HydrophobicContact CE1-CE1 4.4Å |
| 206 | C | 97.8 | Very high | 96.1 | Very high | 0 Ų | 0 | 47.2 Ų | 47.2 | 0% | 0 | 25% | 0.252 | C | S | . | . | H | α-helix | trans | -56 | -43.4 | 177.8 | -72.3 | 0 | 0 | 0 | 0 | 111.3 | F183 A202 I203 Y204 L210 Y239 | F183-C206 HydrophobicContact CD1-CB 4.24Å; A202-C206 PolarHBondContact O-N 3.36Å; A202-C206 PolarHBondContact O-SG 3.34Å; A202-C206 VanDerWaalsContact O-SG 3.35Å; I203-C206 WeakPolarHBondContact O-CB 3.48Å; I203-C206 PolarHBondContact O-N 3.08Å; Y204-C206 PolarHBondContact O-N 3.35Å; C206-L210 WeakPolarHBondContact O-CB 3.46Å; C206-L210 VanDerWaalsContact O-CG 3.29Å; C206-L210 WeakPolarHBondContact O-CG 3.38Å; C206-L210 PolarHBondContact O-N 2.92Å; C206-Y239 PolarHBondContact SG-OH 3.39Å |
| 207 | F | 97.1 | Very high | 96.2 | Very high | 104 Ų | 104 | 46.4 Ų | 46.4 | 46% | 0.456 | 24% | 0.244 | S | C | . | . | H | α-helix | trans | -66.3 | -56.8 | -179.4 | -176.8 | -91.5 | 0 | 0 | 0 | 113.4 | F183 I203 Y204 F205 T209 L210 C211 I213 | F183-F207 HydrophobicContact CD1-CB 4.37Å; F183-F207 HydrophobicContact CE1-CB 4.13Å; F183-F207 AromaticContact CE1-CD2 3.9Å; F183-F207 HydrophobicContact CE1-CD2 3.9Å; F183-F207 HydrophobicContact CE1-CG 4.47Å; I203-F207 PolarHBondContact O-N 2.82Å; Y204-F207 PolarHBondContact O-N 3.11Å; Y204-F207 VanDerWaalsContact O-N 3.15Å; F205-F207 VanDerWaalsContact C-N 3.26Å; F205-F207 PolarHBondContact O-N 3.16Å; F207-T209 PolarHBondContact O-N 3.44Å; F207-T209 VanDerWaalsContact O-N 3.12Å; F207-L210 PolarHBondContact O-N 3.47Å; F207-C211 VanDerWaalsContact O-CB 3.29Å; F207-C211 WeakPolarHBondContact O-CB 3.18Å; F207-C211 PolarHBondContact O-N 3.35Å; F207-I213 HydrophobicContact CE1-CD1 4.26Å |
| 208 | I | 96.6 | Very high | 96.1 | Very high | 5 Ų | 5 | 48 Ų | 48 | 3% | 0.026 | 25% | 0.25 | C | S | . | . | H | α-helix | trans | -61.5 | -27.5 | -178.5 | 66.7 | 176.3 | 0 | 0 | 0 | 111.7 | Y204 F205 I213 G214 L215 D217 | Y204-I208 HydrophobicContact CD1-CD1 4.23Å; Y204-I208 HydrophobicContact CD2-CG2 3.92Å; Y204-I208 HydrophobicContact CE1-CD1 3.73Å; Y204-I208 HydrophobicContact CE1-CG2 4.37Å; Y204-I208 HydrophobicContact CE2-CG2 3.56Å; Y204-I208 HydrophobicContact CG-CG2 4.48Å; Y204-I208 WeakPolarHBondContact O-CG1 3.4Å; Y204-I208 PolarHBondContact O-N 3.32Å; F205-I208 WeakPolarHBondContact O-CG1 3.4Å; I208-I213 HydrophobicContact CB-CB 4.26Å; I208-I213 WeakPolarHBondContact O-CA 3.4Å; I208-I213 WeakPolarHBondContact O-CB 3.42Å; I208-I213 PolarHBondContact O-N 3.1Å; I208-G214 PolarHBondContact O-N 3.23Å; I208-L215 HydrophobicContact CD1-CB 4.18Å; I208-L215 HydrophobicContact CG2-CD1 4.28Å; I208-D217 WeakPolarHBondContact CD1-OD1 3.31Å |
| 209 | T | 96.9 | Very high | 95.9 | Very high | 2 Ų | 2 | 46 Ų | 46 | 1% | 0.012 | 24% | 0.236 | C | C | . | . | H | α-helix | trans | -79.6 | -52.3 | -179.2 | -64.1 | 0 | 0 | 0 | 0 | 112.3 | V105 Y107 F205 F207 C211 T212 L240 | V105-T209 HydrophobicContact CG1-CG2 4.43Å; Y107-T209 HydrophobicContact CE1-CG2 4.48Å; Y107-T209 WeakPolarHBondContact CE1-OG1 3.42Å; Y107-T209 WeakPolarHBondContact OH-CG2 2.98Å; Y107-T209 PolarHBondContact OH-OG1 3.45Å; F205-T209 WeakPolarHBondContact CD2-OG1 3.33Å; F205-T209 VanDerWaalsContact CE2-OG1 3.22Å; F205-T209 WeakPolarHBondContact CE2-OG1 3.15Å; F205-T209 HydrophobicContact CZ-CG2 4.43Å; F205-T209 WeakPolarHBondContact O-CB 3.47Å; F205-T209 PolarHBondContact O-N 3.32Å; F205-T209 PolarHBondContact O-OG1 2.76Å; F207-T209 PolarHBondContact O-N 3.44Å; F207-T209 VanDerWaalsContact O-N 3.12Å; T209-C211 VanDerWaalsContact C-N 3.28Å; T209-C211 PolarHBondContact O-N 3.25Å; T209-T212 WeakPolarHBondContact O-CA 3.38Å; T209-T212 PolarHBondContact O-N 2.87Å; T209-L240 HydrophobicContact CG2-CD1 4.12Å; T209-L240 HydrophobicContact CG2-CD2 3.27Å; T209-L240 HydrophobicContact CG2-CG 4.25Å |
| 210 | L | 96.6 | Very high | 95.7 | Very high | 5 Ų | 5 | 41.6 Ų | 41.6 | 3% | 0.026 | 22% | 0.216 | C | C | . | . | H | α-helix | trans | -72.5 | -23.9 | -176.5 | -65.6 | -174.5 | 0 | 0 | 0 | 112.5 | F182 F183 C206 F207 T212 Y239 M247 | F182-L210 HydrophobicContact CB-CD1 4.01Å; F183-L210 HydrophobicContact CE2-CD1 4.22Å; F183-L210 HydrophobicContact CZ-CB 4.45Å; F183-L210 HydrophobicContact CZ-CD1 4.17Å; C206-L210 WeakPolarHBondContact O-CB 3.46Å; C206-L210 VanDerWaalsContact O-CG 3.29Å; C206-L210 WeakPolarHBondContact O-CG 3.38Å; C206-L210 PolarHBondContact O-N 2.92Å; F207-L210 PolarHBondContact O-N 3.47Å; L210-T212 PolarHBondContact O-N 3.01Å; L210-Y239 HydrophobicContact CD1-CE2 4.42Å; L210-M247 HydrophobicContact CB-CG 3.98Å |
| 211 | C | 95.3 | Very high | 95.2 | Very high | 44 Ų | 44 | 35.5 Ų | 35.5 | 30% | 0.297 | 18% | 0.184 | S | C | . | . | T | Hydrogen-bonded Turn | trans | -82.7 | 8.6 | 168 | -66.2 | 0 | 0 | 0 | 0 | 113.4 | F207 T209 I213 | F207-C211 VanDerWaalsContact O-CB 3.29Å; F207-C211 WeakPolarHBondContact O-CB 3.18Å; F207-C211 PolarHBondContact O-N 3.35Å; T209-C211 VanDerWaalsContact C-N 3.28Å; T209-C211 PolarHBondContact O-N 3.25Å; C211-I213 HydrophobicContact CB-CD1 4.18Å; C211-I213 HydrophobicContact CB-CG1 4.02Å; C211-I213 PolarHBondContact O-N 3.42Å; C211-I213 VanDerWaalsContact O-N 3.1Å |
| 212 | T | 95.7 | Very high | 94.6 | Very high | 49 Ų | 49 | 36.6 Ų | 36.6 | 30% | 0.301 | 19% | 0.188 | S | C | . | . | T | Hydrogen-bonded Turn | trans | 52.3 | 32.4 | 179.2 | 64.2 | 0 | 0 | 0 | 0 | 113.8 | V105 T209 L210 L244 | V105-T212 HydrophobicContact CG2-CG2 4.03Å; T209-T212 WeakPolarHBondContact O-CA 3.38Å; T209-T212 PolarHBondContact O-N 2.87Å; L210-T212 PolarHBondContact O-N 3.01Å; T212-L244 HydrophobicContact CG2-CD1 3.51Å |
| 213 | I | 96.6 | Very high | 93.7 | Very high | 88 Ų | 88 | 38.7 Ų | 38.7 | 45% | 0.451 | 20% | 0.197 | S | C | . | . | trans | -79.9 | -47.6 | 173.7 | -55 | 177 | 0 | 0 | 0 | 109.2 | F207 I208 C211 L215 | F207-I213 HydrophobicContact CE1-CD1 4.26Å; I208-I213 HydrophobicContact CB-CB 4.26Å; I208-I213 WeakPolarHBondContact O-CA 3.4Å; I208-I213 WeakPolarHBondContact O-CB 3.42Å; I208-I213 PolarHBondContact O-N 3.1Å; C211-I213 HydrophobicContact CB-CD1 4.18Å; C211-I213 HydrophobicContact CB-CG1 4.02Å; C211-I213 PolarHBondContact O-N 3.42Å; C211-I213 VanDerWaalsContact O-N 3.1Å; I213-L215 HydrophobicContact CG2-CD2 4.02Å; I213-L215 HydrophobicContact CG2-CG 3.94Å | ||
| 214 | G | 95.1 | Very high | 92.5 | Very high | 6 Ų | 6 | 39.7 Ų | 39.7 | 6% | 0.062 | 21% | 0.208 | C | C | . | . | trans | 55.8 | 54.8 | 170.2 | 0 | 0 | 0 | 0 | 0 | 115.6 | V105 Y107 I208 G216 | V105-G214 WeakPolarHBondContact O-CA 3.29Å; Y107-G214 WeakPolarHBondContact CA-O 3.46Å; I208-G214 PolarHBondContact O-N 3.23Å; G214-G216 PolarHBondContact O-N 2.82Å | ||
| 215 | L | 94 | Very high | 91.4 | Very high | 100 Ų | 100 | 39.2 Ų | 39.2 | 52% | 0.524 | 23% | 0.227 | S | C | . | . | trans | -62.5 | -30.2 | -180 | -63 | 171.5 | 0 | 0 | 0 | 113.5 | Y204 I208 I213 D217 | Y204-L215 WeakPolarHBondContact OH-CD1 3.49Å; I208-L215 HydrophobicContact CD1-CB 4.18Å; I208-L215 HydrophobicContact CG2-CD1 4.28Å; I213-L215 HydrophobicContact CG2-CD2 4.02Å; I213-L215 HydrophobicContact CG2-CG 3.94Å; L215-D217 VanDerWaalsContact C-N 3.28Å; L215-D217 PolarHBondContact O-N 3.24Å | ||
