| 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 | 83.2 | Confident | 90.7 | Very high | 214 Ų | 214 | 101.7 Ų | 101.7 | 100% | 1.054 | 60% | 0.6 | S | S | * | * | 0 | -57.9 | 0 | -58.7 | -55 | -174.4 | 0 | 0 | 112.1 | A3 G4 L5 | M1-A3 PolarHBondContact O-N 3.09Å; M1-G4 PolarHBondContact O-N 2.94Å; M1-L5 PolarHBondContact O-N 3.02Å | |||
| 2 | A | 89.5 | Confident | 90.6 | Very high | 68 Ų | 68 | 98.8 Ų | 98.8 | 56% | 0.562 | 58% | 0.584 | S | S | * | * | H | α-helix | trans | -62.6 | -42.5 | -176.7 | 0 | 0 | 0 | 0 | 0 | 115.3 | G4 L5 L6 | A2-G4 VanDerWaalsContact C-N 3.29Å; A2-G4 PolarHBondContact O-N 3.16Å; A2-L5 PolarHBondContact O-N 3.04Å; A2-L5 VanDerWaalsContact O-N 3.13Å; A2-L6 PolarHBondContact O-N 3.28Å |
| 3 | A | 91.8 | Very high | 90.4 | Very high | 75 Ų | 75 | 99.3 Ų | 99.3 | 62% | 0.62 | 58% | 0.581 | S | S | * | * | H | α-helix | trans | -60.8 | -36.5 | -179.7 | 0 | 0 | 0 | 0 | 0 | 113.2 | M1 L6 F7 | M1-A3 PolarHBondContact O-N 3.09Å; A3-L6 PolarHBondContact O-N 3.11Å; A3-F7 WeakPolarHBondContact O-CB 3.5Å; A3-F7 PolarHBondContact O-N 3.34Å |
| 4 | G | 92.9 | Very high | 90.4 | Very high | 51 Ų | 51 | 99.2 Ų | 99.2 | 53% | 0.526 | 58% | 0.582 | S | S | . | * | H | α-helix | trans | -68.5 | -36.9 | 175.1 | 0 | 0 | 0 | 0 | 0 | 113 | M1 A2 F7 G8 | M1-G4 PolarHBondContact O-N 2.94Å; A2-G4 VanDerWaalsContact C-N 3.29Å; A2-G4 PolarHBondContact O-N 3.16Å; G4-F7 PolarHBondContact O-N 3.01Å; G4-G8 PolarHBondContact O-N 3.41Å |
| 5 | L | 92.6 | Very high | 90.1 | Very high | 128 Ų | 128 | 100.5 Ų | 100.5 | 67% | 0.67 | 58% | 0.58 | S | S | * | * | H | α-helix | trans | -66.1 | -41.5 | 173.9 | -68.6 | 174.4 | 0 | 0 | 0 | 111.7 | M1 A2 G8 M9 | M1-L5 PolarHBondContact O-N 3.02Å; A2-L5 PolarHBondContact O-N 3.04Å; A2-L5 VanDerWaalsContact O-N 3.13Å; L5-G8 PolarHBondContact O-N 3.38Å; L5-M9 WeakPolarHBondContact O-CB 3.15Å; L5-M9 WeakPolarHBondContact O-CG 3.47Å; L5-M9 PolarHBondContact O-N 3.17Å |
| 6 | L | 93.2 | Very high | 89.8 | Confident | 120 Ų | 120 | 100.6 Ų | 100.6 | 63% | 0.628 | 57% | 0.568 | S | S | * | * | H | α-helix | trans | -62.8 | -46.6 | 174.8 | -69.9 | 174.1 | 0 | 0 | 0 | 111 | A2 A3 G8 M9 V10 | A2-L6 PolarHBondContact O-N 3.28Å; A3-L6 PolarHBondContact O-N 3.11Å; L6-G8 VanDerWaalsContact C-N 3.34Å; L6-G8 PolarHBondContact O-N 3.21Å; L6-M9 PolarHBondContact O-N 2.99Å; L6-V10 WeakPolarHBondContact O-CB 3.45Å; L6-V10 VanDerWaalsContact O-CG2 3.22Å; L6-V10 WeakPolarHBondContact O-CG2 3.46Å; L6-V10 PolarHBondContact O-N 3.14Å |
| 7 | F | 91.7 | Very high | 89.7 | Confident | 151 Ų | 151 | 98.7 Ų | 98.7 | 66% | 0.662 | 56% | 0.559 | S | S | * | * | H | α-helix | trans | -63 | -38.9 | 176.6 | -171.2 | -102.9 | 0 | 0 | 0 | 112.4 | A3 G4 T11 | A3-F7 WeakPolarHBondContact O-CB 3.5Å; A3-F7 PolarHBondContact O-N 3.34Å; G4-F7 PolarHBondContact O-N 3.01Å; F7-T11 HydrophobicContact CD1-CG2 4.35Å; F7-T11 HydrophobicContact CE1-CG2 4.04Å; F7-T11 HydrophobicContact CZ-CG2 4.16Å; F7-T11 VanDerWaalsContact O-CG2 3.31Å; F7-T11 WeakPolarHBondContact O-CG2 3.43Å; F7-T11 PolarHBondContact O-N 3.01Å; F7-T11 PolarHBondContact O-OG1 3.26Å |
| 8 | G | 90.3 | Very high | 89.6 | Confident | 30 Ų | 30 | 95.2 Ų | 95.2 | 31% | 0.309 | 55% | 0.549 | S | S | . | . | H | α-helix | trans | -65.6 | -44.2 | 174.8 | 0 | 0 | 0 | 0 | 0 | 113.6 | G4 L5 L6 T11 V12 | G4-G8 PolarHBondContact O-N 3.41Å; L5-G8 PolarHBondContact O-N 3.38Å; L6-G8 VanDerWaalsContact C-N 3.34Å; L6-G8 PolarHBondContact O-N 3.21Å; G8-T11 WeakPolarHBondContact CA-OG1 3.39Å; G8-T11 PolarHBondContact O-N 2.92Å; G8-T11 PolarHBondContact O-OG1 3.41Å; G8-V12 WeakPolarHBondContact O-CG2 3.48Å; G8-V12 PolarHBondContact O-N 3.14Å; G8-V12 VanDerWaalsContact O-N 3.16Å |
| 9 | M | 90.3 | Very high | 89.1 | Confident | 132 Ų | 132 | 91.9 Ų | 91.9 | 65% | 0.65 | 53% | 0.529 | S | S | * | . | H | α-helix | trans | -63.6 | -43.4 | 175.3 | -78.5 | -95.1 | 84.4 | 0 | 0 | 111.7 | L5 L6 V12 L13 | L5-M9 WeakPolarHBondContact O-CB 3.15Å; L5-M9 WeakPolarHBondContact O-CG 3.47Å; L5-M9 PolarHBondContact O-N 3.17Å; L6-M9 PolarHBondContact O-N 2.99Å; M9-V12 PolarHBondContact O-N 3.48Å; M9-L13 VanDerWaalsContact O-CB 3.28Å; M9-L13 WeakPolarHBondContact O-CB 3.49Å; M9-L13 PolarHBondContact O-N 2.71Å |
| 10 | V | 91.7 | Very high | 89.1 | Confident | 81 Ų | 81 | 90.8 Ų | 90.8 | 49% | 0.491 | 52% | 0.518 | S | S | . | . | H | α-helix | trans | -62.9 | -45.1 | 178.4 | 170.7 | 0 | 0 | 0 | 0 | 111 | L6 V12 L13 V14 | L6-V10 WeakPolarHBondContact O-CB 3.45Å; L6-V10 VanDerWaalsContact O-CG2 3.22Å; L6-V10 WeakPolarHBondContact O-CG2 3.46Å; L6-V10 PolarHBondContact O-N 3.14Å; V10-V12 VanDerWaalsContact C-N 3.34Å; V10-V12 PolarHBondContact O-N 3.02Å; V10-L13 WeakPolarHBondContact O-CB 3.42Å; V10-L13 PolarHBondContact O-N 2.98Å; V10-V14 HydrophobicContact CG1-CG2 4.32Å; V10-V14 VanDerWaalsContact O-CG2 3.28Å; V10-V14 WeakPolarHBondContact O-CG2 3.41Å; V10-V14 PolarHBondContact O-N 3.03Å |
| 11 | T | 90.3 | Very high | 89.1 | Confident | 69 Ų | 69 | 92 Ų | 92 | 42% | 0.423 | 52% | 0.52 | S | S | . | . | H | α-helix | trans | -63.1 | -39.2 | 179.5 | 48.3 | 0 | 0 | 0 | 0 | 112.6 | F7 G8 H15 | F7-T11 HydrophobicContact CD1-CG2 4.35Å; F7-T11 HydrophobicContact CE1-CG2 4.04Å; F7-T11 HydrophobicContact CZ-CG2 4.16Å; F7-T11 VanDerWaalsContact O-CG2 3.31Å; F7-T11 WeakPolarHBondContact O-CG2 3.43Å; F7-T11 PolarHBondContact O-N 3.01Å; F7-T11 PolarHBondContact O-OG1 3.26Å; G8-T11 WeakPolarHBondContact CA-OG1 3.39Å; G8-T11 PolarHBondContact O-N 2.92Å; G8-T11 PolarHBondContact O-OG1 3.41Å; T11-H15 PolarHBondContact O-N 3.01Å |
| 12 | V | 89.9 | Confident | 89.2 | Confident | 67 Ų | 67 | 84.7 Ų | 84.7 | 41% | 0.406 | 49% | 0.488 | S | S | . | . | H | α-helix | trans | -67.7 | -41.7 | 174.1 | 171.8 | 0 | 0 | 0 | 0 | 111.3 | G8 M9 V10 H15 Y16 | G8-V12 WeakPolarHBondContact O-CG2 3.48Å; G8-V12 PolarHBondContact O-N 3.14Å; G8-V12 VanDerWaalsContact O-N 3.16Å; M9-V12 PolarHBondContact O-N 3.48Å; V10-V12 VanDerWaalsContact C-N 3.34Å; V10-V12 PolarHBondContact O-N 3.02Å; V12-H15 PolarHBondContact O-N 3.39Å; V12-Y16 HydrophobicContact CG1-CD2 3.71Å; V12-Y16 HydrophobicContact CG1-CE2 3.3Å; V12-Y16 WeakPolarHBondContact O-CD2 3.47Å; V12-Y16 PolarHBondContact O-N 3.41Å |
| 13 | L | 88.4 | Confident | 89 | Confident | 105 Ų | 105 | 81.6 Ų | 81.6 | 55% | 0.55 | 46% | 0.463 | S | S | . | . | H | α-helix | trans | -61.7 | -44.1 | 177.2 | -176.4 | 67.7 | 0 | 0 | 0 | 111.7 | M9 V10 H15 Y16 V17 | M9-L13 VanDerWaalsContact O-CB 3.28Å; M9-L13 WeakPolarHBondContact O-CB 3.49Å; M9-L13 PolarHBondContact O-N 2.71Å; V10-L13 WeakPolarHBondContact O-CB 3.42Å; V10-L13 PolarHBondContact O-N 2.98Å; L13-H15 PolarHBondContact O-N 3.18Å; L13-Y16 PolarHBondContact O-N 3.29Å; L13-Y16 VanDerWaalsContact O-N 3.07Å; L13-V17 HydrophobicContact CD1-CG2 4.28Å; L13-V17 HydrophobicContact CG-CG2 4.17Å; L13-V17 WeakPolarHBondContact O-CG2 3.47Å; L13-V17 PolarHBondContact O-N 3.19Å |
| 14 | V | 90.1 | Very high | 88.8 | Confident | 98 Ų | 98 | 80.6 Ų | 80.6 | 59% | 0.594 | 45% | 0.445 | S | S | * | . | H | α-helix | trans | -56.9 | -41 | 178.2 | 169.3 | 0 | 0 | 0 | 0 | 111 | V10 V17 G18 | V10-V14 HydrophobicContact CG1-CG2 4.32Å; V10-V14 VanDerWaalsContact O-CG2 3.28Å; V10-V14 WeakPolarHBondContact O-CG2 3.41Å; V10-V14 PolarHBondContact O-N 3.03Å; V14-V17 PolarHBondContact O-N 3.37Å; V14-G18 PolarHBondContact O-N 3.49Å |
| 15 | H | 85.6 | Confident | 88.5 | Confident | 119 Ų | 119 | 83.7 Ų | 83.7 | 55% | 0.551 | 45% | 0.448 | S | S | * | . | H | α-helix | trans | -65.2 | -41.6 | 176.4 | -172.4 | -105.5 | 0 | 0 | 0 | 112.4 | T11 V12 L13 G18 L19 | T11-H15 PolarHBondContact O-N 3.01Å; V12-H15 PolarHBondContact O-N 3.39Å; L13-H15 PolarHBondContact O-N 3.18Å; H15-G18 PolarHBondContact O-N 3.49Å; H15-L19 PolarHBondContact O-N 3.03Å; H15-L19 VanDerWaalsContact O-N 3.13Å |
| 16 | Y | 85.1 | Confident | 88.1 | Confident | 101 Ų | 101 | 77.9 Ų | 77.9 | 40% | 0.396 | 42% | 0.418 | S | S | . | . | H | α-helix | trans | -68.4 | -37.9 | 176 | -73.3 | -64.9 | 0 | 0 | 0 | 113.3 | V12 L13 G18 L19 F20 L66 | V12-Y16 HydrophobicContact CG1-CD2 3.71Å; V12-Y16 HydrophobicContact CG1-CE2 3.3Å; V12-Y16 WeakPolarHBondContact O-CD2 3.47Å; V12-Y16 PolarHBondContact O-N 3.41Å; L13-Y16 PolarHBondContact O-N 3.29Å; L13-Y16 VanDerWaalsContact O-N 3.07Å; Y16-G18 VanDerWaalsContact C-N 3.35Å; Y16-L19 HydrophobicContact CD1-CD1 4.45Å; Y16-L19 PolarHBondContact O-N 3.23Å; Y16-F20 WeakPolarHBondContact O-CB 3.47Å; Y16-F20 PolarHBondContact O-N 3.41Å; Y16-L66 HydrophobicContact CD1-CD2 3.9Å |
| 17 | V | 89 | Confident | 87.7 | Confident | 69 Ų | 69 | 72.2 Ų | 72.2 | 42% | 0.418 | 39% | 0.388 | S | S | . | . | H | α-helix | trans | -65.4 | -40.8 | 175 | 174.5 | 0 | 0 | 0 | 0 | 110.2 | L13 V14 L19 F20 M21 | L13-V17 HydrophobicContact CD1-CG2 4.28Å; L13-V17 HydrophobicContact CG-CG2 4.17Å; L13-V17 WeakPolarHBondContact O-CG2 3.47Å; L13-V17 PolarHBondContact O-N 3.19Å; V14-V17 PolarHBondContact O-N 3.37Å; V17-L19 VanDerWaalsContact C-N 3.34Å; V17-L19 PolarHBondContact O-N 3.22Å; V17-F20 PolarHBondContact O-N 3.36Å; V17-M21 HydrophobicContact CG1-CG 4.07Å; V17-M21 WeakPolarHBondContact O-CB 3.42Å; V17-M21 WeakPolarHBondContact O-CG 3.34Å; V17-M21 PolarHBondContact O-N 3.22Å |
| 18 | G | 86.6 | Confident | 87.3 | Confident | 36 Ų | 36 | 68.1 Ų | 68.1 | 37% | 0.371 | 37% | 0.373 | S | S | . | . | H | α-helix | trans | -59 | -43.9 | 174.1 | 0 | 0 | 0 | 0 | 0 | 112.8 | V14 H15 Y16 T22 | V14-G18 PolarHBondContact O-N 3.49Å; H15-G18 PolarHBondContact O-N 3.49Å; Y16-G18 VanDerWaalsContact C-N 3.35Å; G18-T22 WeakPolarHBondContact O-CB 3.47Å; G18-T22 PolarHBondContact O-N 2.96Å; G18-T22 PolarHBondContact O-OG1 2.93Å |
| 19 | L | 81.1 | Confident | 86.8 | Confident | 32 Ų | 32 | 70 Ų | 70 | 17% | 0.168 | 38% | 0.375 | C | S | . | . | H | α-helix | trans | -62.8 | -42.8 | 173.9 | -77.4 | 157.3 | 0 | 0 | 0 | 112.1 | H15 Y16 V17 G23 | H15-L19 PolarHBondContact O-N 3.03Å; H15-L19 VanDerWaalsContact O-N 3.13Å; Y16-L19 HydrophobicContact CD1-CD1 4.45Å; Y16-L19 PolarHBondContact O-N 3.23Å; V17-L19 VanDerWaalsContact C-N 3.34Å; V17-L19 PolarHBondContact O-N 3.22Å; L19-G23 PolarHBondContact O-N 3.06Å |
| 20 | F | 88.2 | Confident | 86.4 | Confident | 70 Ų | 70 | 65.2 Ų | 65.2 | 31% | 0.307 | 35% | 0.353 | S | S | . | . | H | α-helix | trans | -63.3 | -47.2 | 177.6 | 177.4 | -92.9 | 0 | 0 | 0 | 112 | Y16 V17 T22 G23 F24 L59 A62 | Y16-F20 WeakPolarHBondContact O-CB 3.47Å; Y16-F20 PolarHBondContact O-N 3.41Å; V17-F20 PolarHBondContact O-N 3.36Å; F20-T22 PolarHBondContact O-N 3.09Å; F20-G23 PolarHBondContact O-N 2.91Å; F20-F24 WeakPolarHBondContact O-CB 3.35Å; F20-F24 PolarHBondContact O-N 3.24Å; F20-L59 HydrophobicContact CE2-CD2 4.42Å; F20-L59 HydrophobicContact CZ-CD2 4.11Å; F20-A62 HydrophobicContact CD2-CB 3.57Å; F20-A62 HydrophobicContact CE2-CB 3.51Å; F20-A62 HydrophobicContact CG-CB 4.28Å; F20-A62 HydrophobicContact CZ-CB 4.17Å |
| 21 | M | 88.9 | Confident | 85.8 | Confident | 115 Ų | 115 | 61.4 Ų | 61.4 | 57% | 0.567 | 33% | 0.329 | S | S | * | . | H | α-helix | trans | -64.3 | -40.9 | 179.9 | -67.7 | -64.2 | -99.9 | 0 | 0 | 111.6 | V17 F24 L25 | V17-M21 HydrophobicContact CG1-CG 4.07Å; V17-M21 WeakPolarHBondContact O-CB 3.42Å; V17-M21 WeakPolarHBondContact O-CG 3.34Å; V17-M21 PolarHBondContact O-N 3.22Å; M21-F24 PolarHBondContact O-N 2.84Å; M21-L25 WeakPolarHBondContact O-CB 3.27Å; M21-L25 PolarHBondContact O-N 3.27Å |
| 22 | T | 86.4 | Confident | 85 | Confident | 62 Ų | 62 | 61.7 Ų | 61.7 | 38% | 0.38 | 33% | 0.331 | S | S | . | . | H | α-helix | trans | -64.4 | -47.3 | 175.1 | -51.7 | 0 | 0 | 0 | 0 | 110.4 | G18 F20 F24 L25 T26 D76 | G18-T22 WeakPolarHBondContact O-CB 3.47Å; G18-T22 PolarHBondContact O-N 2.96Å; G18-T22 PolarHBondContact O-OG1 2.93Å; F20-T22 PolarHBondContact O-N 3.09Å; T22-F24 VanDerWaalsContact C-N 3.34Å; T22-F24 PolarHBondContact O-N 2.66Å; T22-L25 PolarHBondContact O-N 2.85Å; T22-T26 WeakPolarHBondContact O-CG2 3.41Å; T22-T26 PolarHBondContact O-N 3.43Å; T22-T26 PolarHBondContact O-OG1 2.96Å; T22-D76 HydrophobicContact CG2-CB 4.44Å |
| 23 | G | 84.7 | Confident | 84.2 | Confident | 3 Ų | 3 | 59.5 Ų | 59.5 | 3% | 0.031 | 32% | 0.318 | C | S | . | . | H | α-helix | trans | -59.7 | -41.9 | 176.3 | 0 | 0 | 0 | 0 | 0 | 113.1 | L19 F20 T26 G27 | L19-G23 PolarHBondContact O-N 3.06Å; F20-G23 PolarHBondContact O-N 2.91Å; G23-T26 WeakPolarHBondContact CA-OG1 3.32Å; G23-T26 PolarHBondContact O-N 3.12Å; G23-T26 PolarHBondContact O-OG1 3.02Å; G23-G27 PolarHBondContact O-N 2.89Å |
| 24 | F | 88.7 | Confident | 83.6 | Confident | 54 Ų | 54 | 56.1 Ų | 56.1 | 24% | 0.237 | 30% | 0.303 | C | S | . | . | H | α-helix | trans | -62.6 | -45.5 | 175.4 | -175.9 | -106.3 | 0 | 0 | 0 | 111.7 | F20 M21 T22 T26 G27 L28 F55 A62 | F20-F24 WeakPolarHBondContact O-CB 3.35Å; F20-F24 PolarHBondContact O-N 3.24Å; M21-F24 PolarHBondContact O-N 2.84Å; T22-F24 VanDerWaalsContact C-N 3.34Å; T22-F24 PolarHBondContact O-N 2.66Å; F24-T26 PolarHBondContact O-N 3.18Å; F24-G27 PolarHBondContact O-N 3.25Å; F24-L28 HydrophobicContact CD1-CD1 3.65Å; F24-L28 HydrophobicContact CD2-CD1 3.96Å; F24-L28 HydrophobicContact CE1-CD1 3.35Å; F24-L28 HydrophobicContact CE1-CD2 4.49Å; F24-L28 HydrophobicContact CE2-CD1 3.69Å; F24-L28 HydrophobicContact CG-CD1 3.95Å; F24-L28 HydrophobicContact CZ-CD1 3.38Å; F24-L28 WeakPolarHBondContact O-CD1 3.36Å; F24-L28 PolarHBondContact O-N 3Å; F24-F55 AromaticContact CE2-CD2 3.9Å; F24-F55 HydrophobicContact CE2-CD2 3.9Å; F24-F55 AromaticContact CE2-CE2 3.82Å; F24-F55 HydrophobicContact CE2-CE2 3.82Å; F24-F55 HydrophobicContact CZ-CD2 4Å; F24-F55 AromaticContact CZ-CE2 3.91Å; F24-F55 HydrophobicContact CZ-CE2 3.91Å; F24-A62 HydrophobicContact CB-CB 4.21Å |