| 216 | G | 91.8 | Very high | 90.6 | Very high | 17 Ų | 17 | 41.2 Ų | 41.2 | 18% | 0.175 | 24% | 0.237 | C | C | . | . | trans | 76.9 | 9.4 | 172.9 | 0 | 0 | 0 | 0 | 0 | 115.8 | Y107 G214 Y218 | Y107-G216 WeakPolarHBondContact O-CA 3.38Å; G214-G216 PolarHBondContact O-N 2.82Å; G216-Y218 VanDerWaalsContact C-N 3.29Å | ||
| 217 | D | 91.1 | Very high | 89.8 | Confident | 85 Ų | 85 | 50.2 Ų | 50.2 | 46% | 0.455 | 28% | 0.276 | S | S | . | . | S | Bend | trans | -63.2 | -35.8 | 165 | 50.1 | -5.1 | 0 | 0 | 0 | 111.9 | Y204 I208 L215 | Y204-D217 WeakPolarHBondContact CE1-OD2 3.36Å; Y204-D217 PolarHBondContact OH-OD2 3.47Å; I208-D217 WeakPolarHBondContact CD1-OD1 3.31Å; L215-D217 VanDerWaalsContact C-N 3.28Å; L215-D217 PolarHBondContact O-N 3.24Å |
| 218 | Y | 93.8 | Very high | 89.2 | Confident | 57 Ų | 57 | 53.4 Ų | 53.4 | 22% | 0.224 | 29% | 0.29 | C | S | . | . | S | Bend | trans | -117.2 | 119.1 | 171.5 | -67.4 | -77.5 | 0 | 0 | 0 | 111 | W197 D201 Y204 F205 G216 | W197-Y218 AromaticContact CD1-CD1 3.81Å; W197-Y218 AromaticContact CD1-CE1 3.92Å; W197-Y218 AromaticContact CD2-CD1 3.95Å; W197-Y218 HydrophobicContact CD2-CD1 3.95Å; W197-Y218 AromaticContact CE2-CD1 3.54Å; W197-Y218 HydrophobicContact CG-CD1 4.15Å; W197-Y218 HydrophobicContact CG-CE1 4.33Å; W197-Y218 AromaticContact CZ2-CD1 3.93Å; W197-Y218 HydrophobicContact CZ2-CD1 3.93Å; W197-Y218 HydrophobicContact CZ2-CG 4.33Å; W197-Y218 AromaticContact NE1-CD1 3.49Å; D201-Y218 HydrophobicContact CB-CD1 4.35Å; D201-Y218 HydrophobicContact CB-CE1 3.76Å; D201-Y218 HydrophobicContact CB-CE2 4.18Å; D201-Y218 PolarHBondContact OD1-OH 2.87Å; Y204-Y218 AromaticContact CD1-CD2 3.72Å; Y204-Y218 HydrophobicContact CD1-CD2 3.72Å; Y204-Y218 AromaticContact CD1-CE2 3.94Å; Y204-Y218 HydrophobicContact CD1-CE2 3.94Å; Y204-Y218 AromaticContact CE1-CD2 3.72Å; Y204-Y218 HydrophobicContact CE1-CD2 3.72Å; Y204-Y218 AromaticContact CE1-CE2 3.98Å; Y204-Y218 HydrophobicContact CE1-CE2 3.98Å; F205-Y218 WeakPolarHBondContact CD2-O 3.27Å; G216-Y218 VanDerWaalsContact C-N 3.29Å |
| 219 | V | 92.4 | Very high | 88.8 | Confident | 12 Ų | 12 | 54.3 Ų | 54.3 | 7% | 0.073 | 29% | 0.293 | C | S | . | . | trans | -135.4 | 122.8 | 174.6 | -175.8 | 0 | 0 | 0 | 0 | 108.8 | F96 Y107 H109 E222 | F96-V219 HydrophobicContact CE1-CG1 3.98Å; F96-V219 HydrophobicContact CZ-CG1 4.33Å; Y107-V219 HydrophobicContact CD1-CG2 4.19Å; Y107-V219 HydrophobicContact CD2-CG2 4.41Å; Y107-V219 HydrophobicContact CG-CG2 3.97Å; H109-V219 HydrophobicContact CB-CG2 4.16Å; V219-E222 HydrophobicContact CB-CG 3.92Å; V219-E222 HydrophobicContact CG1-CG 3.88Å | ||
| 220 | P | 92.4 | Very high | 88.4 | Confident | 1 Ų | 1 | 57 Ų | 57 | 1% | 0.006 | 31% | 0.312 | C | S | . | . | T | Hydrogen-bonded Turn | trans | -71.1 | 146 | -179.1 | 29 | -34.3 | 0 | 0 | 0 | 110.3 | F190 E194 W197 F205 Y232 V236 | F190-P220 HydrophobicContact CD1-CB 4.25Å; F190-P220 HydrophobicContact CE1-CB 3.88Å; F190-P220 HydrophobicContact CE1-CG 4.22Å; E194-P220 WeakPolarHBondContact OE1-CA 3.33Å; W197-P220 HydrophobicContact CH2-CB 4.23Å; F205-P220 HydrophobicContact CE1-CG 4.37Å; F205-P220 VanDerWaalsContact CE2-CD 3.48Å; F205-P220 HydrophobicContact CE2-CG 4.24Å; F205-P220 HydrophobicContact CZ-CG 3.73Å; P220-Y232 HydrophobicContact CB-CE1 3.92Å; P220-Y232 WeakPolarHBondContact CB-OH 3.32Å; P220-V236 HydrophobicContact CB-CG2 4.08Å; P220-V236 HydrophobicContact CG-CB 4.26Å; P220-V236 HydrophobicContact CG-CG1 3.57Å; P220-V236 HydrophobicContact CG-CG2 3.83Å |
| 221 | G | 87.8 | Confident | 88.2 | Confident | 0 Ų | 0 | 62.2 Ų | 62.2 | 0% | 0 | 34% | 0.339 | C | S | . | . | T | Hydrogen-bonded Turn | trans | 83.4 | 21.3 | 173.3 | 0 | 0 | 0 | 0 | 0 | 114 | E194 Q226 R229 | E194-G221 PolarHBondContact OE1-N 2.65Å; G221-Q226 VanDerWaalsContact CA-OE1 3.25Å; G221-R229 PolarHBondContact O-NE 3.23Å; G221-R229 PolarHBondContact O-NH2 3.43Å |
| 222 | E | 84.1 | Confident | 88.1 | Confident | 58 Ų | 58 | 61.5 Ų | 61.5 | 27% | 0.271 | 33% | 0.33 | S | S | . | . | trans | -100.9 | -9.8 | -179.6 | -68 | -50.6 | 115.4 | 0 | 0 | 114.4 | H109 V219 R229 K233 | H109-E222 IonicContact CD2-OE2 3.01Å; H109-E222 IonicContact NE2-OE1 3.96Å; V219-E222 HydrophobicContact CB-CG 3.92Å; V219-E222 HydrophobicContact CG1-CG 3.88Å; E222-R229 VanDerWaalsContact CD-NH2 3.35Å; E222-R229 IonicContact OE1-NH2 3.55Å; E222-R229 PolarHBondContact OE1-NH2 3.4Å; E222-R229 IonicContact OE2-NH2 3.26Å; E222-R229 PolarHBondContact OE2-NH2 3.18Å; E222-R229 VanDerWaalsContact OE2-NH2 3.11Å; E222-K233 WeakPolarHBondContact OE1-CE 3.36Å; E222-K233 IonicContact OE1-NZ 3.49Å; E222-K233 PolarHBondContact OE1-NZ 2.9Å | ||
| 223 | K | 78.9 | Confident | 87.9 | Confident | 44 Ų | 44 | 59.3 Ų | 59.3 | 19% | 0.191 | 32% | 0.317 | C | S | . | . | S | Bend | trans | -70.9 | 137.1 | -180 | -62.6 | -176.8 | -176.6 | -178.7 | 0 | 112 | E194 T196 Q226 | E194-K223 WeakPolarHBondContact OE2-CE 3.27Å; E194-K223 IonicContact OE2-NZ 2.61Å; T196-K223 WeakPolarHBondContact OG1-CE 3.24Å; T196-K223 PolarHBondContact OG1-NZ 3.43Å; K223-Q226 HydrophobicContact CB-CG 3.93Å |
| 224 | P | 73.5 | Confident | 87.7 | Confident | 76 Ų | 76 | 58.7 Ų | 58.7 | 49% | 0.494 | 31% | 0.313 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -59.2 | 138.7 | 170.4 | -20.9 | 31.8 | 0 | 0 | 0 | 111.4 | Q226 | P224-Q226 PolarHBondContact O-N 3.25Š|
| 225 | G | 73.9 | Confident | 87.7 | Confident | 71 Ų | 71 | 61.3 Ų | 61.3 | 73% | 0.732 | 33% | 0.331 | S | S | * | . | T | Hydrogen-bonded Turn | trans | 78.2 | 9 | 172 | 0 | 0 | 0 | 0 | 0 | 116.3 | K227 | G225-K227 PolarHBondContact O-N 2.94Š|
| 226 | Q | 81.2 | Confident | 87.7 | Confident | 42 Ų | 42 | 56.7 Ų | 56.7 | 20% | 0.196 | 31% | 0.307 | C | S | . | . | trans | -63.3 | 127.7 | 171.7 | -81.4 | -179.1 | -5.8 | 0 | 0 | 111.7 | E194 G221 K223 P224 | E194-Q226 PolarHBondContact OE1-NE2 2.67Å; E194-Q226 PolarHBondContact OE2-NE2 3.24Å; G221-Q226 VanDerWaalsContact CA-OE1 3.25Å; K223-Q226 HydrophobicContact CB-CG 3.93Å; P224-Q226 PolarHBondContact O-N 3.25Å | ||
| 227 | K | 81.8 | Confident | 87.9 | Confident | 188 Ų | 188 | 58.1 Ų | 58.1 | 82% | 0.817 | 31% | 0.309 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -68.5 | 141.3 | 175.3 | -64.6 | -178 | -178.3 | 176.8 | 0 | 110 | G225 R229 | G225-K227 PolarHBondContact O-N 2.94Å; K227-R229 PolarHBondContact O-N 3.01Å |
| 228 | F | 84.5 | Confident | 88.1 | Confident | 172 Ų | 172 | 57.4 Ų | 57.4 | 75% | 0.754 | 31% | 0.308 | S | S | * | . | T | Hydrogen-bonded Turn | trans | 56.6 | 29.5 | 178.3 | -53.7 | -73.9 | 0 | 0 | 0 | 115.3 | S230 L231 Y232 | F228-S230 VanDerWaalsContact C-N 3.28Å; F228-S230 PolarHBondContact O-N 3.36Å; F228-S230 VanDerWaalsContact O-N 3.14Å; F228-L231 PolarHBondContact O-N 3.23Å; F228-Y232 PolarHBondContact O-N 3.42Å |