| 25 | L | 85.8 | Confident | 82.9 | Confident | 116 Ų | 116 | 52.8 Ų | 52.8 | 61% | 0.607 | 28% | 0.281 | S | S | * | . | H | α-helix | trans | -60.6 | -44.7 | 176.2 | -177.7 | 64.7 | 0 | 0 | 0 | 111.7 | M21 T22 G27 L28 L29 | M21-L25 WeakPolarHBondContact O-CB 3.27Å; M21-L25 PolarHBondContact O-N 3.27Å; T22-L25 PolarHBondContact O-N 2.85Å; L25-G27 VanDerWaalsContact C-N 3.3Å; L25-G27 PolarHBondContact O-N 3.42Å; L25-L28 PolarHBondContact O-N 3.23Å; L25-L29 WeakPolarHBondContact O-CB 3.3Å; L25-L29 PolarHBondContact O-N 3.24Å |
| 26 | T | 84.8 | Confident | 82.1 | Confident | 6 Ų | 6 | 49.9 Ų | 49.9 | 4% | 0.037 | 27% | 0.27 | C | S | . | . | H | α-helix | trans | -62.2 | -39.3 | 176.6 | 59.2 | 0 | 0 | 0 | 0 | 111.9 | T22 G23 F24 L29 I30 D76 L79 | T22-T26 WeakPolarHBondContact O-CG2 3.41Å; T22-T26 PolarHBondContact O-N 3.43Å; T22-T26 PolarHBondContact O-OG1 2.96Å; G23-T26 WeakPolarHBondContact CA-OG1 3.32Å; G23-T26 PolarHBondContact O-N 3.12Å; G23-T26 PolarHBondContact O-OG1 3.02Å; F24-T26 PolarHBondContact O-N 3.18Å; T26-L29 PolarHBondContact O-N 3.48Å; T26-I30 WeakPolarHBondContact O-CG1 3.24Å; T26-I30 PolarHBondContact O-N 3.43Å; T26-D76 HydrophobicContact CG2-CB 3.96Å; T26-D76 WeakPolarHBondContact CG2-OD1 3.27Å; T26-L79 HydrophobicContact CG2-CD2 4.01Å; T26-L79 WeakPolarHBondContact O-CD2 3.41Å |
| 27 | G | 83.7 | Confident | 81.5 | Confident | 0 Ų | 0 | 49.1 Ų | 49.1 | 0% | 0 | 27% | 0.272 | C | S | . | . | H | α-helix | trans | -71.3 | -33.8 | 177.7 | 0 | 0 | 0 | 0 | 0 | 113.8 | G23 F24 L25 L29 I30 G31 | G23-G27 PolarHBondContact O-N 2.89Å; F24-G27 PolarHBondContact O-N 3.25Å; L25-G27 VanDerWaalsContact C-N 3.3Å; L25-G27 PolarHBondContact O-N 3.42Å; G27-L29 VanDerWaalsContact C-N 3.27Å; G27-L29 PolarHBondContact O-N 3.14Å; G27-I30 PolarHBondContact O-N 3.46Å; G27-G31 PolarHBondContact O-N 2.92Å |
| 28 | L | 84 | Confident | 80.8 | Confident | 66 Ų | 66 | 52.7 Ų | 52.7 | 35% | 0.346 | 28% | 0.278 | S | S | . | . | H | α-helix | trans | -61.5 | -39.8 | 169 | -94.5 | 83.7 | 0 | 0 | 0 | 111.7 | F24 L25 G31 V32 V54 | F24-L28 HydrophobicContact CD1-CD1 3.65Å; F24-L28 HydrophobicContact CD2-CD1 3.96Å; F24-L28 HydrophobicContact CE1-CD1 3.35Å; F24-L28 HydrophobicContact CE1-CD2 4.49Å; F24-L28 HydrophobicContact CE2-CD1 3.69Å; F24-L28 HydrophobicContact CG-CD1 3.95Å; F24-L28 HydrophobicContact CZ-CD1 3.38Å; F24-L28 WeakPolarHBondContact O-CD1 3.36Å; F24-L28 PolarHBondContact O-N 3Å; L25-L28 PolarHBondContact O-N 3.23Å; L28-G31 PolarHBondContact O-N 2.9Å; L28-V32 PolarHBondContact O-N 3.42Å; L28-V54 HydrophobicContact CG-CG1 4.09Å |
| 29 | L | 80.1 | Confident | 80 | Confident | 68 Ų | 68 | 54.5 Ų | 54.5 | 36% | 0.356 | 29% | 0.285 | S | S | . | . | H | α-helix | trans | -72.8 | -32.2 | -177.6 | -165.9 | 69.7 | 0 | 0 | 0 | 112 | L25 T26 G27 P33 L79 W134 | L25-L29 WeakPolarHBondContact O-CB 3.3Å; L25-L29 PolarHBondContact O-N 3.24Å; T26-L29 PolarHBondContact O-N 3.48Å; G27-L29 VanDerWaalsContact C-N 3.27Å; G27-L29 PolarHBondContact O-N 3.14Å; L29-P33 WeakPolarHBondContact O-CD 3.44Å; L29-L79 HydrophobicContact CB-CD2 3.98Å; L29-L79 HydrophobicContact CD2-CD2 3.78Å; L29-L79 HydrophobicContact CD2-CG 3.86Å; L29-L79 HydrophobicContact CG-CD2 4.23Å; L29-L79 HydrophobicContact CG-CG 4.48Å; L29-W134 HydrophobicContact CD1-CH2 4.26Å; L29-W134 HydrophobicContact CD1-CZ2 4.31Å; L29-W134 HydrophobicContact CG-CH2 4.34Å; L29-W134 HydrophobicContact CG-CZ2 3.99Å; L29-W134 WeakPolarHBondContact O-CH2 3.42Å |
| 30 | I | 81.3 | Confident | 79.4 | Confident | 33 Ų | 33 | 56.2 Ų | 56.2 | 17% | 0.169 | 29% | 0.294 | C | S | . | . | H | α-helix | trans | -75.7 | -28.2 | 170.3 | -68 | 162.8 | 0 | 0 | 0 | 111.7 | T26 G27 V32 P33 S34 L61 L79 F138 | T26-I30 WeakPolarHBondContact O-CG1 3.24Å; T26-I30 PolarHBondContact O-N 3.43Å; G27-I30 PolarHBondContact O-N 3.46Å; I30-V32 VanDerWaalsContact C-N 3.27Å; I30-V32 PolarHBondContact O-N 2.78Å; I30-P33 WeakPolarHBondContact O-CD 3.42Å; I30-P33 WeakPolarHBondContact O-CG 3.36Å; I30-S34 WeakPolarHBondContact O-CB 3.21Å; I30-S34 PolarHBondContact O-N 3.5Å; I30-L61 HydrophobicContact CB-CD1 4.43Å; I30-L61 HydrophobicContact CD1-CD1 3.67Å; I30-L79 HydrophobicContact CD1-CD1 4.23Å; I30-L79 HydrophobicContact CD1-CD2 4.07Å; I30-L79 HydrophobicContact CG1-CD1 3.61Å; I30-L79 HydrophobicContact CG1-CD2 3.9Å; I30-L79 HydrophobicContact CG1-CG 4.42Å; I30-F138 HydrophobicContact CD1-CE1 4.25Å; I30-F138 HydrophobicContact CD1-CE2 3.94Å; I30-F138 HydrophobicContact CD1-CZ 3.56Å; I30-F138 HydrophobicContact CG1-CE2 4.46Å; I30-F138 HydrophobicContact CG1-CZ 4.3Å |
| 31 | G | 80 | Confident | 78.6 | Confident | 0 Ų | 0 | 60.5 Ų | 60.5 | 0% | 0 | 31% | 0.312 | C | S | . | . | H | α-helix | trans | -60 | -34.6 | 177.4 | 0 | 0 | 0 | 0 | 0 | 113.6 | G27 L28 S34 M35 E57 | G27-G31 PolarHBondContact O-N 2.92Å; L28-G31 PolarHBondContact O-N 2.9Å; G31-S34 PolarHBondContact O-N 3.32Å; G31-M35 WeakPolarHBondContact O-CB 3.09Å; G31-M35 WeakPolarHBondContact O-CG 3.26Å; G31-M35 PolarHBondContact O-N 3.06Å; G31-E57 VanDerWaalsContact CA-OE2 3.26Å; G31-E57 WeakPolarHBondContact CA-OE2 3.21Å |
| 32 | V | 72.3 | Confident | 77.7 | Confident | 76 Ų | 76 | 62 Ų | 62 | 46% | 0.461 | 32% | 0.316 | S | S | . | . | H | α-helix | trans | -60.6 | -58 | 176.8 | 177.9 | 0 | 0 | 0 | 0 | 111.8 | L28 I30 S34 M35 L36 W134 | L28-V32 PolarHBondContact O-N 3.42Å; I30-V32 VanDerWaalsContact C-N 3.27Å; I30-V32 PolarHBondContact O-N 2.78Å; V32-S34 VanDerWaalsContact C-N 3.32Å; V32-S34 PolarHBondContact O-N 2.94Å; V32-M35 WeakPolarHBondContact O-CB 3.37Å; V32-M35 PolarHBondContact O-N 2.94Å; V32-L36 HydrophobicContact CG1-CD1 4.06Å; V32-L36 WeakPolarHBondContact O-CD1 3.37Å; V32-L36 PolarHBondContact O-N 3.5Å; V32-L36 VanDerWaalsContact O-N 3.11Å; V32-W134 HydrophobicContact CB-CH2 4.47Å; V32-W134 HydrophobicContact CB-CZ3 4.41Å; V32-W134 HydrophobicContact CG1-CZ3 4.25Å |
| 33 | P | 73.1 | Confident | 76.8 | Confident | 20 Ų | 20 | 65 Ų | 65 | 13% | 0.13 | 34% | 0.336 | C | S | . | . | H | α-helix | trans | -65.4 | -32.4 | 177.3 | 22.6 | -30.9 | 0 | 0 | 0 | 113 | L29 I30 L36 L37 W134 | L29-P33 WeakPolarHBondContact O-CD 3.44Å; I30-P33 WeakPolarHBondContact O-CD 3.42Å; I30-P33 WeakPolarHBondContact O-CG 3.36Å; P33-L36 PolarHBondContact O-N 3.48Å; P33-L37 PolarHBondContact O-N 2.92Å; P33-W134 HydrophobicContact CB-CD2 4.41Å; P33-W134 HydrophobicContact CB-CE3 4.07Å; P33-W134 HydrophobicContact CB-CZ3 4.43Å; P33-W134 HydrophobicContact CG-CD2 4.13Å; P33-W134 HydrophobicContact CG-CE3 3.99Å; P33-W134 HydrophobicContact CG-CH2 4.25Å; P33-W134 HydrophobicContact CG-CZ2 4.39Å; P33-W134 HydrophobicContact CG-CZ3 4.06Å |
| 34 | S | 76.8 | Confident | 75.9 | Confident | 35 Ų | 35 | 67.3 Ų | 67.3 | 25% | 0.245 | 35% | 0.348 | C | S | . | . | H | α-helix | trans | -59.4 | -45.6 | 172.8 | -176.3 | 0 | 0 | 0 | 0 | 111.6 | I30 G31 V32 L36 L37 W38 E57 | I30-S34 WeakPolarHBondContact O-CB 3.21Å; I30-S34 PolarHBondContact O-N 3.5Å; G31-S34 PolarHBondContact O-N 3.32Å; V32-S34 VanDerWaalsContact C-N 3.32Å; V32-S34 PolarHBondContact O-N 2.94Å; S34-L36 VanDerWaalsContact C-N 3.34Å; S34-L36 PolarHBondContact O-N 3.13Å; S34-L37 WeakPolarHBondContact O-CB 3.45Å; S34-L37 PolarHBondContact O-N 3.38Å; S34-W38 PolarHBondContact O-N 2.62Å; S34-E57 WeakPolarHBondContact CB-OE1 3.31Å; S34-E57 WeakPolarHBondContact CB-OE2 3.37Å; S34-E57 PolarHBondContact OG-OE1 2.78Å; S34-E57 PolarHBondContact OG-OE2 2.76Å |
| 35 | M | 74.2 | Confident | 74.8 | Confident | 27 Ų | 27 | 70.1 Ų | 70.1 | 13% | 0.133 | 38% | 0.381 | C | S | . | . | H | α-helix | trans | -59.8 | -42.4 | 174.8 | -77.5 | -67.5 | 115.6 | 0 | 0 | 112.4 | G31 V32 L37 W38 S39 T50 V53 V54 | G31-M35 WeakPolarHBondContact O-CB 3.09Å; G31-M35 WeakPolarHBondContact O-CG 3.26Å; G31-M35 PolarHBondContact O-N 3.06Å; V32-M35 WeakPolarHBondContact O-CB 3.37Å; V32-M35 PolarHBondContact O-N 2.94Å; M35-L37 VanDerWaalsContact C-N 3.33Å; M35-L37 PolarHBondContact O-N 2.81Å; M35-W38 PolarHBondContact O-N 3.35Å; M35-S39 PolarHBondContact O-N 2.91Å; M35-T50 HydrophobicContact SD-CG2 3.73Å; M35-V53 HydrophobicContact CE-CB 3.31Å; M35-V53 HydrophobicContact CE-CG1 3.12Å; M35-V53 HydrophobicContact CE-CG2 4.21Å; M35-V54 HydrophobicContact CE-CG2 4.28Å; M35-V54 HydrophobicContact CG-CG2 3.7Å; M35-V54 HydrophobicContact SD-CG2 4.35Å |
| 36 | L | 69 | Low | 74.4 | Confident | 59 Ų | 59 | 66.7 Ų | 66.7 | 31% | 0.309 | 37% | 0.366 | S | S | . | . | H | α-helix | trans | -63.7 | -41.3 | 177.4 | -87.7 | 77.3 | 0 | 0 | 0 | 111.2 | V32 P33 S34 W38 S39 I40 V131 | V32-L36 HydrophobicContact CG1-CD1 4.06Å; V32-L36 WeakPolarHBondContact O-CD1 3.37Å; V32-L36 PolarHBondContact O-N 3.5Å; V32-L36 VanDerWaalsContact O-N 3.11Å; P33-L36 PolarHBondContact O-N 3.48Å; S34-L36 VanDerWaalsContact C-N 3.34Å; S34-L36 PolarHBondContact O-N 3.13Å; L36-W38 VanDerWaalsContact C-N 3.33Å; L36-W38 PolarHBondContact O-N 3.31Å; L36-S39 WeakPolarHBondContact O-CB 3.34Å; L36-S39 PolarHBondContact O-N 3.36Å; L36-I40 WeakPolarHBondContact O-CG1 3.16Å; L36-I40 PolarHBondContact O-N 3.5Å; L36-V131 HydrophobicContact CB-CG1 4Å; L36-V131 HydrophobicContact CD2-CB 4.24Å; L36-V131 HydrophobicContact CD2-CG1 3.62Å; L36-V131 HydrophobicContact CD2-CG2 3.56Å; L36-V131 HydrophobicContact CG-CG1 4.45Å |
| 37 | L | 73.3 | Confident | 74.2 | Confident | 84 Ų | 84 | 71.6 Ų | 71.6 | 44% | 0.44 | 40% | 0.396 | S | S | . | . | H | α-helix | trans | -63.6 | -39.4 | 176.3 | -169 | 72.7 | 0 | 0 | 0 | 111.7 | P33 S34 M35 I40 F41 M132 | P33-L37 PolarHBondContact O-N 2.92Å; S34-L37 WeakPolarHBondContact O-CB 3.45Å; S34-L37 PolarHBondContact O-N 3.38Å; M35-L37 VanDerWaalsContact C-N 3.33Å; M35-L37 PolarHBondContact O-N 2.81Å; L37-I40 HydrophobicContact CD1-CD1 3.78Å; L37-I40 WeakPolarHBondContact O-CB 3.12Å; L37-I40 VanDerWaalsContact O-CG1 3.24Å; L37-I40 WeakPolarHBondContact O-CG1 3.46Å; L37-I40 PolarHBondContact O-N 3.21Å; L37-F41 WeakPolarHBondContact O-CD2 3.44Å; L37-M132 HydrophobicContact CD1-CE 4.08Å |
| 38 | W | 73.8 | Confident | 74.2 | Confident | 145 Ų | 145 | 81.4 Ų | 81.4 | 55% | 0.549 | 43% | 0.433 | S | S | . | . | H | α-helix | trans | -67.7 | -37.7 | 176.5 | -162.7 | -73.1 | 0 | 0 | 0 | 112.4 | S34 M35 L36 I40 F41 K42 I44 | S34-W38 PolarHBondContact O-N 2.62Å; M35-W38 PolarHBondContact O-N 3.35Å; L36-W38 VanDerWaalsContact C-N 3.33Å; L36-W38 PolarHBondContact O-N 3.31Å; W38-I40 PolarHBondContact O-N 3.39Å; W38-I40 VanDerWaalsContact O-N 3.11Å; W38-F41 PolarHBondContact O-N 2.87Å; W38-K42 PolarHBondContact O-N 3.49Å; W38-I44 HydrophobicContact CB-CD1 4.49Å; W38-I44 HydrophobicContact CG-CD1 3.84Å |
| 39 | S | 69.1 | Low | 74.2 | Confident | 74 Ų | 74 | 82.2 Ų | 82.2 | 52% | 0.517 | 44% | 0.437 | S | S | . | . | H | α-helix | trans | -60.6 | -20.5 | 177.1 | -169.2 | 0 | 0 | 0 | 0 | 113 | M35 L36 | M35-S39 PolarHBondContact O-N 2.91Å; L36-S39 WeakPolarHBondContact O-CB 3.34Å; L36-S39 PolarHBondContact O-N 3.36Å |
| 40 | I | 69.3 | Low | 74.3 | Confident | 67 Ų | 67 | 81.2 Ų | 81.2 | 34% | 0.344 | 43% | 0.434 | S | S | . | . | H | α-helix | trans | -67.8 | -42.2 | 173 | -44.6 | -176.2 | 0 | 0 | 0 | 111 | L36 L37 W38 W128 M132 | L36-I40 WeakPolarHBondContact O-CG1 3.16Å; L36-I40 PolarHBondContact O-N 3.5Å; L37-I40 HydrophobicContact CD1-CD1 3.78Å; L37-I40 WeakPolarHBondContact O-CB 3.12Å; L37-I40 VanDerWaalsContact O-CG1 3.24Å; L37-I40 WeakPolarHBondContact O-CG1 3.46Å; L37-I40 PolarHBondContact O-N 3.21Å; W38-I40 PolarHBondContact O-N 3.39Å; W38-I40 VanDerWaalsContact O-N 3.11Å; I40-W128 HydrophobicContact CB-CH2 4.2Å; I40-W128 HydrophobicContact CB-CZ3 4.43Å; I40-W128 HydrophobicContact CD1-CE3 4.35Å; I40-W128 HydrophobicContact CD1-CH2 4Å; I40-W128 HydrophobicContact CD1-CZ3 3.36Å; I40-W128 HydrophobicContact CG1-CH2 3.6Å; I40-W128 HydrophobicContact CG1-CZ3 3.47Å; I40-W128 VanDerWaalsContact CG1-CZ3 3.47Å; I40-W128 HydrophobicContact CG2-CH2 3.99Å; I40-W128 HydrophobicContact CG2-CZ3 4.29Å; I40-M132 HydrophobicContact CD1-CE 3.44Å; I40-M132 VanDerWaalsContact CD1-CE 3.44Å |
| 41 | F | 71.8 | Confident | 74.5 | Confident | 160 Ų | 160 | 83.4 Ų | 83.4 | 70% | 0.702 | 45% | 0.448 | S | S | * | . | H | α-helix | trans | -83.6 | -37.8 | -170.3 | -72.8 | -75.5 | 0 | 0 | 0 | 112.4 | L37 W38 | L37-F41 WeakPolarHBondContact O-CD2 3.44Å; W38-F41 PolarHBondContact O-N 2.87Å |
| 42 | K | 70.3 | Confident | 74.9 | Confident | 146 Ų | 146 | 87.9 Ų | 87.9 | 64% | 0.635 | 48% | 0.476 | S | S | * | . | trans | -149 | 133.9 | 175.2 | -66.1 | -164.3 | 177.9 | -164.7 | 0 | 110.8 | W38 I44 | W38-K42 PolarHBondContact O-N 3.49Å; K42-I44 PolarHBondContact O-N 2.91Å | ||
| 43 | P | 66.3 | Low | 75.5 | Confident | 125 Ų | 125 | 86.3 Ų | 86.3 | 81% | 0.812 | 47% | 0.466 | S | S | * | . | trans | -65 | 108.6 | 167.3 | 26.9 | -31.4 | 0 | 0 | 0 | 108.7 | ||||
| 44 | I | 66.1 | Low | 76.2 | Confident | 53 Ų | 53 | 86.9 Ų | 86.9 | 27% | 0.272 | 47% | 0.469 | S | S | . | . | trans | -82.1 | 118 | 173.4 | -63.4 | 162.5 | 0 | 0 | 0 | 108.1 | W38 K42 I49 | W38-I44 HydrophobicContact CB-CD1 4.49Å; W38-I44 HydrophobicContact CG-CD1 3.84Å; K42-I44 PolarHBondContact O-N 2.91Å; I44-I49 HydrophobicContact CD1-CG2 4.32Å; I44-I49 HydrophobicContact CG2-CB 3.86Å; I44-I49 HydrophobicContact CG2-CD1 4.1Å; I44-I49 HydrophobicContact CG2-CG2 3.81Å | ||