| 229 | R | 87.4 | Confident | 88.3 | Confident | 23 Ų | 23 | 56.1 Ų | 56.1 | 9% | 0.087 | 30% | 0.303 | C | S | . | . | H | α-helix | trans | -45.4 | -47 | -179.4 | -174.5 | -175.8 | 179.6 | -176.8 | 1.5 | 113.6 | S86 G221 E222 K227 L231 Y232 K233 | S86-R229 PolarHBondContact O-NH1 3.49Å; S86-R229 PolarHBondContact OG-NH1 3.32Å; G221-R229 PolarHBondContact O-NE 3.23Å; G221-R229 PolarHBondContact O-NH2 3.43Å; E222-R229 VanDerWaalsContact CD-NH2 3.35Å; E222-R229 IonicContact OE1-NH2 3.55Å; E222-R229 PolarHBondContact OE1-NH2 3.4Å; E222-R229 IonicContact OE2-NH2 3.26Å; E222-R229 PolarHBondContact OE2-NH2 3.18Å; E222-R229 VanDerWaalsContact OE2-NH2 3.11Å; K227-R229 PolarHBondContact O-N 3.01Å; R229-L231 PolarHBondContact O-N 3.49Å; R229-Y232 PolarHBondContact O-N 3.16Å; R229-K233 PolarHBondContact O-N 3.3Å |
| 230 | S | 88.9 | Confident | 88.4 | Confident | 59 Ų | 59 | 55.8 Ų | 55.8 | 41% | 0.413 | 30% | 0.301 | S | S | . | . | H | α-helix | trans | -63.4 | -42.1 | -177.7 | -52.4 | 0 | 0 | 0 | 0 | 112.9 | F228 K233 I234 | F228-S230 VanDerWaalsContact C-N 3.28Å; F228-S230 PolarHBondContact O-N 3.36Å; F228-S230 VanDerWaalsContact O-N 3.14Å; S230-K233 PolarHBondContact O-N 2.92Å; S230-I234 WeakPolarHBondContact O-CG1 3.3Å; S230-I234 PolarHBondContact O-N 2.94Å; S230-I234 VanDerWaalsContact O-N 3.17Å |
| 231 | L | 91.4 | Very high | 88.6 | Confident | 114 Ų | 114 | 58.6 Ų | 58.6 | 60% | 0.597 | 31% | 0.313 | S | S | * | . | H | α-helix | trans | -67.8 | -41.7 | 177.3 | -175.9 | 141.1 | 0 | 0 | 0 | 110.5 | F228 R229 K233 I234 S235 | F228-L231 PolarHBondContact O-N 3.23Å; R229-L231 PolarHBondContact O-N 3.49Å; L231-K233 PolarHBondContact O-N 3.33Å; L231-I234 PolarHBondContact O-N 3.34Å; L231-S235 PolarHBondContact O-N 3.36Å; L231-S235 PolarHBondContact O-OG 3.26Å; L231-S235 VanDerWaalsContact O-OG 3.12Å |
| 232 | Y | 92.8 | Very high | 89 | Confident | 29 Ų | 29 | 62 Ų | 62 | 11% | 0.114 | 33% | 0.331 | C | S | . | . | H | α-helix | trans | -59.6 | -46.5 | 175.7 | 175.7 | -133.9 | 0 | 0 | 0 | 112.2 | F190 I193 E194 P220 F228 R229 I234 S235 V236 | F190-Y232 VanDerWaalsContact CD1-OH 3.3Å; F190-Y232 WeakPolarHBondContact CD1-OH 3.39Å; F190-Y232 HydrophobicContact CE1-CE2 4.13Å; F190-Y232 WeakPolarHBondContact CE1-OH 3.4Å; I193-Y232 HydrophobicContact CD1-CE2 4.07Å; I193-Y232 HydrophobicContact CG2-CE1 4.05Å; I193-Y232 HydrophobicContact CG2-CE2 4.09Å; E194-Y232 VanDerWaalsContact OE1-CE1 3.29Å; E194-Y232 WeakPolarHBondContact OE1-CE1 3.38Å; E194-Y232 PolarHBondContact OE1-OH 3.45Å; P220-Y232 HydrophobicContact CB-CE1 3.92Å; P220-Y232 WeakPolarHBondContact CB-OH 3.32Å; F228-Y232 PolarHBondContact O-N 3.42Å; R229-Y232 PolarHBondContact O-N 3.16Å; Y232-I234 VanDerWaalsContact C-N 3.32Å; Y232-I234 PolarHBondContact O-N 3.17Å; Y232-S235 WeakPolarHBondContact O-CB 3.41Å; Y232-S235 PolarHBondContact O-N 3.34Å; Y232-S235 VanDerWaalsContact O-N 3.12Å; Y232-V236 HydrophobicContact CD2-CG2 3.94Å; Y232-V236 HydrophobicContact CE2-CG2 3.63Å; Y232-V236 WeakPolarHBondContact O-CG2 3.33Å; Y232-V236 PolarHBondContact O-N 3.04Å |
| 233 | K | 91.6 | Very high | 89.5 | Confident | 3 Ų | 3 | 59.2 Ų | 59.2 | 1% | 0.013 | 32% | 0.318 | C | S | . | . | H | α-helix | trans | -58.9 | -40.6 | 175.2 | -77.2 | -139 | 176 | 177.4 | 0 | 113.1 | A92 S93 F96 E222 R229 S230 L231 V236 M237 | A92-K233 HydrophobicContact CB-CB 4.45Å; S93-K233 PolarHBondContact OG-NZ 3.14Å; F96-K233 HydrophobicContact CB-CD 4.16Å; F96-K233 HydrophobicContact CG-CD 4.25Å; E222-K233 WeakPolarHBondContact OE1-CE 3.36Å; E222-K233 IonicContact OE1-NZ 3.49Å; E222-K233 PolarHBondContact OE1-NZ 2.9Å; R229-K233 PolarHBondContact O-N 3.3Å; S230-K233 PolarHBondContact O-N 2.92Å; L231-K233 PolarHBondContact O-N 3.33Å; K233-V236 PolarHBondContact O-N 3.01Å; K233-M237 WeakPolarHBondContact O-CB 3.39Å; K233-M237 PolarHBondContact O-N 3.19Å |
| 234 | I | 92.9 | Very high | 90.3 | Very high | 75 Ų | 75 | 58 Ų | 58 | 39% | 0.385 | 31% | 0.314 | S | S | . | . | H | α-helix | trans | -65.4 | -43 | 175.1 | -66.5 | 167 | 0 | 0 | 0 | 110.5 | S230 L231 Y232 V236 M237 V238 | S230-I234 WeakPolarHBondContact O-CG1 3.3Å; S230-I234 PolarHBondContact O-N 2.94Å; S230-I234 VanDerWaalsContact O-N 3.17Å; L231-I234 PolarHBondContact O-N 3.34Å; Y232-I234 VanDerWaalsContact C-N 3.32Å; Y232-I234 PolarHBondContact O-N 3.17Å; I234-V236 PolarHBondContact O-N 3.02Å; I234-M237 WeakPolarHBondContact O-CB 3.2Å; I234-M237 PolarHBondContact O-N 3.43Å; I234-V238 WeakPolarHBondContact O-CG2 3.49Å; I234-V238 PolarHBondContact O-N 2.84Å |
| 235 | S | 94.9 | Very high | 91.3 | Very high | 62 Ų | 62 | 55.8 Ų | 55.8 | 43% | 0.434 | 30% | 0.297 | S | S | . | . | H | α-helix | trans | -61.2 | -42.7 | 175.6 | -62.1 | 0 | 0 | 0 | 0 | 112.2 | L231 Y232 V238 Y239 | L231-S235 PolarHBondContact O-N 3.36Å; L231-S235 PolarHBondContact O-OG 3.26Å; L231-S235 VanDerWaalsContact O-OG 3.12Å; Y232-S235 WeakPolarHBondContact O-CB 3.41Å; Y232-S235 PolarHBondContact O-N 3.34Å; Y232-S235 VanDerWaalsContact O-N 3.12Å; S235-V238 PolarHBondContact O-N 3.44Å; S235-Y239 PolarHBondContact O-N 3.29Å |
| 236 | V | 95.3 | Very high | 92.4 | Very high | 3 Ų | 3 | 53.7 Ų | 53.7 | 2% | 0.018 | 27% | 0.268 | C | S | . | . | H | α-helix | trans | -62.3 | -45.2 | 174.4 | 177.4 | 0 | 0 | 0 | 0 | 110.1 | F96 F190 P220 Y232 K233 I234 V238 Y239 L240 | F96-V236 HydrophobicContact CE2-CB 4.26Å; F96-V236 HydrophobicContact CE2-CG1 3.74Å; F96-V236 HydrophobicContact CZ-CG1 4.38Å; F190-V236 HydrophobicContact CE1-CG2 3.92Å; F190-V236 HydrophobicContact CZ-CG2 4.18Å; P220-V236 HydrophobicContact CB-CG2 4.08Å; P220-V236 HydrophobicContact CG-CB 4.26Å; P220-V236 HydrophobicContact CG-CG1 3.57Å; P220-V236 HydrophobicContact CG-CG2 3.83Å; Y232-V236 HydrophobicContact CD2-CG2 3.94Å; Y232-V236 HydrophobicContact CE2-CG2 3.63Å; Y232-V236 WeakPolarHBondContact O-CG2 3.33Å; Y232-V236 PolarHBondContact O-N 3.04Å; K233-V236 PolarHBondContact O-N 3.01Å; I234-V236 PolarHBondContact O-N 3.02Å; V236-V238 VanDerWaalsContact C-N 3.3Å; V236-V238 PolarHBondContact O-N 2.8Å; V236-Y239 CarbonylContact O-C 3.5Å; V236-Y239 WeakPolarHBondContact O-CA 3.32Å; V236-Y239 WeakPolarHBondContact O-CB 3.48Å; V236-Y239 PolarHBondContact O-N 3.25Å; V236-L240 HydrophobicContact CG1-CD2 4.1Å; V236-L240 HydrophobicContact CG1-CG 4.15Å; V236-L240 VanDerWaalsContact O-CG 3.28Å; V236-L240 WeakPolarHBondContact O-CG 3.36Å; V236-L240 PolarHBondContact O-N 3.48Å |
| 237 | M | 94.4 | Very high | 93 | Very high | 46 Ų | 46 | 54 Ų | 54 | 23% | 0.227 | 27% | 0.27 | C | S | . | . | H | α-helix | trans | -54.4 | -45.9 | 177 | -175.9 | -167.8 | 75.4 | 0 | 0 | 112 | F96 N99 K233 I234 L240 F241 | F96-M237 HydrophobicContact CD2-CB 4.42Å; N99-M237 HydrophobicContact CB-CG 3.68Å; N99-M237 HydrophobicContact CB-SD 4.02Å; N99-M237 VanDerWaalsContact CG-CG 3.46Å; K233-M237 WeakPolarHBondContact O-CB 3.39Å; K233-M237 PolarHBondContact O-N 3.19Å; I234-M237 WeakPolarHBondContact O-CB 3.2Å; I234-M237 PolarHBondContact O-N 3.43Å; M237-L240 PolarHBondContact O-N 2.86Å; M237-F241 PolarHBondContact O-N 3.35Å; M237-F241 VanDerWaalsContact O-N 3.11Å |