| 45 | A | 65.5 | Low | 76.8 | Confident | 113 Ų | 113 | 90.4 Ų | 90.4 | 93% | 0.934 | 48% | 0.48 | S | S | * | . | trans | -85.4 | -1.7 | -175.4 | 0 | 0 | 0 | 0 | 0 | 115 | ||||
| 46 | S | 78.7 | Confident | 77.6 | Confident | 43 Ų | 43 | 91.2 Ų | 91.2 | 30% | 0.301 | 49% | 0.489 | S | S | . | . | trans | -126.3 | 129.2 | -174.7 | 68.1 | 0 | 0 | 0 | 0 | 114.1 | W48 I49 | S46-W48 PolarHBondContact O-N 3.47Å; S46-I49 PolarHBondContact O-N 3.46Å; S46-I49 WeakPolarHBondContact OG-CD1 3.44Å; S46-I49 WeakPolarHBondContact OG-CG1 3.23Å | ||
| 47 | V | 79.7 | Confident | 78.5 | Confident | 109 Ų | 109 | 90.2 Ų | 90.2 | 66% | 0.661 | 48% | 0.482 | S | S | * | . | H | α-helix | trans | -63.1 | -31.4 | 177.5 | -177.3 | 0 | 0 | 0 | 0 | 111.5 | I49 T50 V51 | V47-I49 VanDerWaalsContact C-N 3.33Å; V47-I49 PolarHBondContact O-N 3.35Å; V47-T50 PolarHBondContact O-N 2.91Å; V47-T50 PolarHBondContact O-OG1 3.48Å; V47-V51 WeakPolarHBondContact O-CG2 3.37Å; V47-V51 PolarHBondContact O-N 3.31Å; V47-V51 VanDerWaalsContact O-N 3.11Å |
| 48 | W | 84.3 | Confident | 79.2 | Confident | 206 Ų | 206 | 86.2 Ų | 86.2 | 78% | 0.78 | 46% | 0.461 | S | S | * | . | H | α-helix | trans | -66.3 | -35.3 | 178.2 | -65.5 | 104 | 0 | 0 | 0 | 113 | S46 T50 V51 V52 | S46-W48 PolarHBondContact O-N 3.47Å; W48-T50 VanDerWaalsContact C-N 3.33Å; W48-V51 PolarHBondContact O-N 2.76Å; W48-V52 VanDerWaalsContact O-CG2 3.3Å; W48-V52 WeakPolarHBondContact O-CG2 3.31Å; W48-V52 PolarHBondContact O-N 2.97Å |
| 49 | I | 82.5 | Confident | 80 | Confident | 83 Ų | 83 | 82.3 Ų | 82.3 | 43% | 0.426 | 45% | 0.451 | S | S | . | . | H | α-helix | trans | -64.9 | -42 | 176.9 | -70 | 173.6 | 0 | 0 | 0 | 109.7 | I44 S46 V47 V51 V52 V53 | I44-I49 HydrophobicContact CD1-CG2 4.32Å; I44-I49 HydrophobicContact CG2-CB 3.86Å; I44-I49 HydrophobicContact CG2-CD1 4.1Å; I44-I49 HydrophobicContact CG2-CG2 3.81Å; S46-I49 PolarHBondContact O-N 3.46Å; S46-I49 WeakPolarHBondContact OG-CD1 3.44Å; S46-I49 WeakPolarHBondContact OG-CG1 3.23Å; V47-I49 VanDerWaalsContact C-N 3.33Å; V47-I49 PolarHBondContact O-N 3.35Å; I49-V51 PolarHBondContact O-N 2.81Å; I49-V52 PolarHBondContact O-N 2.83Å; I49-V53 HydrophobicContact CG2-CG2 4.28Å; I49-V53 VanDerWaalsContact O-CG2 3.25Å; I49-V53 WeakPolarHBondContact O-CG2 3.24Å; I49-V53 PolarHBondContact O-N 2.78Å |
| 50 | T | 83.2 | Confident | 81 | Confident | 48 Ų | 48 | 84.3 Ų | 84.3 | 29% | 0.294 | 46% | 0.455 | S | S | . | . | H | α-helix | trans | -64.4 | -42.3 | 178.3 | 64.3 | 0 | 0 | 0 | 0 | 111.3 | M35 V47 W48 V52 V53 V54 | M35-T50 HydrophobicContact SD-CG2 3.73Å; V47-T50 PolarHBondContact O-N 2.91Å; V47-T50 PolarHBondContact O-OG1 3.48Å; W48-T50 VanDerWaalsContact C-N 3.33Å; T50-V52 PolarHBondContact O-N 3.46Å; T50-V53 PolarHBondContact O-N 3.42Å; T50-V54 WeakPolarHBondContact O-CB 3.27Å; T50-V54 VanDerWaalsContact O-CG2 3.28Å; T50-V54 WeakPolarHBondContact O-CG2 3.3Å; T50-V54 PolarHBondContact O-N 3.34Å |
| 51 | V | 84.8 | Confident | 81.6 | Confident | 78 Ų | 78 | 82.7 Ų | 82.7 | 47% | 0.473 | 45% | 0.447 | S | S | . | . | H | α-helix | trans | -60.5 | -47.3 | 175.8 | 174.5 | 0 | 0 | 0 | 0 | 111.5 | V47 W48 I49 V53 F55 | V47-V51 WeakPolarHBondContact O-CG2 3.37Å; V47-V51 PolarHBondContact O-N 3.31Å; V47-V51 VanDerWaalsContact O-N 3.11Å; W48-V51 PolarHBondContact O-N 2.76Å; I49-V51 PolarHBondContact O-N 2.81Å; V51-V53 VanDerWaalsContact C-N 3.34Å; V51-V53 PolarHBondContact O-N 2.79Å; V51-F55 WeakPolarHBondContact O-CB 3.19Å; V51-F55 PolarHBondContact O-N 3.17Å |
| 52 | V | 88.4 | Confident | 82.3 | Confident | 95 Ų | 95 | 75.1 Ų | 75.1 | 58% | 0.576 | 41% | 0.413 | S | S | * | . | H | α-helix | trans | -63.7 | -40.2 | -179.2 | 169.9 | 0 | 0 | 0 | 0 | 111.6 | W48 I49 T50 S56 | W48-V52 VanDerWaalsContact O-CG2 3.3Å; W48-V52 WeakPolarHBondContact O-CG2 3.31Å; W48-V52 PolarHBondContact O-N 2.97Å; I49-V52 PolarHBondContact O-N 2.83Å; T50-V52 PolarHBondContact O-N 3.46Å; V52-S56 WeakPolarHBondContact O-CB 3.27Å; V52-S56 PolarHBondContact O-N 3.15Å; V52-S56 PolarHBondContact O-OG 3.12Å |
| 53 | V | 86.1 | Confident | 83.1 | Confident | 42 Ų | 42 | 71.9 Ų | 71.9 | 26% | 0.255 | 41% | 0.406 | S | S | . | . | H | α-helix | trans | -73.2 | -44.4 | -179.5 | 178.2 | 0 | 0 | 0 | 0 | 111.5 | M35 I49 T50 V51 F55 S56 E57 | M35-V53 HydrophobicContact CE-CB 3.31Å; M35-V53 HydrophobicContact CE-CG1 3.12Å; M35-V53 HydrophobicContact CE-CG2 4.21Å; I49-V53 HydrophobicContact CG2-CG2 4.28Å; I49-V53 VanDerWaalsContact O-CG2 3.25Å; I49-V53 WeakPolarHBondContact O-CG2 3.24Å; I49-V53 PolarHBondContact O-N 2.78Å; T50-V53 PolarHBondContact O-N 3.42Å; V51-V53 VanDerWaalsContact C-N 3.34Å; V51-V53 PolarHBondContact O-N 2.79Å; V53-F55 VanDerWaalsContact C-N 3.25Å; V53-F55 PolarHBondContact O-N 3.3Å; V53-S56 PolarHBondContact O-N 3.49Å; V53-S56 PolarHBondContact O-OG 3.49Å; V53-E57 WeakPolarHBondContact O-CG 3.43Å; V53-E57 PolarHBondContact O-N 3.28Å |
| 54 | V | 86.1 | Confident | 83.9 | Confident | 32 Ų | 32 | 67.2 Ų | 67.2 | 19% | 0.194 | 38% | 0.378 | C | S | . | . | H | α-helix | trans | -61.8 | -38.9 | 175.7 | 172.6 | 0 | 0 | 0 | 0 | 110.7 | L28 M35 T50 G58 | L28-V54 HydrophobicContact CG-CG1 4.09Å; M35-V54 HydrophobicContact CE-CG2 4.28Å; M35-V54 HydrophobicContact CG-CG2 3.7Å; M35-V54 HydrophobicContact SD-CG2 4.35Å; T50-V54 WeakPolarHBondContact O-CB 3.27Å; T50-V54 VanDerWaalsContact O-CG2 3.28Å; T50-V54 WeakPolarHBondContact O-CG2 3.3Å; T50-V54 PolarHBondContact O-N 3.34Å; V54-G58 PolarHBondContact O-N 2.86Å |
| 55 | F | 90.5 | Very high | 84.3 | Confident | 109 Ų | 109 | 64.7 Ų | 64.7 | 48% | 0.478 | 37% | 0.365 | S | S | . | . | H | α-helix | trans | -67.6 | -39.6 | 176.8 | -168.6 | -104.1 | 0 | 0 | 0 | 112.4 | F24 V51 V53 G58 L59 | F24-F55 AromaticContact CE2-CD2 3.9Å; F24-F55 HydrophobicContact CE2-CD2 3.9Å; F24-F55 AromaticContact CE2-CE2 3.82Å; F24-F55 HydrophobicContact CE2-CE2 3.82Å; F24-F55 HydrophobicContact CZ-CD2 4Å; F24-F55 AromaticContact CZ-CE2 3.91Å; F24-F55 HydrophobicContact CZ-CE2 3.91Å; V51-F55 WeakPolarHBondContact O-CB 3.19Å; V51-F55 PolarHBondContact O-N 3.17Å; V53-F55 VanDerWaalsContact C-N 3.25Å; V53-F55 PolarHBondContact O-N 3.3Å; F55-G58 PolarHBondContact O-N 3.04Å; F55-L59 HydrophobicContact CD1-CD1 3.74Å; F55-L59 HydrophobicContact CD1-CG 4.24Å; F55-L59 HydrophobicContact CE1-CD1 3.37Å; F55-L59 HydrophobicContact CE1-CG 3.98Å; F55-L59 HydrophobicContact CZ-CD1 4.08Å; F55-L59 HydrophobicContact CZ-CD2 4.47Å; F55-L59 HydrophobicContact CZ-CG 4.3Å; F55-L59 WeakPolarHBondContact O-CG 3.46Å; F55-L59 PolarHBondContact O-N 3.05Å |