| 238 | V | 95.9 | Very high | 93.7 | Very high | 71 Ų | 71 | 47.4 Ų | 47.4 | 43% | 0.43 | 24% | 0.241 | S | C | . | . | H | α-helix | trans | -62.5 | -44.2 | 175.3 | 173.3 | 0 | 0 | 0 | 0 | 111 | I234 S235 V236 L240 F241 L242 | I234-V238 WeakPolarHBondContact O-CG2 3.49Å; I234-V238 PolarHBondContact O-N 2.84Å; S235-V238 PolarHBondContact O-N 3.44Å; V236-V238 VanDerWaalsContact C-N 3.3Å; V236-V238 PolarHBondContact O-N 2.8Å; V238-L240 VanDerWaalsContact C-N 3.34Å; V238-L240 PolarHBondContact O-N 3.14Å; V238-F241 PolarHBondContact O-N 2.84Å; V238-L242 HydrophobicContact CG1-CD1 3.82Å; V238-L242 HydrophobicContact CG1-CG 4.31Å; V238-L242 WeakPolarHBondContact O-CB 3.28Å; V238-L242 WeakPolarHBondContact O-CG 3.3Å; V238-L242 PolarHBondContact O-N 3.33Å |
| 239 | Y | 97.3 | Very high | 94.1 | Very high | 29 Ų | 29 | 39.2 Ų | 39.2 | 11% | 0.114 | 21% | 0.205 | C | C | . | . | H | α-helix | trans | -58.4 | -43.5 | 174.7 | 158.3 | -108.5 | 0 | 0 | 0 | 112.1 | F182 P186 F190 F205 C206 L210 S235 V236 F241 L242 G243 | F182-Y239 HydrophobicContact CD1-CE2 4.23Å; F182-Y239 PolarHBondContact O-OH 3.49Å; F182-Y239 VanDerWaalsContact O-OH 3.06Å; P186-Y239 HydrophobicContact CB-CE2 3.91Å; P186-Y239 HydrophobicContact CG-CD2 4.39Å; P186-Y239 HydrophobicContact CG-CE2 3.73Å; F190-Y239 HydrophobicContact CE2-CD1 4.12Å; F190-Y239 AromaticContact CE2-CE1 3.73Å; F190-Y239 HydrophobicContact CE2-CE1 3.73Å; F190-Y239 AromaticContact CZ-CD1 3.99Å; F190-Y239 HydrophobicContact CZ-CD1 3.99Å; F190-Y239 HydrophobicContact CZ-CE1 4.02Å; F205-Y239 HydrophobicContact CE1-CE1 4.4Å; C206-Y239 PolarHBondContact SG-OH 3.39Å; L210-Y239 HydrophobicContact CD1-CE2 4.42Å; S235-Y239 PolarHBondContact O-N 3.29Å; V236-Y239 CarbonylContact O-C 3.5Å; V236-Y239 WeakPolarHBondContact O-CA 3.32Å; V236-Y239 WeakPolarHBondContact O-CB 3.48Å; V236-Y239 PolarHBondContact O-N 3.25Å; Y239-F241 PolarHBondContact O-N 2.96Å; Y239-L242 PolarHBondContact O-N 3.49Å; Y239-G243 PolarHBondContact O-N 3.29Å |
| 240 | L | 96.1 | Very high | 94.5 | Very high | 5 Ų | 5 | 38.8 Ų | 38.8 | 3% | 0.026 | 21% | 0.205 | C | C | . | . | H | α-helix | trans | -61.3 | -45.7 | 178.7 | -59.1 | -161.5 | 0 | 0 | 0 | 111.4 | F96 T100 Y107 T209 V236 M237 V238 G243 L244 | F96-L240 HydrophobicContact CE2-CD1 4.1Å; F96-L240 HydrophobicContact CZ-CD1 4.37Å; T100-L240 HydrophobicContact CG2-CD1 4.17Å; Y107-L240 HydrophobicContact CE2-CD1 4.27Å; T209-L240 HydrophobicContact CG2-CD1 4.12Å; T209-L240 HydrophobicContact CG2-CD2 3.27Å; T209-L240 HydrophobicContact CG2-CG 4.25Å; V236-L240 HydrophobicContact CG1-CD2 4.1Å; V236-L240 HydrophobicContact CG1-CG 4.15Å; V236-L240 VanDerWaalsContact O-CG 3.28Å; V236-L240 WeakPolarHBondContact O-CG 3.36Å; V236-L240 PolarHBondContact O-N 3.48Å; M237-L240 PolarHBondContact O-N 2.86Å; V238-L240 VanDerWaalsContact C-N 3.34Å; V238-L240 PolarHBondContact O-N 3.14Å; L240-G243 PolarHBondContact O-N 2.93Å; L240-L244 VanDerWaalsContact O-CB 3.31Å; L240-L244 WeakPolarHBondContact O-CB 3.48Å; L240-L244 PolarHBondContact O-N 2.95Å |
| 241 | F | 94.8 | Very high | 94.7 | Very high | 60 Ų | 60 | 40.4 Ų | 40.4 | 26% | 0.263 | 21% | 0.209 | S | C | . | . | H | α-helix | trans | -64.8 | -46.4 | 180 | -173.6 | -94.8 | 0 | 0 | 0 | 111.9 | V135 M237 V238 Y239 L244 M245 | V135-F241 HydrophobicContact CG1-CZ 4.01Å; M237-F241 PolarHBondContact O-N 3.35Å; M237-F241 VanDerWaalsContact O-N 3.11Å; V238-F241 PolarHBondContact O-N 2.84Å; Y239-F241 PolarHBondContact O-N 2.96Å; F241-L244 PolarHBondContact O-N 3.34Å; F241-M245 PolarHBondContact O-N 2.72Å |
| 242 | L | 96.2 | Very high | 94.7 | Very high | 72 Ų | 72 | 37.7 Ų | 37.7 | 38% | 0.377 | 19% | 0.19 | S | C | . | . | H | α-helix | trans | -65.7 | -40.6 | 177.3 | -69.2 | 175.5 | 0 | 0 | 0 | 112.3 | F182 V238 Y239 M245 M246 | F182-L242 HydrophobicContact CE1-CB 4.11Å; V238-L242 HydrophobicContact CG1-CD1 3.82Å; V238-L242 HydrophobicContact CG1-CG 4.31Å; V238-L242 WeakPolarHBondContact O-CB 3.28Å; V238-L242 WeakPolarHBondContact O-CG 3.3Å; V238-L242 PolarHBondContact O-N 3.33Å; Y239-L242 PolarHBondContact O-N 3.49Å; L242-M245 HydrophobicContact CD2-CE 3.9Å; L242-M245 WeakPolarHBondContact O-CB 3.36Å; L242-M245 PolarHBondContact O-N 3.04Å; L242-M246 WeakPolarHBondContact O-CG 3.4Å; L242-M246 PolarHBondContact O-N 2.97Å |
| 243 | G | 96.2 | Very high | 94.6 | Very high | 0 Ų | 0 | 36.5 Ų | 36.5 | 0% | 0 | 19% | 0.186 | C | C | . | . | H | α-helix | trans | -66.3 | -40.7 | 177.7 | 0 | 0 | 0 | 0 | 0 | 112 | F182 Y239 L240 M245 M246 M247 | F182-G243 VanDerWaalsContact CD1-CA 3.48Å; Y239-G243 PolarHBondContact O-N 3.29Å; L240-G243 PolarHBondContact O-N 2.93Å; G243-M245 VanDerWaalsContact C-N 3.31Å; G243-M245 PolarHBondContact O-N 2.75Å; G243-M246 PolarHBondContact O-N 3.49Å; G243-M247 WeakPolarHBondContact O-CG 3.5Å; G243-M247 PolarHBondContact O-N 3.35Å |
| 244 | L | 95.3 | Very high | 94.6 | Very high | 19 Ų | 19 | 41 Ų | 41 | 10% | 0.099 | 21% | 0.206 | C | C | . | . | H | α-helix | trans | -61.6 | -40.5 | 173.4 | -173.1 | 63.6 | 0 | 0 | 0 | 111.5 | T103 L136 T212 L240 F241 M246 M247 Y248 | T103-L244 HydrophobicContact CG2-CD2 4.2Å; L136-L244 HydrophobicContact CD1-CG 4.42Å; L136-L244 HydrophobicContact CD2-CD2 4.16Å; L136-L244 HydrophobicContact CD2-CG 4.01Å; T212-L244 HydrophobicContact CG2-CD1 3.51Å; L240-L244 VanDerWaalsContact O-CB 3.31Å; L240-L244 WeakPolarHBondContact O-CB 3.48Å; L240-L244 PolarHBondContact O-N 2.95Å; F241-L244 PolarHBondContact O-N 3.34Å; L244-M246 PolarHBondContact O-N 3.5Å; L244-M247 PolarHBondContact O-N 2.8Å; L244-Y248 WeakPolarHBondContact O-CB 3.36Å; L244-Y248 PolarHBondContact O-N 3.48Å |
| 245 | M | 95.3 | Very high | 94.4 | Very high | 28 Ų | 28 | 41.5 Ų | 41.5 | 14% | 0.138 | 21% | 0.207 | C | C | . | . | H | α-helix | trans | -59.7 | -43.7 | 173.5 | -173.9 | -174.6 | 67.4 | 0 | 0 | 111.9 | L136 C139 V140 L143 F241 L242 G243 Y248 L249 | L136-M245 VanDerWaalsContact CD1-CA 3.47Å; L136-M245 HydrophobicContact CD1-CB 3.82Å; L136-M245 HydrophobicContact CD1-CG 4.31Å; C139-M245 HydrophobicContact CB-SD 3.96Å; V140-M245 HydrophobicContact CG2-CB 4.49Å; V140-M245 HydrophobicContact CG2-CG 3.55Å; V140-M245 VanDerWaalsContact CG2-O 3.3Å; V140-M245 WeakPolarHBondContact CG2-O 3.24Å; L143-M245 HydrophobicContact CD2-CE 3.84Å; L143-M245 HydrophobicContact CD2-SD 4.33Å; F241-M245 PolarHBondContact O-N 2.72Å; L242-M245 HydrophobicContact CD2-CE 3.9Å; L242-M245 WeakPolarHBondContact O-CB 3.36Å; L242-M245 PolarHBondContact O-N 3.04Å; G243-M245 VanDerWaalsContact C-N 3.31Å; G243-M245 PolarHBondContact O-N 2.75Å; M245-Y248 PolarHBondContact O-N 2.84Å; M245-L249 PolarHBondContact O-N 3.25Å |
| 246 | M | 95.5 | Very high | 94 | Very high | 27 Ų | 27 | 41.6 Ų | 41.6 | 13% | 0.133 | 20% | 0.197 | C | C | . | . | H | α-helix | trans | -70.4 | -35.9 | 177.5 | -67.3 | -56.6 | -63.1 | 0 | 0 | 113 | L143 V178 F182 L242 G243 L244 Y248 L249 V250 | L143-M246 HydrophobicContact CD2-SD 3.99Å; V178-M246 HydrophobicContact CG2-CB 4.34Å; V178-M246 HydrophobicContact CG2-CE 3.67Å; F182-M246 HydrophobicContact CD2-CB 4.26Å; F182-M246 HydrophobicContact CD2-CG 4.09Å; F182-M246 HydrophobicContact CE1-CG 4.01Å; F182-M246 HydrophobicContact CE2-CB 4.15Å; F182-M246 HydrophobicContact CE2-CE 4.46Å; F182-M246 HydrophobicContact CE2-CG 3.48Å; F182-M246 VanDerWaalsContact CE2-CG 3.48Å; F182-M246 HydrophobicContact CZ-CB 4.29Å; F182-M246 HydrophobicContact CZ-CG 3.42Å; F182-M246 VanDerWaalsContact CZ-CG 3.42Å; L242-M246 WeakPolarHBondContact O-CG 3.4Å; L242-M246 PolarHBondContact O-N 2.97Å; G243-M246 PolarHBondContact O-N 3.49Å; L244-M246 PolarHBondContact O-N 3.5Å; M246-Y248 VanDerWaalsContact C-N 3.35Å; M246-L249 HydrophobicContact CE-CD2 3.84Å; M246-L249 WeakPolarHBondContact O-CB 3.46Å; M246-L249 PolarHBondContact O-N 2.96Å; M246-L249 HydrophobicContact SD-CD2 4.11Å; M246-V250 WeakPolarHBondContact O-CG2 3.17Å; M246-V250 PolarHBondContact O-N 3.48Å |
| 247 | M | 95.4 | Very high | 93.7 | Very high | 49 Ų | 49 | 42.8 Ų | 42.8 | 24% | 0.241 | 20% | 0.203 | C | C | . | . | H | α-helix | trans | -63 | -41.8 | 172.4 | -72.1 | -52.5 | -59.2 | 0 | 0 | 111.6 | V178 F183 L210 G243 L244 L249 V250 L251 | V178-M247 HydrophobicContact CG1-SD 4.39Å; F183-M247 HydrophobicContact CE2-SD 3.86Å; F183-M247 HydrophobicContact CZ-SD 3.69Å; L210-M247 HydrophobicContact CB-CG 3.98Å; G243-M247 WeakPolarHBondContact O-CG 3.5Å; G243-M247 PolarHBondContact O-N 3.35Å; L244-M247 PolarHBondContact O-N 2.8Å; M247-L249 VanDerWaalsContact C-N 3.35Å; M247-V250 PolarHBondContact O-N 3.5Å; M247-L251 PolarHBondContact O-N 3.03Å |
| 248 | Y | 94.7 | Very high | 93.4 | Very high | 49 Ų | 49 | 40.9 Ų | 40.9 | 19% | 0.192 | 20% | 0.195 | C | C | . | . | H | α-helix | trans | -65.7 | -37.4 | 175.4 | -173.6 | -122.5 | 0 | 0 | 0 | 112.1 | L136 V140 L244 M245 M246 L251 R252 | L136-Y248 HydrophobicContact CD2-CD1 4.38Å; L136-Y248 HydrophobicContact CD2-CG 4.2Å; L136-Y248 HydrophobicContact CG-CD1 4.06Å; L136-Y248 HydrophobicContact CG-CG 4.33Å; V140-Y248 HydrophobicContact CB-CD1 3.58Å; V140-Y248 HydrophobicContact CB-CE1 3.95Å; V140-Y248 HydrophobicContact CG1-CD1 3.75Å; V140-Y248 HydrophobicContact CG1-CE1 4.02Å; V140-Y248 HydrophobicContact CG2-CD1 3.51Å; V140-Y248 HydrophobicContact CG2-CE1 4.37Å; V140-Y248 HydrophobicContact CG2-CG 4.32Å; L244-Y248 WeakPolarHBondContact O-CB 3.36Å; L244-Y248 PolarHBondContact O-N 3.48Å; M245-Y248 PolarHBondContact O-N 2.84Å; M246-Y248 VanDerWaalsContact C-N 3.35Å; Y248-L251 HydrophobicContact CD2-CD2 4.41Å; Y248-L251 PolarHBondContact O-N 3.34Å; Y248-R252 HydrophobicContact CE1-CG 4.23Å; Y248-R252 HydrophobicContact CE2-CG 4.37Å; Y248-R252 PolarHBondContact O-N 2.82Å; Y248-R252 PolarHBondContact OH-NE 3.46Å; Y248-R252 PolarHBondContact OH-NH2 3.38Å |
| 249 | L | 94.8 | Very high | 92.9 | Very high | 0 Ų | 0 | 39.9 Ų | 39.9 | 0% | 0 | 19% | 0.187 | C | C | . | . | H | α-helix | trans | -62.2 | -44.8 | 172.3 | 179.8 | 68.5 | 0 | 0 | 0 | 112.2 | V140 L143 M144 V147 L174 M245 M246 M247 L251 R252 A253 | V140-L249 HydrophobicContact CG1-CB 4.16Å; V140-L249 HydrophobicContact CG1-CD1 4.01Å; V140-L249 HydrophobicContact CG2-CB 4.46Å; L143-L249 HydrophobicContact CD2-CD2 4.16Å; L143-L249 HydrophobicContact CG-CD2 4.49Å; M144-L249 HydrophobicContact CB-CD1 4.47Å; M144-L249 HydrophobicContact CG-CD1 3.5Å; V147-L249 HydrophobicContact CB-CD2 4.25Å; V147-L249 HydrophobicContact CG1-CD2 3.75Å; L174-L249 HydrophobicContact CD1-CD2 4.26Å; L174-L249 HydrophobicContact CD2-CG 4.43Å; M245-L249 PolarHBondContact O-N 3.25Å; M246-L249 HydrophobicContact CE-CD2 3.84Å; M246-L249 WeakPolarHBondContact O-CB 3.46Å; M246-L249 PolarHBondContact O-N 2.96Å; M246-L249 HydrophobicContact SD-CD2 4.11Å; M247-L249 VanDerWaalsContact C-N 3.35Å; L249-L251 VanDerWaalsContact C-N 3.31Å; L249-L251 PolarHBondContact O-N 3.46Å; L249-R252 PolarHBondContact O-N 3.01Å; L249-A253 WeakPolarHBondContact O-CB 3.39Å; L249-A253 PolarHBondContact O-N 2.97Å |
| 250 | V | 95.1 | Very high | 92.2 | Very high | 15 Ų | 15 | 43 Ų | 43 | 9% | 0.091 | 21% | 0.205 | C | C | . | . | H | α-helix | trans | -61.2 | -41.8 | 175.6 | 171 | 0 | 0 | 0 | 0 | 110.7 | F171 L174 L175 V178 M246 M247 A253 F254 | F171-V250 HydrophobicContact CE2-CG1 4.01Å; F171-V250 HydrophobicContact CZ-CG1 4.35Å; L174-V250 HydrophobicContact CD2-CG2 4.46Å; L174-V250 HydrophobicContact CG-CG2 4.39Å; L175-V250 HydrophobicContact CD1-CG1 4.21Å; V178-V250 HydrophobicContact CB-CG2 4.13Å; V178-V250 HydrophobicContact CG1-CG2 4.15Å; V178-V250 HydrophobicContact CG2-CG2 3.76Å; M246-V250 WeakPolarHBondContact O-CG2 3.17Å; M246-V250 PolarHBondContact O-N 3.48Å; M247-V250 PolarHBondContact O-N 3.5Å; V250-A253 PolarHBondContact O-N 2.53Å; V250-F254 WeakPolarHBondContact O-CB 3.46Å; V250-F254 PolarHBondContact O-N 3.02Å |
| 251 | L | 93.1 | Very high | 91.6 | Very high | 93 Ų | 93 | 46.5 Ų | 46.5 | 49% | 0.487 | 22% | 0.221 | S | C | . | . | H | α-helix | trans | -61.6 | -46.7 | 176.3 | -177.5 | 65.6 | 0 | 0 | 0 | 111.7 | M247 Y248 L249 F254 H255 | M247-L251 PolarHBondContact O-N 3.03Å; Y248-L251 HydrophobicContact CD2-CD2 4.41Å; Y248-L251 PolarHBondContact O-N 3.34Å; L249-L251 VanDerWaalsContact C-N 3.31Å; L249-L251 PolarHBondContact O-N 3.46Å; L251-F254 PolarHBondContact O-N 3.15Å; L251-H255 WeakPolarHBondContact O-CB 3.33Å; L251-H255 PolarHBondContact O-N 3.41Å |
| 252 | R | 91.8 | Very high | 90.9 | Very high | 56 Ų | 56 | 44.8 Ų | 44.8 | 21% | 0.211 | 22% | 0.22 | C | C | . | . | H | α-helix | trans | -60.9 | -44 | 175.6 | -78.4 | -79.8 | -170.4 | 169.4 | 1.6 | 111.7 | V140 M144 Y248 L249 H255 R256 E274 | V140-R252 HydrophobicContact CG1-CG 4.28Å; M144-R252 HydrophobicContact SD-CB 4.04Å; M144-R252 HydrophobicContact SD-CG 4.38Å; Y248-R252 HydrophobicContact CE1-CG 4.23Å; Y248-R252 HydrophobicContact CE2-CG 4.37Å; Y248-R252 PolarHBondContact O-N 2.82Å; Y248-R252 PolarHBondContact OH-NE 3.46Å; Y248-R252 PolarHBondContact OH-NH2 3.38Å; L249-R252 PolarHBondContact O-N 3.01Å; R252-H255 PolarHBondContact O-N 3.29Å; R252-R256 PolarHBondContact O-N 3.36Å; R252-E274 IonicContact CZ-OE2 2.74Å; R252-E274 VanDerWaalsContact CZ-OE2 3.28Å; R252-E274 IonicContact NH1-OE2 3.17Å; R252-E274 PolarHBondContact NH1-OE2 3.2Å; R252-E274 IonicContact NH2-OE2 3.64Å; R252-E274 PolarHBondContact NH2-OE2 2.85Å |
| 253 | A | 91 | Very high | 89.9 | Confident | 4 Ų | 4 | 45 Ų | 45 | 3% | 0.033 | 22% | 0.221 | C | C | . | . | H | α-helix | trans | -64.6 | -39.6 | 177.1 | 0 | 0 | 0 | 0 | 0 | 112.2 | F171 L174 L249 V250 M257 | F171-A253 HydrophobicContact CD2-CB 4.02Å; L174-A253 HydrophobicContact CD2-CB 3.71Å; L249-A253 WeakPolarHBondContact O-CB 3.39Å; L249-A253 PolarHBondContact O-N 2.97Å; V250-A253 PolarHBondContact O-N 2.53Å; A253-M257 WeakPolarHBondContact O-CB 2.93Å; A253-M257 PolarHBondContact O-N 3.49Å |