| 56 | S | 90.3 | Very high | 84.9 | Confident | 45 Ų | 45 | 62.9 Ų | 62.9 | 32% | 0.315 | 34% | 0.339 | S | S | . | . | H | α-helix | trans | -67.6 | -42 | 178.1 | 72.3 | 0 | 0 | 0 | 0 | 111.7 | V52 V53 G58 L59 I60 | V52-S56 WeakPolarHBondContact O-CB 3.27Å; V52-S56 PolarHBondContact O-N 3.15Å; V52-S56 PolarHBondContact O-OG 3.12Å; V53-S56 PolarHBondContact O-N 3.49Å; V53-S56 PolarHBondContact O-OG 3.49Å; S56-G58 VanDerWaalsContact C-N 3.34Å; S56-G58 PolarHBondContact O-N 3.35Å; S56-L59 PolarHBondContact O-N 3.07Å; S56-I60 WeakPolarHBondContact O-CB 3.45Å; S56-I60 WeakPolarHBondContact O-CD1 3.21Å; S56-I60 WeakPolarHBondContact O-CG1 3.36Å; S56-I60 PolarHBondContact O-N 2.73Å |
| 57 | E | 88.5 | Confident | 85 | Confident | 37 Ų | 37 | 70.5 Ų | 70.5 | 17% | 0.173 | 36% | 0.361 | C | S | . | . | H | α-helix | trans | -62.4 | -42 | 173.9 | -70.7 | -179.9 | -165.5 | 0 | 0 | 111.7 | G31 S34 V53 L59 I60 L61 | G31-E57 VanDerWaalsContact CA-OE2 3.26Å; G31-E57 WeakPolarHBondContact CA-OE2 3.21Å; S34-E57 WeakPolarHBondContact CB-OE1 3.31Å; S34-E57 WeakPolarHBondContact CB-OE2 3.37Å; S34-E57 PolarHBondContact OG-OE1 2.78Å; S34-E57 PolarHBondContact OG-OE2 2.76Å; V53-E57 WeakPolarHBondContact O-CG 3.43Å; V53-E57 PolarHBondContact O-N 3.28Å; E57-L59 PolarHBondContact O-N 2.78Å; E57-I60 PolarHBondContact O-N 3.26Å; E57-L61 WeakPolarHBondContact O-CB 3.41Å; E57-L61 PolarHBondContact O-N 2.85Å |
| 58 | G | 87.7 | Confident | 84.8 | Confident | 0 Ų | 0 | 73.2 Ų | 73.2 | 0% | 0 | 36% | 0.36 | C | S | . | . | H | α-helix | trans | -54.9 | -48.2 | 170.9 | 0 | 0 | 0 | 0 | 0 | 113 | V54 F55 S56 A62 | V54-G58 PolarHBondContact O-N 2.86Å; F55-G58 PolarHBondContact O-N 3.04Å; S56-G58 VanDerWaalsContact C-N 3.34Å; S56-G58 PolarHBondContact O-N 3.35Å; G58-A62 WeakPolarHBondContact O-CB 3.2Å; G58-A62 PolarHBondContact O-N 3.44Å |
| 59 | L | 90.4 | Very high | 84.3 | Confident | 64 Ų | 64 | 67.8 Ų | 67.8 | 34% | 0.335 | 34% | 0.343 | S | S | . | . | H | α-helix | trans | -70.2 | -41.3 | 179.4 | -75 | 179 | 0 | 0 | 0 | 113.1 | F20 F55 S56 E57 L61 A62 V63 | F20-L59 HydrophobicContact CE2-CD2 4.42Å; F20-L59 HydrophobicContact CZ-CD2 4.11Å; F55-L59 HydrophobicContact CD1-CD1 3.74Å; F55-L59 HydrophobicContact CD1-CG 4.24Å; F55-L59 HydrophobicContact CE1-CD1 3.37Å; F55-L59 HydrophobicContact CE1-CG 3.98Å; F55-L59 HydrophobicContact CZ-CD1 4.08Å; F55-L59 HydrophobicContact CZ-CD2 4.47Å; F55-L59 HydrophobicContact CZ-CG 4.3Å; F55-L59 WeakPolarHBondContact O-CG 3.46Å; F55-L59 PolarHBondContact O-N 3.05Å; S56-L59 PolarHBondContact O-N 3.07Å; E57-L59 PolarHBondContact O-N 2.78Å; L59-L61 VanDerWaalsContact C-N 3.32Å; L59-L61 PolarHBondContact O-N 3.35Å; L59-A62 PolarHBondContact O-N 3.14Å; L59-V63 WeakPolarHBondContact O-CB 2.92Å; L59-V63 VanDerWaalsContact O-CG2 3.29Å; L59-V63 WeakPolarHBondContact O-CG2 3.14Å; L59-V63 PolarHBondContact O-N 3.02Å |
| 60 | I | 89.4 | Confident | 83.7 | Confident | 115 Ų | 115 | 74.2 Ų | 74.2 | 59% | 0.59 | 36% | 0.362 | S | S | * | . | H | α-helix | trans | -61.1 | -46.3 | 178.6 | -70.1 | 160 | 0 | 0 | 0 | 109.5 | S56 E57 V63 A64 | S56-I60 WeakPolarHBondContact O-CB 3.45Å; S56-I60 WeakPolarHBondContact O-CD1 3.21Å; S56-I60 WeakPolarHBondContact O-CG1 3.36Å; S56-I60 PolarHBondContact O-N 2.73Å; E57-I60 PolarHBondContact O-N 3.26Å; I60-V63 PolarHBondContact O-N 2.92Å; I60-A64 VanDerWaalsContact O-CB 3.29Å; I60-A64 WeakPolarHBondContact O-CB 3.4Å; I60-A64 PolarHBondContact O-N 3.44Å |
| 61 | L | 82.5 | Confident | 83.1 | Confident | 34 Ų | 34 | 75.1 Ų | 75.1 | 18% | 0.178 | 37% | 0.365 | C | S | . | . | H | α-helix | trans | -65.1 | -48.7 | 173.6 | -77.5 | 164.5 | 0 | 0 | 0 | 110.3 | I30 E57 L59 V63 A64 G65 M72 L75 | I30-L61 HydrophobicContact CB-CD1 4.43Å; I30-L61 HydrophobicContact CD1-CD1 3.67Å; E57-L61 WeakPolarHBondContact O-CB 3.41Å; E57-L61 PolarHBondContact O-N 2.85Å; L59-L61 VanDerWaalsContact C-N 3.32Å; L59-L61 PolarHBondContact O-N 3.35Å; L61-V63 VanDerWaalsContact C-N 3.26Å; L61-V63 PolarHBondContact O-N 2.85Å; L61-V63 VanDerWaalsContact O-N 3.14Å; L61-A64 CarbonylContact O-C 3.56Å; L61-A64 PolarHBondContact O-N 3.3Å; L61-A64 VanDerWaalsContact O-N 3.1Å; L61-G65 PolarHBondContact O-N 3.32Å; L61-M72 HydrophobicContact CB-CE 4.26Å; L61-M72 HydrophobicContact CD2-CE 4.1Å; L61-M72 WeakPolarHBondContact O-CE 3.33Å; L61-L75 HydrophobicContact CD2-CD1 4.38Å |
| 62 | A | 87.2 | Confident | 82.5 | Confident | 0 Ų | 0 | 72 Ų | 72 | 0% | 0 | 35% | 0.346 | C | S | . | . | H | α-helix | trans | -55.5 | -38.3 | 178.2 | 0 | 0 | 0 | 0 | 0 | 113.8 | F20 F24 G58 L59 G65 | F20-A62 HydrophobicContact CD2-CB 3.57Å; F20-A62 HydrophobicContact CE2-CB 3.51Å; F20-A62 HydrophobicContact CG-CB 4.28Å; F20-A62 HydrophobicContact CZ-CB 4.17Å; F24-A62 HydrophobicContact CB-CB 4.21Å; G58-A62 WeakPolarHBondContact O-CB 3.2Å; G58-A62 PolarHBondContact O-N 3.44Å; L59-A62 PolarHBondContact O-N 3.14Å; A62-G65 VanDerWaalsContact O-CA 3.27Å; A62-G65 WeakPolarHBondContact O-CA 3.27Å; A62-G65 PolarHBondContact O-N 3.41Å |
| 63 | V | 86.9 | Confident | 82 | Confident | 78 Ų | 78 | 72.7 Ų | 72.7 | 47% | 0.473 | 35% | 0.345 | S | S | . | . | H | α-helix | trans | -76 | -38.7 | 177 | 174.5 | 0 | 0 | 0 | 0 | 112.1 | L59 I60 L61 G65 L66 R67 | L59-V63 WeakPolarHBondContact O-CB 2.92Å; L59-V63 VanDerWaalsContact O-CG2 3.29Å; L59-V63 WeakPolarHBondContact O-CG2 3.14Å; L59-V63 PolarHBondContact O-N 3.02Å; I60-V63 PolarHBondContact O-N 2.92Å; L61-V63 VanDerWaalsContact C-N 3.26Å; L61-V63 PolarHBondContact O-N 2.85Å; L61-V63 VanDerWaalsContact O-N 3.14Å; V63-G65 PolarHBondContact O-N 3.33Å; V63-L66 WeakPolarHBondContact O-CB 3.45Å; V63-L66 PolarHBondContact O-N 2.87Å; V63-R67 PolarHBondContact O-N 3.31Å |
| 64 | A | 83.3 | Confident | 81.7 | Confident | 27 Ų | 27 | 72.6 Ų | 72.6 | 22% | 0.223 | 34% | 0.342 | C | S | . | . | H | α-helix | trans | -58.6 | -30.9 | 169 | 0 | 0 | 0 | 0 | 0 | 111.2 | I60 L61 L66 R67 W68 M72 | I60-A64 VanDerWaalsContact O-CB 3.29Å; I60-A64 WeakPolarHBondContact O-CB 3.4Å; I60-A64 PolarHBondContact O-N 3.44Å; L61-A64 CarbonylContact O-C 3.56Å; L61-A64 PolarHBondContact O-N 3.3Å; L61-A64 VanDerWaalsContact O-N 3.1Å; A64-L66 VanDerWaalsContact C-N 3.28Å; A64-L66 PolarHBondContact O-N 3.01Å; A64-R67 PolarHBondContact O-N 3.37Å; A64-R67 VanDerWaalsContact O-N 3.13Å; A64-W68 PolarHBondContact O-N 3.32Å; A64-M72 HydrophobicContact CB-CE 3.82Å |
| 65 | G | 74.6 | Confident | 81.5 | Confident | 1 Ų | 1 | 72.2 Ų | 72.2 | 1% | 0.01 | 34% | 0.339 | C | S | . | . | H | α-helix | trans | -37.8 | -55.1 | 164 | 0 | 0 | 0 | 0 | 0 | 113.7 | L61 A62 V63 | L61-G65 PolarHBondContact O-N 3.32Å; A62-G65 VanDerWaalsContact O-CA 3.27Å; A62-G65 WeakPolarHBondContact O-CA 3.27Å; A62-G65 PolarHBondContact O-N 3.41Å; V63-G65 PolarHBondContact O-N 3.33Å |