| 254 | F | 91.7 | Very high | 88.6 | Confident | 99 Ų | 99 | 45.3 Ų | 45.3 | 43% | 0.434 | 22% | 0.223 | S | C | . | . | H | α-helix | trans | -62.8 | -47.1 | 173.2 | 174.4 | -104.6 | 0 | 0 | 0 | 111.2 | F171 V250 L251 R256 M257 A258 | F171-F254 HydrophobicContact CD2-CB 4.39Å; F171-F254 HydrophobicContact CE1-CD2 4.44Å; F171-F254 HydrophobicContact CE2-CB 3.56Å; F171-F254 HydrophobicContact CE2-CD2 4.37Å; F171-F254 HydrophobicContact CE2-CG 4.47Å; F171-F254 HydrophobicContact CZ-CB 3.91Å; F171-F254 AromaticContact CZ-CD2 3.94Å; F171-F254 HydrophobicContact CZ-CD2 3.94Å; F171-F254 HydrophobicContact CZ-CG 4.38Å; V250-F254 WeakPolarHBondContact O-CB 3.46Å; V250-F254 PolarHBondContact O-N 3.02Å; L251-F254 PolarHBondContact O-N 3.15Å; F254-R256 PolarHBondContact O-N 3.3Å; F254-M257 HydrophobicContact CD2-CE 4.33Å; F254-M257 WeakPolarHBondContact O-CB 3.35Å; F254-M257 PolarHBondContact O-N 3.08Å; F254-M257 VanDerWaalsContact O-N 3.16Å; F254-A258 WeakPolarHBondContact O-CB 3.09Å; F254-A258 PolarHBondContact O-N 2.88Å |
| 255 | H | 88.5 | Confident | 87.2 | Confident | 84 Ų | 84 | 48.6 Ų | 48.6 | 39% | 0.389 | 25% | 0.248 | S | C | . | . | H | α-helix | trans | -57.1 | -51.1 | -179.7 | -131.2 | -74.9 | 0 | 0 | 0 | 110.8 | L251 R252 M257 A258 D259 | L251-H255 WeakPolarHBondContact O-CB 3.33Å; L251-H255 PolarHBondContact O-N 3.41Å; R252-H255 PolarHBondContact O-N 3.29Å; H255-M257 VanDerWaalsContact C-N 3.32Å; H255-M257 PolarHBondContact O-N 3.42Å; H255-A258 WeakPolarHBondContact O-CB 3.3Å; H255-A258 PolarHBondContact O-N 3.41Å; H255-A258 VanDerWaalsContact O-N 3.11Å; H255-D259 IonicContact ND1-OD2 3.28Å; H255-D259 PolarHBondContact ND1-OD2 2.95Å; H255-D259 WeakPolarHBondContact O-CB 3.28Å; H255-D259 PolarHBondContact O-N 2.98Å |
| 256 | R | 86 | Confident | 85.7 | Confident | 64 Ų | 64 | 54.7 Ų | 54.7 | 24% | 0.242 | 27% | 0.274 | C | S | . | . | H | α-helix | trans | -58.4 | -42.1 | 176.2 | -175.9 | 177.5 | -177.8 | -177.9 | 5.2 | 113 | R252 F254 D259 L260 | R252-R256 PolarHBondContact O-N 3.36Å; F254-R256 PolarHBondContact O-N 3.3Å; R256-D259 PolarHBondContact O-N 3.12Å; R256-L260 HydrophobicContact CG-CD1 4.25Å; R256-L260 WeakPolarHBondContact O-CG 3.36Å; R256-L260 PolarHBondContact O-N 3.46Å |
| 257 | M | 88.8 | Confident | 84.2 | Confident | 28 Ų | 28 | 57 Ų | 57 | 14% | 0.138 | 28% | 0.283 | C | S | . | . | H | α-helix | trans | -63.7 | -44.2 | 176.5 | -174.9 | -118.8 | -68.7 | 0 | 0 | 111.2 | T167 F171 A253 F254 H255 L260 H261 | T167-M257 HydrophobicContact CG2-CB 3.86Å; T167-M257 HydrophobicContact CG2-CG 4.04Å; F171-M257 HydrophobicContact CB-CE 3.67Å; F171-M257 HydrophobicContact CD1-CE 3.02Å; F171-M257 HydrophobicContact CD2-CE 3.97Å; F171-M257 HydrophobicContact CE1-CE 3.54Å; F171-M257 HydrophobicContact CE2-CE 4.4Å; F171-M257 HydrophobicContact CG-CE 3.25Å; F171-M257 HydrophobicContact CZ-CE 4.2Å; A253-M257 WeakPolarHBondContact O-CB 2.93Å; A253-M257 PolarHBondContact O-N 3.49Å; F254-M257 HydrophobicContact CD2-CE 4.33Å; F254-M257 WeakPolarHBondContact O-CB 3.35Å; F254-M257 PolarHBondContact O-N 3.08Å; F254-M257 VanDerWaalsContact O-N 3.16Å; H255-M257 VanDerWaalsContact C-N 3.32Å; H255-M257 PolarHBondContact O-N 3.42Å; M257-L260 PolarHBondContact O-N 2.84Å; M257-H261 PolarHBondContact O-N 3.08Å; M257-H261 VanDerWaalsContact O-N 3.08Å; M257-H261 PolarHBondContact O-ND1 2.99Å |
| 258 | A | 87.6 | Confident | 82.5 | Confident | 6 Ų | 6 | 60 Ų | 60 | 5% | 0.05 | 30% | 0.297 | C | S | . | . | H | α-helix | trans | -63.4 | -41.3 | 177 | 0 | 0 | 0 | 0 | 0 | 111.8 | F254 H255 H261 G262 L263 | F254-A258 WeakPolarHBondContact O-CB 3.09Å; F254-A258 PolarHBondContact O-N 2.88Å; H255-A258 WeakPolarHBondContact O-CB 3.3Å; H255-A258 PolarHBondContact O-N 3.41Å; H255-A258 VanDerWaalsContact O-N 3.11Å; A258-H261 PolarHBondContact O-N 2.97Å; A258-G262 PolarHBondContact O-N 3.36Å; A258-L263 HydrophobicContact CB-CB 4.02Å; A258-L263 HydrophobicContact CB-CD1 4.27Å; A258-L263 WeakPolarHBondContact O-CB 3.23Å; A258-L263 PolarHBondContact O-N 3.38Å |
| 259 | D | 85.1 | Confident | 80.7 | Confident | 51 Ų | 51 | 62.1 Ų | 62.1 | 27% | 0.273 | 31% | 0.311 | S | S | . | . | H | α-helix | trans | -58.7 | -49.5 | 174.5 | -76 | -48.6 | 0 | 0 | 0 | 111.4 | H255 R256 H261 G262 T264 H271 | H255-D259 IonicContact ND1-OD2 3.28Å; H255-D259 PolarHBondContact ND1-OD2 2.95Å; H255-D259 WeakPolarHBondContact O-CB 3.28Å; H255-D259 PolarHBondContact O-N 2.98Å; R256-D259 PolarHBondContact O-N 3.12Å; D259-H261 VanDerWaalsContact C-N 3.31Å; D259-H261 PolarHBondContact O-N 2.96Å; D259-G262 PolarHBondContact O-N 3.37Å; D259-T264 WeakPolarHBondContact OD1-CB 3.39Å; D259-T264 WeakPolarHBondContact OD1-CG2 3.36Å; D259-T264 PolarHBondContact OD1-OG1 3.38Å; D259-H271 IonicContact OD1-CE1 2.85Å |
| 260 | L | 83.9 | Confident | 78.7 | Confident | 93 Ų | 93 | 67.4 Ų | 67.4 | 49% | 0.487 | 35% | 0.345 | S | S | . | . | H | α-helix | trans | -64.9 | -30.8 | 179.1 | -74.5 | 168.7 | 0 | 0 | 0 | 113.8 | L164 T167 R256 M257 G262 | L164-L260 HydrophobicContact CD1-CB 4.39Å; T167-L260 HydrophobicContact CG2-CD1 4Å; R256-L260 HydrophobicContact CG-CD1 4.25Å; R256-L260 WeakPolarHBondContact O-CG 3.36Å; R256-L260 PolarHBondContact O-N 3.46Å; M257-L260 PolarHBondContact O-N 2.84Å; L260-G262 PolarHBondContact O-N 3.45Å |
| 261 | H | 83.8 | Confident | 76.6 | Confident | 80 Ų | 80 | 72.3 Ų | 72.3 | 37% | 0.37 | 37% | 0.367 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -83 | 0.6 | 174.1 | -70.8 | 75.9 | 0 | 0 | 0 | 112.8 | L164 M257 A258 D259 L263 | L164-H261 HydrophobicContact CD1-CB 4.38Å; L164-H261 WeakPolarHBondContact CD1-CE1 3.39Å; L164-H261 WeakPolarHBondContact CD1-ND1 3.3Å; L164-H261 WeakPolarHBondContact CD1-NE2 3.43Å; L164-H261 WeakPolarHBondContact CG-NE2 3.47Å; M257-H261 PolarHBondContact O-N 3.08Å; M257-H261 VanDerWaalsContact O-N 3.08Å; M257-H261 PolarHBondContact O-ND1 2.99Å; A258-H261 PolarHBondContact O-N 2.97Å; D259-H261 VanDerWaalsContact C-N 3.31Å; D259-H261 PolarHBondContact O-N 2.96Å; H261-L263 VanDerWaalsContact C-N 3.28Å; H261-L263 HydrophobicContact CB-CD1 4.12Å; H261-L263 PolarHBondContact O-N 3.22Å |
| 262 | G | 78.6 | Confident | 74.4 | Confident | 23 Ų | 23 | 72.8 Ų | 72.8 | 24% | 0.237 | 38% | 0.377 | C | S | . | . | T | Hydrogen-bonded Turn | trans | 73.7 | 12.6 | -180 | 0 | 0 | 0 | 0 | 0 | 114.5 | A258 D259 L260 T264 S265 F266 | A258-G262 PolarHBondContact O-N 3.36Å; D259-G262 PolarHBondContact O-N 3.37Å; L260-G262 PolarHBondContact O-N 3.45Å; G262-T264 VanDerWaalsContact C-N 3.32Å; G262-T264 PolarHBondContact O-N 2.89Å; G262-S265 PolarHBondContact O-N 2.8Å; G262-S265 PolarHBondContact O-OG 3.38Å; G262-F266 PolarHBondContact O-N 3.37Å |
| 263 | L | 75.6 | Confident | 71.9 | Confident | 76 Ų | 76 | 76 Ų | 76 | 40% | 0.398 | 40% | 0.398 | S | S | . | . | H | α-helix | trans | -61.7 | -39.6 | 177.3 | -90.2 | 133.6 | 0 | 0 | 0 | 111.5 | A258 H261 S265 F266 F267 | A258-L263 HydrophobicContact CB-CB 4.02Å; A258-L263 HydrophobicContact CB-CD1 4.27Å; A258-L263 WeakPolarHBondContact O-CB 3.23Å; A258-L263 PolarHBondContact O-N 3.38Å; H261-L263 VanDerWaalsContact C-N 3.28Å; H261-L263 HydrophobicContact CB-CD1 4.12Å; H261-L263 PolarHBondContact O-N 3.22Å; L263-S265 VanDerWaalsContact C-N 3.35Å; L263-F266 WeakPolarHBondContact O-CB 3.49Å; L263-F266 PolarHBondContact O-N 3.39Å; L263-F267 HydrophobicContact CD2-CE2 3.81Å; L263-F267 WeakPolarHBondContact O-CD2 3.35Å; L263-F267 PolarHBondContact O-N 2.96Å |