| 66 | L | 78.2 | Confident | 81 | Confident | 75 Ų | 75 | 68.9 Ų | 68.9 | 39% | 0.393 | 33% | 0.326 | S | S | . | . | H | α-helix | trans | -76.5 | -29.6 | -173.6 | -60.4 | 170.1 | 0 | 0 | 0 | 111.9 | Y16 V63 A64 | Y16-L66 HydrophobicContact CD1-CD2 3.9Å; V63-L66 WeakPolarHBondContact O-CB 3.45Å; V63-L66 PolarHBondContact O-N 2.87Å; A64-L66 VanDerWaalsContact C-N 3.28Å; A64-L66 PolarHBondContact O-N 3.01Å |
| 67 | R | 80 | Confident | 80.7 | Confident | 202 Ų | 202 | 70.4 Ų | 70.4 | 76% | 0.762 | 33% | 0.334 | S | S | * | . | H | α-helix | trans | -84 | -39 | -177.5 | -69.5 | -68.3 | -166.8 | 148.8 | 2.6 | 113.3 | V63 A64 | V63-R67 PolarHBondContact O-N 3.31Å; A64-R67 PolarHBondContact O-N 3.37Å; A64-R67 VanDerWaalsContact O-N 3.13Å |
| 68 | W | 76 | Confident | 80.6 | Confident | 166 Ų | 166 | 68.9 Ų | 68.9 | 63% | 0.629 | 33% | 0.327 | S | S | * | . | trans | -125.7 | 74.7 | -176.8 | -76.2 | -87.3 | 0 | 0 | 0 | 111.8 | A64 R70 L71 M72 | A64-W68 PolarHBondContact O-N 3.32Å; W68-R70 PolarHBondContact O-N 3.07Å; W68-L71 HydrophobicContact CB-CB 3.71Å; W68-L71 HydrophobicContact CB-CD2 4.49Å; W68-L71 PolarHBondContact O-N 2.82Å; W68-M72 PolarHBondContact O-N 3.14Å | ||
| 69 | Q | 73.3 | Confident | 80.4 | Confident | 93 Ų | 93 | 69 Ų | 69 | 44% | 0.435 | 33% | 0.328 | S | S | . | . | H | α-helix | trans | -49.8 | -36.5 | 179.3 | -72.6 | -180 | -19.1 | 0 | 0 | 113.8 | ||
| 70 | R | 71.2 | Confident | 80.1 | Confident | 217 Ų | 217 | 70.6 Ų | 70.6 | 82% | 0.819 | 34% | 0.335 | S | S | * | . | H | α-helix | trans | -75.1 | -37.8 | 179.9 | -66.9 | -173.9 | -179.7 | 177.8 | 2 | 113.5 | W68 M72 I74 | W68-R70 PolarHBondContact O-N 3.07Å; R70-M72 PolarHBondContact O-N 2.89Å; R70-I74 WeakPolarHBondContact O-CD1 3.35Å; R70-I74 VanDerWaalsContact O-CG1 3.31Å; R70-I74 WeakPolarHBondContact O-CG1 3.32Å |
| 71 | L | 69 | Low | 79.9 | Confident | 67 Ų | 67 | 66.6 Ų | 66.6 | 35% | 0.351 | 32% | 0.323 | S | S | . | . | H | α-helix | trans | -65.8 | -29.4 | -179.9 | -169.3 | 93.7 | 0 | 0 | 0 | 110.5 | W68 I74 L75 | W68-L71 HydrophobicContact CB-CB 3.71Å; W68-L71 HydrophobicContact CB-CD2 4.49Å; W68-L71 PolarHBondContact O-N 2.82Å; L71-I74 VanDerWaalsContact O-CB 3.24Å; L71-I74 WeakPolarHBondContact O-CB 3.33Å; L71-I74 PolarHBondContact O-N 3.13Å; L71-L75 HydrophobicContact CD2-CD1 3.72Å; L71-L75 HydrophobicContact CD2-CG 4.46Å; L71-L75 HydrophobicContact CG-CD1 4.06Å; L71-L75 HydrophobicContact CG-CG 4.29Å; L71-L75 VanDerWaalsContact O-CG 3.27Å; L71-L75 WeakPolarHBondContact O-CG 3.31Å; L71-L75 PolarHBondContact O-N 3.33Å |
| 72 | M | 72.3 | Confident | 79.9 | Confident | 14 Ų | 14 | 65.1 Ų | 65.1 | 7% | 0.069 | 32% | 0.316 | C | S | . | . | H | α-helix | trans | -81.1 | -36.3 | -169.2 | -80.4 | -74.9 | -151 | 0 | 0 | 115 | L61 A64 W68 R70 I74 L75 D76 | L61-M72 HydrophobicContact CB-CE 4.26Å; L61-M72 HydrophobicContact CD2-CE 4.1Å; L61-M72 WeakPolarHBondContact O-CE 3.33Å; A64-M72 HydrophobicContact CB-CE 3.82Å; W68-M72 PolarHBondContact O-N 3.14Å; R70-M72 PolarHBondContact O-N 2.89Å; M72-I74 PolarHBondContact O-N 3.37Å; M72-L75 HydrophobicContact CE-CD1 4.44Å; M72-L75 PolarHBondContact O-N 3.48Å; M72-L75 HydrophobicContact SD-CB 4.38Å; M72-L75 HydrophobicContact SD-CD1 3.74Å; M72-D76 WeakPolarHBondContact O-CB 3.35Å; M72-D76 PolarHBondContact O-N 3.3Å |
| 73 | I | 78 | Confident | 79.7 | Confident | 109 Ų | 109 | 66.1 Ų | 66.1 | 56% | 0.559 | 32% | 0.324 | S | S | * | . | H | α-helix | trans | -61.3 | -38.5 | 168.6 | -62.4 | 163.2 | 0 | 0 | 0 | 110 | T77 | I73-T77 WeakPolarHBondContact O-CB 3.44Å; I73-T77 VanDerWaalsContact O-CG2 3.31Å; I73-T77 WeakPolarHBondContact O-CG2 3.26Å; I73-T77 PolarHBondContact O-N 2.96Å; I73-T77 PolarHBondContact O-OG1 3.45Å |
| 74 | I | 80.5 | Confident | 79.6 | Confident | 39 Ų | 39 | 67.9 Ų | 67.9 | 20% | 0.2 | 33% | 0.33 | C | S | . | . | H | α-helix | trans | -63.9 | -47.3 | 178.4 | -78.4 | 177.5 | 0 | 0 | 0 | 110.4 | R70 L71 M72 T77 S78 Q145 | R70-I74 WeakPolarHBondContact O-CD1 3.35Å; R70-I74 VanDerWaalsContact O-CG1 3.31Å; R70-I74 WeakPolarHBondContact O-CG1 3.32Å; L71-I74 VanDerWaalsContact O-CB 3.24Å; L71-I74 WeakPolarHBondContact O-CB 3.33Å; L71-I74 PolarHBondContact O-N 3.13Å; M72-I74 PolarHBondContact O-N 3.37Å; I74-T77 PolarHBondContact O-OG1 2.97Å; I74-T77 VanDerWaalsContact O-OG1 3.07Å; I74-S78 WeakPolarHBondContact O-CB 3.06Å; I74-S78 PolarHBondContact O-N 2.69Å; I74-Q145 HydrophobicContact CG2-CB 3.46Å; I74-Q145 VanDerWaalsContact CG2-CB 3.46Å; I74-Q145 HydrophobicContact CG2-CG 3.77Å; I74-Q145 PolarHBondContact O-NE2 2.82Å; I74-Q145 PolarHBondContact O-OE1 3.4Å; I74-Q145 VanDerWaalsContact O-OE1 3.14Å |
| 75 | L | 82.2 | Confident | 79.8 | Confident | 24 Ų | 24 | 70 Ų | 70 | 13% | 0.126 | 34% | 0.34 | C | S | . | . | H | α-helix | trans | -65.2 | -45.3 | 176.5 | -71.7 | 173.7 | 0 | 0 | 0 | 112.9 | L61 L71 M72 S78 L79 F138 C142 | L61-L75 HydrophobicContact CD2-CD1 4.38Å; L71-L75 HydrophobicContact CD2-CD1 3.72Å; L71-L75 HydrophobicContact CD2-CG 4.46Å; L71-L75 HydrophobicContact CG-CD1 4.06Å; L71-L75 HydrophobicContact CG-CG 4.29Å; L71-L75 VanDerWaalsContact O-CG 3.27Å; L71-L75 WeakPolarHBondContact O-CG 3.31Å; L71-L75 PolarHBondContact O-N 3.33Å; M72-L75 HydrophobicContact CE-CD1 4.44Å; M72-L75 PolarHBondContact O-N 3.48Å; M72-L75 HydrophobicContact SD-CB 4.38Å; M72-L75 HydrophobicContact SD-CD1 3.74Å; L75-S78 WeakPolarHBondContact O-CB 3.46Å; L75-S78 PolarHBondContact O-N 2.89Å; L75-L79 VanDerWaalsContact O-CB 3.26Å; L75-L79 WeakPolarHBondContact O-CB 3.31Å; L75-L79 PolarHBondContact O-N 2.84Å; L75-F138 HydrophobicContact CD2-CE2 4.32Å; L75-F138 HydrophobicContact CD2-CZ 3.86Å; L75-C142 WeakPolarHBondContact CD2-SG 3.42Å |
| 76 | D | 79.6 | Confident | 80.1 | Confident | 40 Ų | 40 | 70.8 Ų | 70.8 | 21% | 0.214 | 35% | 0.345 | C | S | . | . | H | α-helix | trans | -62.2 | -48.8 | -179.5 | -177.5 | 61.4 | 0 | 0 | 0 | 111.3 | T22 T26 M72 S78 L79 I80 | T22-D76 HydrophobicContact CG2-CB 4.44Å; T26-D76 HydrophobicContact CG2-CB 3.96Å; T26-D76 WeakPolarHBondContact CG2-OD1 3.27Å; M72-D76 WeakPolarHBondContact O-CB 3.35Å; M72-D76 PolarHBondContact O-N 3.3Å; D76-S78 VanDerWaalsContact C-N 3.34Å; D76-S78 PolarHBondContact O-N 3.48Å; D76-L79 PolarHBondContact O-N 3.42Å; D76-I80 VanDerWaalsContact O-CG1 3.31Å; D76-I80 WeakPolarHBondContact O-CG1 3.17Å; D76-I80 PolarHBondContact O-N 2.79Å |