| 264 | T | 70.2 | Confident | 69.8 | Low | 7 Ų | 7 | 80.8 Ų | 80.8 | 4% | 0.043 | 42% | 0.42 | C | S | . | . | H | α-helix | trans | -69.1 | -34.2 | 177.2 | 53.2 | 0 | 0 | 0 | 0 | 112.6 | D259 G262 F267 Q268 L269 | D259-T264 WeakPolarHBondContact OD1-CB 3.39Å; D259-T264 WeakPolarHBondContact OD1-CG2 3.36Å; D259-T264 PolarHBondContact OD1-OG1 3.38Å; G262-T264 VanDerWaalsContact C-N 3.32Å; G262-T264 PolarHBondContact O-N 2.89Å; T264-F267 CarbonylContact O-C 3.59Å; T264-F267 PolarHBondContact O-N 2.99Å; T264-Q268 PolarHBondContact O-N 3.31Å; T264-L269 PolarHBondContact O-N 2.93Å; T264-L269 VanDerWaalsContact O-N 3.15Å |
| 265 | S | 64.4 | Low | 67.5 | Low | 88 Ų | 88 | 81.6 Ų | 81.6 | 62% | 0.615 | 43% | 0.429 | S | S | * | . | H | α-helix | trans | -66.1 | -36.5 | 171.4 | 81.3 | 0 | 0 | 0 | 0 | 112.4 | G262 L263 F267 Q268 | G262-S265 PolarHBondContact O-N 2.8Å; G262-S265 PolarHBondContact O-OG 3.38Å; L263-S265 VanDerWaalsContact C-N 3.35Å; S265-F267 VanDerWaalsContact C-N 3.3Å; S265-F267 PolarHBondContact O-N 3.26Å; S265-Q268 PolarHBondContact O-N 2.95Å |
| 266 | F | 63.9 | Low | 65.2 | Low | 156 Ų | 156 | 82.7 Ų | 82.7 | 68% | 0.684 | 44% | 0.441 | S | S | * | . | H | α-helix | trans | -64.4 | -36.6 | 172.6 | 178.3 | -98.2 | 0 | 0 | 0 | 111.6 | G262 L263 | G262-F266 PolarHBondContact O-N 3.37Å; L263-F266 WeakPolarHBondContact O-CB 3.49Å; L263-F266 PolarHBondContact O-N 3.39Å |
| 267 | F | 63.7 | Low | 62.9 | Low | 76 Ų | 76 | 86.7 Ų | 86.7 | 33% | 0.333 | 46% | 0.463 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -86 | -1.2 | 178.3 | -68.3 | -55.6 | 0 | 0 | 0 | 114.8 | F14 L263 T264 S265 L269 | F14-F267 AromaticContact CE1-CD1 3.99Å; F14-F267 HydrophobicContact CE1-CD1 3.99Å; F14-F267 AromaticContact CE1-CE1 3.72Å; F14-F267 HydrophobicContact CE1-CE1 3.72Å; F14-F267 HydrophobicContact CE2-CD1 4.16Å; F14-F267 AromaticContact CZ-CD1 3.31Å; F14-F267 HydrophobicContact CZ-CD1 3.31Å; F14-F267 AromaticContact CZ-CE1 3.44Å; F14-F267 HydrophobicContact CZ-CE1 3.44Å; F14-F267 VanDerWaalsContact CZ-CE1 3.44Å; F14-F267 HydrophobicContact CZ-CG 4.49Å; L263-F267 HydrophobicContact CD2-CE2 3.81Å; L263-F267 WeakPolarHBondContact O-CD2 3.35Å; L263-F267 PolarHBondContact O-N 2.96Å; T264-F267 CarbonylContact O-C 3.59Å; T264-F267 PolarHBondContact O-N 2.99Å; S265-F267 VanDerWaalsContact C-N 3.3Å; S265-F267 PolarHBondContact O-N 3.26Å; F267-L269 HydrophobicContact CB-CD1 3.77Å; F267-L269 HydrophobicContact CB-CG 3.87Å; F267-L269 PolarHBondContact O-N 3.3Å; F267-L269 VanDerWaalsContact O-N 3.08Å |
| 268 | Q | 60.1 | Low | 60.7 | Low | 112 Ų | 112 | 94.4 Ų | 94.4 | 52% | 0.523 | 50% | 0.498 | S | S | . | . | T | Hydrogen-bonded Turn | trans | 47.4 | 32.6 | -172.7 | -60.2 | -172.5 | -57.2 | 0 | 0 | 113 | T264 S265 | T264-Q268 PolarHBondContact O-N 3.31Å; S265-Q268 PolarHBondContact O-N 2.95Å |
| 269 | L | 58.1 | Low | 58.3 | Low | 93 Ų | 93 | 101.8 Ų | 101.8 | 49% | 0.487 | 54% | 0.537 | S | S | . | . | P | Polyproline II helix | trans | -71.9 | 141.5 | 174.9 | -72 | 162.8 | 0 | 0 | 0 | 108.3 | T264 F267 H271 | T264-L269 PolarHBondContact O-N 2.93Å; T264-L269 VanDerWaalsContact O-N 3.15Å; F267-L269 HydrophobicContact CB-CD1 3.77Å; F267-L269 HydrophobicContact CB-CG 3.87Å; F267-L269 PolarHBondContact O-N 3.3Å; F267-L269 VanDerWaalsContact O-N 3.08Å; L269-H271 PolarHBondContact O-N 3.4Å |
| 270 | P | 52.8 | Low | 56.1 | Low | 111 Ų | 111 | 106.8 Ų | 106.8 | 72% | 0.721 | 56% | 0.557 | S | S | * | * | P | Polyproline II helix | trans | -53.2 | 132.1 | 173.3 | -19.8 | 29.8 | 0 | 0 | 0 | 109.5 | C272 | P270-C272 PolarHBondContact O-N 2.85Š|
| 271 | H | 49.7 | Very low | 53.8 | Low | 118 Ų | 118 | 110.7 Ų | 110.7 | 55% | 0.546 | 57% | 0.572 | S | S | . | * | P | Polyproline II helix | trans | -62.6 | 119.2 | 167 | -115.7 | 40.6 | 0 | 0 | 0 | 107.4 | D259 L269 D273 | D259-H271 IonicContact OD1-CE1 2.85Å; L269-H271 PolarHBondContact O-N 3.4Å; H271-D273 IonicContact CD2-OD1 3.97Å; H271-D273 PolarHBondContact O-N 2.74Å |
| 272 | C | 47.2 | Very low | 51.7 | Low | 103 Ų | 103 | 112.4 Ų | 112.4 | 70% | 0.696 | 59% | 0.591 | S | S | * | * | trans | -76.7 | 83.5 | 166.2 | -72.5 | 0 | 0 | 0 | 0 | 107 | P270 E274 | P270-C272 PolarHBondContact O-N 2.85Å; C272-E274 PolarHBondContact O-N 3.03Å | ||
| 273 | D | 39.9 | Very low | 49.8 | Very low | 123 Ų | 123 | 118.9 Ų | 118.9 | 66% | 0.658 | 62% | 0.618 | S | S | * | * | trans | -67.8 | 80.3 | 171.7 | -66.9 | -34.9 | 0 | 0 | 0 | 109.1 | H271 | H271-D273 IonicContact CD2-OD1 3.97Å; H271-D273 PolarHBondContact O-N 2.74Å | ||
| 274 | E | 46.5 | Very low | 48 | Very low | 105 Ų | 105 | 122 Ų | 122 | 49% | 0.491 | 63% | 0.633 | S | S | . | * | trans | -100.9 | -10 | 168.3 | -78.3 | -170.5 | 159.2 | 0 | 0 | 112.6 | R252 C272 | R252-E274 IonicContact CZ-OE2 2.74Å; R252-E274 VanDerWaalsContact CZ-OE2 3.28Å; R252-E274 IonicContact NH1-OE2 3.17Å; R252-E274 PolarHBondContact NH1-OE2 3.2Å; R252-E274 IonicContact NH2-OE2 3.64Å; R252-E274 PolarHBondContact NH2-OE2 2.85Å; C272-E274 PolarHBondContact O-N 3.03Å | ||
| 275 | D | 43.4 | Very low | 46.4 | Very low | 117 Ų | 117 | 130.2 Ų | 130.2 | 63% | 0.626 | 67% | 0.672 | S | S | * | * | S | Bend | trans | -99.4 | 3.2 | -169.8 | -69.4 | -27.3 | 0 | 0 | 0 | 115.1 | ||
| 276 | T | 38.9 | Very low | 45 | Very low | 106 Ų | 106 | 131.7 Ų | 131.7 | 65% | 0.65 | 68% | 0.676 | S | S | * | * | S | Bend | trans | -106.6 | -0.5 | -170.6 | -26.2 | 0 | 0 | 0 | 0 | 115.9 | ||
| 277 | E | 38.6 | Very low | 43.5 | Very low | 148 Ų | 148 | 127.5 Ų | 127.5 | 69% | 0.692 | 68% | 0.678 | S | S | * | * | S | Bend | trans | -109.3 | -9.4 | -174.6 | -79.4 | -93 | 118.7 | 0 | 0 | 115.7 | K280 | E277-K280 IonicContact OE1-NZ 3.11Å; E277-K280 PolarHBondContact OE1-NZ 3.17Å |
| 278 | E | 42 | Very low | 41.8 | Very low | 190 Ų | 190 | 132.6 Ų | 132.6 | 89% | 0.888 | 70% | 0.702 | S | S | * | * | S | Bend | trans | -97.6 | -5.7 | -177.7 | -73.1 | -169.5 | 166 | 0 | 0 | 115.9 | ||
| 279 | D | 37.3 | Very low | 40.4 | Very low | 161 Ų | 161 | 135.3 Ų | 135.3 | 86% | 0.861 | 72% | 0.715 | S | S | * | * | trans | -100.4 | 28.1 | 177.9 | -85.4 | -16.5 | 0 | 0 | 0 | 114 | ||||
| 280 | K | 38.7 | Very low | 39.1 | Very low | 157 Ų | 157 | 137.5 Ų | 137.5 | 68% | 0.683 | 73% | 0.727 | S | S | * | * | S | Bend | trans | -91.5 | 113.4 | 166.9 | -75.8 | 176.5 | -174.3 | 152.7 | 0 | 109.6 | E277 | E277-K280 IonicContact OE1-NZ 3.11Å; E277-K280 PolarHBondContact OE1-NZ 3.17Å |
| 281 | E | 37.3 | Very low | 37.9 | Very low | 174 Ų | 174 | 141 Ų | 141 | 81% | 0.813 | 73% | 0.734 | S | S | * | * | trans | -38.1 | 147.6 | -179.2 | -59.3 | -172.6 | 157.9 | 0 | 0 | 115.6 | I283 | E281-I283 PolarHBondContact O-N 2.99Š| ||
| 282 | P | 38.8 | Very low | 36.8 | Very low | 117 Ų | 117 | 142.7 Ų | 142.7 | 76% | 0.76 | 74% | 0.741 | S | S | * | * | trans | -67.6 | 123 | 172.7 | 28.3 | -31.2 | 0 | 0 | 0 | 110 | I284 | P282-I284 PolarHBondContact O-N 3.27Š| ||
| 283 | I | 38.9 | Very low | 35.9 | Very low | 158 Ų | 158 | 145.6 Ų | 145.6 | 81% | 0.81 | 75% | 0.745 | S | S | * | * | trans | -58 | 105.3 | 170.4 | -60.8 | 165.6 | 0 | 0 | 0 | 108 | E281 E285 | E281-I283 PolarHBondContact O-N 2.99Å; I283-E285 HydrophobicContact CG2-CG 4.45Å; I283-E285 PolarHBondContact O-N 3.26Å | ||
| 284 | I | 37.3 | Very low | 35.3 | Very low | 141 Ų | 141 | 144 Ų | 144 | 72% | 0.723 | 75% | 0.749 | S | S | * | * | trans | -79.1 | 98.4 | 164.3 | -57.6 | 178.4 | 0 | 0 | 0 | 106.5 | P282 V286 | P282-I284 PolarHBondContact O-N 3.27Å; I284-V286 HydrophobicContact CG2-CG2 3.57Å; I284-V286 PolarHBondContact O-N 3.29Å; I284-V286 VanDerWaalsContact O-N 3.14Å | ||
| 285 | E | 37.3 | Very low | 34.4 | Very low | 181 Ų | 181 | 148.7 Ų | 148.7 | 85% | 0.846 | 77% | 0.77 | S | S | * | * | trans | -68.7 | 98.5 | 156.8 | -87.7 | -174.4 | 153.9 | 0 | 0 | 108.1 | I283 G287 | I283-E285 HydrophobicContact CG2-CG 4.45Å; I283-E285 PolarHBondContact O-N 3.26Å; E285-G287 PolarHBondContact O-N 3.14Å | ||
| 286 | V | 35.2 | Very low | 33.8 | Very low | 118 Ų | 118 | 147.7 Ų | 147.7 | 72% | 0.715 | 78% | 0.779 | S | S | * | * | trans | -82.5 | 94.1 | 159.8 | -175.8 | 0 | 0 | 0 | 0 | 107 | I284 | I284-V286 HydrophobicContact CG2-CG2 3.57Å; I284-V286 PolarHBondContact O-N 3.29Å; I284-V286 VanDerWaalsContact O-N 3.14Å | ||
| 287 | G | 31.2 | Very low | 33.3 | Very low | 69 Ų | 69 | 148.3 Ų | 148.3 | 71% | 0.711 | 79% | 0.787 | S | S | * | * | trans | -68.3 | 125.7 | 158.2 | 0 | 0 | 0 | 0 | 0 | 109.5 | E285 | E285-G287 PolarHBondContact O-N 3.14Š| ||
| 288 | H | 29.3 | Very low | 32.9 | Very low | 183 Ų | 183 | 145.4 Ų | 145.4 | 85% | 0.847 | 79% | 0.789 | S | S | * | * | trans | -144.9 | 106.1 | 152.5 | -130.5 | -44.2 | 0 | 0 | 0 | 109 | ||||
| 289 | E | 30.9 | Very low | 32.4 | Very low | 169 Ų | 169 | 146 Ų | 146 | 79% | 0.79 | 79% | 0.788 | S | S | * | * | trans | -77.1 | 143.9 | 163.7 | -80.4 | 179.5 | 152.2 | 0 | 0 | 110.5 | ||||
| 290 | D | 29.6 | Very low | 32.9 | Very low | 138 Ų | 138 | 142.7 Ų | 142.7 | 74% | 0.738 | 78% | 0.776 | S | S | * | * | trans | 64.7 | 118.1 | 148.3 | -61.7 | -25.3 | 0 | 0 | 0 | 122.4 | ||||
| 291 | Q | 27.1 | Very low | 32.5 | Very low | 186 Ų | 186 | 142.5 Ų | 142.5 | 87% | 0.869 | 78% | 0.781 | S | S | * | * | -168.2 | 114.4 | 116.6 | -101.4 | 167.5 | 24 | 0 | 0 | 113.9 | |||||
| 292 | H | 28.1 | Very low | 32.2 | Very low | 152 Ų | 152 | 142 Ų | 142 | 70% | 0.704 | 78% | 0.784 | S | S | * | * | trans | 59.9 | 120.3 | 130.6 | -88.3 | -106.5 | 0 | 0 | 0 | 124.4 | ||||
| 293 | E | 27.9 | Very low | 32.2 | Very low | 165 Ų | 165 | 141.1 Ų | 141.1 | 77% | 0.771 | 78% | 0.779 | S | S | * | * | 83.8 | 112.1 | 127 | -83.9 | 173.2 | 155.9 | 0 | 0 | 123.5 | |||||
| 294 | A | 28 | Very low | 31.7 | Very low | 89 Ų | 89 | 138.4 Ų | 138.4 | 74% | 0.736 | 78% | 0.78 | S | S | * | * | 98.8 | 132.3 | 115.6 | 0 | 0 | 0 | 0 | 0 | 121.6 | |||||
| 295 | E | 27.3 | Very low | 31.5 | Very low | 203 Ų | 203 | 137.5 Ų | 137.5 | 95% | 0.949 | 79% | 0.786 | S | S | * | * | trans | 98.2 | 137.3 | 144.3 | -86.1 | -177.1 | 160.7 | 0 | 0 | 122.7 | ||||
| 296 | A | 30.1 | Very low | 31.2 | Very low | 97 Ų | 97 | 137.6 Ų | 137.6 | 80% | 0.802 | 79% | 0.786 | S | S | * | * | trans | -90 | 165.6 | -167.3 | 0 | 0 | 0 | 0 | 0 | 113.1 | ||||
| 297 | S | 28.2 | Very low | 31.1 | Very low | 118 Ų | 118 | 137.8 Ų | 137.8 | 83% | 0.825 | 79% | 0.788 | S | S | * | * | 160 | 132.3 | 127.2 | -168.3 | 0 | 0 | 0 | 0 | 114.6 | |||||
| 298 | A | 30.5 | Very low | 31 | Very low | 87 Ų | 87 | 139 Ų | 139 | 72% | 0.719 | 79% | 0.786 | S | S | * | * | trans | 59 | 106.4 | 142.7 | 0 | 0 | 0 | 0 | 0 | 124.5 | ||||
| 299 | K | 31 | Very low | 31.3 | Very low | 202 Ų | 202 | 139.6 Ų | 139.6 | 88% | 0.878 | 78% | 0.782 | S | S | * | * | 23.1 | 164.7 | 115.1 | -100.8 | -169.2 | 172.9 | 178.4 | 0 | 121 | |||||
| 300 | P | 48.4 | Very low | 31.6 | Very low | 93 Ų | 93 | 137.7 Ų | 137.7 | 60% | 0.604 | 78% | 0.777 | S | S | * | * | -145.4 | -177.2 | -54.5 | 37.7 | -15.2 | 0 | 0 | 0 | 115.8 | |||||
| 301 | L | 30.6 | Very low | 32 | Very low | 152 Ų | 152 | 136.9 Ų | 136.9 | 80% | 0.796 | 78% | 0.777 | S | S | * | * | trans | 66.2 | 128.6 | 150.7 | -77.1 | 155.9 | 0 | 0 | 0 | 121.8 | ||||
| 302 | D | 30.7 | Very low | 32.6 | Very low | 163 Ų | 163 | 134.2 Ų | 134.2 | 87% | 0.872 | 77% | 0.768 | S | S | * | * | -157.6 | 152.6 | 114.8 | -112.9 | -13.1 | 0 | 0 | 0 | 113.9 | |||||
| 303 | P | 38.8 | Very low | 33.1 | Very low | 100 Ų | 100 | 134 Ų | 134 | 65% | 0.649 | 77% | 0.772 | S | S | * | * | trans | -111.4 | 174.1 | -168 | 41.7 | -32.8 | 0 | 0 | 0 | 115.3 | ||||
| 304 | A | 28.5 | Very low | 33.7 | Very low | 101 Ų | 101 | 141 Ų | 141 | 84% | 0.835 | 79% | 0.791 | S | S | * | * | trans | 84.3 | 113.3 | 153.8 | 0 | 0 | 0 | 0 | 0 | 120.1 | ||||
| 305 | S | 33.6 | Very low | 34 | Very low | 122 Ų | 122 | 143.6 Ų | 143.6 | 85% | 0.853 | 79% | 0.794 | S | S | * | * | -161.3 | 127.1 | 117.7 | 61.2 | 0 | 0 | 0 | 0 | 111.8 | |||||
| 306 | Q | 31.2 | Very low | 34.4 | Very low | 182 Ų | 182 | 140.5 Ų | 140.5 | 85% | 0.85 | 79% | 0.786 | S | S | * | * | trans | -52.2 | 169.7 | 169 | -60.8 | 168.2 | -33.6 | 0 | 0 | 111.9 | ||||
| 307 | T | 31.3 | Very low | 34.6 | Very low | 122 Ų | 122 | 142.9 Ų | 142.9 | 75% | 0.748 | 79% | 0.785 | S | S | * | * | cis | -172.8 | 156.7 | 20.4 | -7.4 | 0 | 0 | 0 | 0 | 104.2 | ||||
| 308 | S | 30.8 | Very low | 35 | Very low | 95 Ų | 95 | 144.4 Ų | 144.4 | 66% | 0.664 | 78% | 0.782 | S | S | * | * | 150.5 | 116.8 | 99.9 | -168 | 0 | 0 | 0 | 0 | 112.2 | |||||
| 309 | Y | 35 | Very low | 35.3 | Very low | 196 Ų | 196 | 147.9 Ų | 147.9 | 77% | 0.769 | 79% | 0.786 | S | S | * | * | trans | 65 | 113.9 | 145.9 | -69.5 | -106.1 | 0 | 0 | 0 | 121.2 | ||||
| 310 | N | 36.9 | Very low | 35.6 | Very low | 129 Ų | 129 | 144.3 Ų | 144.3 | 69% | 0.69 | 78% | 0.78 | S | S | * | * | 61.8 | 131.6 | 95.5 | -72.9 | -22.4 | 0 | 0 | 0 | 113.5 | |||||
| 311 | T | 39.3 | Very low | 34.6 | Very low | 120 Ų | 120 | 148 Ų | 148 | 74% | 0.736 | 79% | 0.793 | S | S | * | * | -178.5 | 119.1 | 67.4 | -31 | 0 | 0 | 0 | 0 | 105.8 | |||||
| 312 | I | 38 | Very low | 35 | Very low | 131 Ų | 131 | 147.7 Ų | 147.7 | 67% | 0.672 | 79% | 0.793 | S | S | * | * | 76.8 | 121.6 | 95.1 | -69.1 | -178.1 | 0 | 0 | 0 | 116.8 | |||||
| 313 | N | 38.7 | Very low | 35.3 | Very low | 148 Ų | 148 | 146.4 Ų | 146.4 | 79% | 0.791 | 79% | 0.786 | S | S | * | * | trans | 60 | 144.3 | 145.4 | -61.5 | -8.5 | 0 | 0 | 0 | 119.9 | ||||
| 314 | R | 41.8 | Very low | 35 | Very low | 311 Ų | 311 | 150.6 Ų | 150.6 | 100% | 1.174 | 80% | 0.798 | S | S | * | * | cis | -154.6 | 0 | 25 | -158.3 | -179.6 | -172.1 | 174.3 | 1.5 | 110.5 |
Retrieved 314 of 314 residues in 55.6 ms
(Link to these results)