| 77 | T | 85.1 | Confident | 80.2 | Confident | 77 Ų | 77 | 70.6 Ų | 70.6 | 47% | 0.472 | 35% | 0.346 | S | S | . | . | H | α-helix | trans | -64.4 | -37.6 | 177 | 53.7 | 0 | 0 | 0 | 0 | 112.9 | I73 I74 G81 | I73-T77 WeakPolarHBondContact O-CB 3.44Å; I73-T77 VanDerWaalsContact O-CG2 3.31Å; I73-T77 WeakPolarHBondContact O-CG2 3.26Å; I73-T77 PolarHBondContact O-N 2.96Å; I73-T77 PolarHBondContact O-OG1 3.45Å; I74-T77 PolarHBondContact O-OG1 2.97Å; I74-T77 VanDerWaalsContact O-OG1 3.07Å; T77-G81 PolarHBondContact O-N 3.5Å |
| 78 | S | 85.5 | Confident | 80.4 | Confident | 5 Ų | 5 | 63.3 Ų | 63.3 | 4% | 0.035 | 33% | 0.327 | C | S | . | . | H | α-helix | trans | -62.9 | -45.1 | 174.4 | 166.7 | 0 | 0 | 0 | 0 | 111.6 | I74 L75 D76 G81 G82 S141 | I74-S78 WeakPolarHBondContact O-CB 3.06Å; I74-S78 PolarHBondContact O-N 2.69Å; L75-S78 WeakPolarHBondContact O-CB 3.46Å; L75-S78 PolarHBondContact O-N 2.89Å; D76-S78 VanDerWaalsContact C-N 3.34Å; D76-S78 PolarHBondContact O-N 3.48Å; S78-G81 PolarHBondContact O-N 3.4Å; S78-G82 PolarHBondContact O-N 2.97Å; S78-S141 WeakPolarHBondContact OG-CB 3.24Å |
| 79 | L | 83.3 | Confident | 80.8 | Confident | 3 Ų | 3 | 57.6 Ų | 57.6 | 2% | 0.016 | 31% | 0.31 | C | S | . | . | H | α-helix | trans | -67.4 | -46.3 | -177.7 | -173.2 | 65.1 | 0 | 0 | 0 | 111.7 | T26 L29 I30 L75 D76 G81 G82 A83 F138 | T26-L79 HydrophobicContact CG2-CD2 4.01Å; T26-L79 WeakPolarHBondContact O-CD2 3.41Å; L29-L79 HydrophobicContact CB-CD2 3.98Å; L29-L79 HydrophobicContact CD2-CD2 3.78Å; L29-L79 HydrophobicContact CD2-CG 3.86Å; L29-L79 HydrophobicContact CG-CD2 4.23Å; L29-L79 HydrophobicContact CG-CG 4.48Å; I30-L79 HydrophobicContact CD1-CD1 4.23Å; I30-L79 HydrophobicContact CD1-CD2 4.07Å; I30-L79 HydrophobicContact CG1-CD1 3.61Å; I30-L79 HydrophobicContact CG1-CD2 3.9Å; I30-L79 HydrophobicContact CG1-CG 4.42Å; L75-L79 VanDerWaalsContact O-CB 3.26Å; L75-L79 WeakPolarHBondContact O-CB 3.31Å; L75-L79 PolarHBondContact O-N 2.84Å; D76-L79 PolarHBondContact O-N 3.42Å; L79-G81 VanDerWaalsContact C-N 3.33Å; L79-G81 PolarHBondContact O-N 3Å; L79-G82 PolarHBondContact O-N 3.4Å; L79-A83 VanDerWaalsContact O-CB 3.22Å; L79-A83 WeakPolarHBondContact O-CB 3.22Å; L79-A83 PolarHBondContact O-N 3.27Å; L79-F138 HydrophobicContact CB-CD2 4.23Å; L79-F138 HydrophobicContact CB-CE2 4.04Å; L79-F138 HydrophobicContact CD1-CD2 3.72Å; L79-F138 HydrophobicContact CD1-CE2 3.89Å |
| 80 | I | 84.8 | Confident | 81 | Confident | 96 Ų | 96 | 53.7 Ų | 53.7 | 49% | 0.492 | 29% | 0.292 | S | S | . | . | H | α-helix | trans | -62.8 | -42.8 | 176.2 | -64.4 | 164.9 | 0 | 0 | 0 | 110.1 | D76 A83 L84 | D76-I80 VanDerWaalsContact O-CG1 3.31Å; D76-I80 WeakPolarHBondContact O-CG1 3.17Å; D76-I80 PolarHBondContact O-N 2.79Å; I80-A83 PolarHBondContact O-N 3.3Å; I80-L84 WeakPolarHBondContact O-CB 2.73Å; I80-L84 PolarHBondContact O-N 3.32Å |
| 81 | G | 85.4 | Confident | 81.5 | Confident | 32 Ų | 32 | 49.6 Ų | 49.6 | 33% | 0.33 | 28% | 0.277 | S | S | . | . | H | α-helix | trans | -63.4 | -47.5 | 176.6 | 0 | 0 | 0 | 0 | 0 | 112.7 | T77 S78 L79 L84 V85 | T77-G81 PolarHBondContact O-N 3.5Å; S78-G81 PolarHBondContact O-N 3.4Å; L79-G81 VanDerWaalsContact C-N 3.33Å; L79-G81 PolarHBondContact O-N 3Å; G81-L84 PolarHBondContact O-N 2.89Å; G81-V85 WeakPolarHBondContact O-CG2 3.41Å; G81-V85 PolarHBondContact O-N 3.43Å |
| 82 | G | 82.8 | Confident | 82 | Confident | 2 Ų | 2 | 54.4 Ų | 54.4 | 2% | 0.021 | 30% | 0.296 | C | S | . | . | H | α-helix | trans | -62.3 | -41.8 | 176.6 | 0 | 0 | 0 | 0 | 0 | 112.3 | S78 L79 V85 T86 | S78-G82 PolarHBondContact O-N 2.97Å; L79-G82 PolarHBondContact O-N 3.4Å; G82-V85 PolarHBondContact O-N 3.25Å; G82-T86 WeakPolarHBondContact O-CB 3.44Å; G82-T86 PolarHBondContact O-N 2.92Å; G82-T86 PolarHBondContact O-OG1 2.99Å |
| 83 | A | 81.8 | Confident | 82 | Confident | 21 Ų | 21 | 57.4 Ų | 57.4 | 17% | 0.174 | 32% | 0.315 | C | S | . | . | H | α-helix | trans | -63.4 | -45.5 | 174.8 | 0 | 0 | 0 | 0 | 0 | 111.4 | L79 I80 V85 T86 V87 | L79-A83 VanDerWaalsContact O-CB 3.22Å; L79-A83 WeakPolarHBondContact O-CB 3.22Å; L79-A83 PolarHBondContact O-N 3.27Å; I80-A83 PolarHBondContact O-N 3.3Å; A83-V85 PolarHBondContact O-N 2.84Å; A83-T86 PolarHBondContact O-N 3.44Å; A83-V87 WeakPolarHBondContact O-CB 3.28Å; A83-V87 VanDerWaalsContact O-CG2 3.27Å; A83-V87 WeakPolarHBondContact O-CG2 3.27Å; A83-V87 PolarHBondContact O-N 3.35Å |
| 84 | L | 85.9 | Confident | 81.6 | Confident | 115 Ų | 115 | 55 Ų | 55 | 60% | 0.602 | 30% | 0.302 | S | S | * | . | H | α-helix | trans | -62 | -43 | 178.5 | -174.6 | 67.1 | 0 | 0 | 0 | 111.9 | I80 G81 V87 S88 | I80-L84 WeakPolarHBondContact O-CB 2.73Å; I80-L84 PolarHBondContact O-N 3.32Å; G81-L84 PolarHBondContact O-N 2.89Å; L84-V87 PolarHBondContact O-N 3.49Å; L84-S88 WeakPolarHBondContact O-CB 3.48Å; L84-S88 PolarHBondContact O-N 3.29Å; L84-S88 PolarHBondContact O-OG 3.41Å |
| 85 | V | 85.9 | Confident | 81 | Confident | 71 Ų | 71 | 63.7 Ų | 63.7 | 43% | 0.43 | 33% | 0.332 | S | S | . | . | H | α-helix | trans | -64.6 | -44.4 | 175.7 | 173.5 | 0 | 0 | 0 | 0 | 110.2 | G81 G82 A83 V87 S88 V89 L137 | G81-V85 WeakPolarHBondContact O-CG2 3.41Å; G81-V85 PolarHBondContact O-N 3.43Å; G82-V85 PolarHBondContact O-N 3.25Å; A83-V85 PolarHBondContact O-N 2.84Å; V85-V87 PolarHBondContact O-N 3.13Å; V85-S88 WeakPolarHBondContact O-CB 3.45Å; V85-S88 PolarHBondContact O-N 3.29Å; V85-S88 VanDerWaalsContact O-N 3.13Å; V85-V89 HydrophobicContact CG1-CG2 4.31Å; V85-V89 WeakPolarHBondContact O-CG2 3.29Å; V85-V89 PolarHBondContact O-N 3.16Å; V85-L137 HydrophobicContact CB-CD1 4.14Å; V85-L137 HydrophobicContact CG1-CD1 3.71Å |
| 86 | T | 81.9 | Confident | 80 | Confident | 18 Ų | 18 | 65.8 Ų | 65.8 | 11% | 0.11 | 34% | 0.343 | C | S | . | . | H | α-helix | trans | -60.9 | -45.1 | 177.8 | -54.9 | 0 | 0 | 0 | 0 | 111.3 | G82 A83 S88 V89 N90 W134 | G82-T86 WeakPolarHBondContact O-CB 3.44Å; G82-T86 PolarHBondContact O-N 2.92Å; G82-T86 PolarHBondContact O-OG1 2.99Å; A83-T86 PolarHBondContact O-N 3.44Å; T86-S88 VanDerWaalsContact C-N 3.29Å; T86-S88 PolarHBondContact O-N 3.42Å; T86-V89 PolarHBondContact O-N 2.89Å; T86-N90 VanDerWaalsContact O-CB 3.24Å; T86-N90 WeakPolarHBondContact O-CB 3.09Å; T86-N90 PolarHBondContact O-N 3.48Å; T86-W134 HydrophobicContact CG2-CB 4.11Å |
| 87 | V | 80.1 | Confident | 79.4 | Confident | 71 Ų | 71 | 70.9 Ų | 70.9 | 43% | 0.43 | 36% | 0.36 | S | S | . | . | H | α-helix | trans | -61.6 | -39.7 | 174.9 | 170.1 | 0 | 0 | 0 | 0 | 111.1 | A83 L84 V85 N90 Y91 | A83-V87 WeakPolarHBondContact O-CB 3.28Å; A83-V87 VanDerWaalsContact O-CG2 3.27Å; A83-V87 WeakPolarHBondContact O-CG2 3.27Å; A83-V87 PolarHBondContact O-N 3.35Å; L84-V87 PolarHBondContact O-N 3.49Å; V85-V87 PolarHBondContact O-N 3.13Å; V87-N90 PolarHBondContact O-N 3Å; V87-Y91 WeakPolarHBondContact O-CB 3.17Å; V87-Y91 PolarHBondContact O-N 3.44Å |
| 88 | S | 85.2 | Confident | 78.4 | Confident | 50 Ų | 50 | 67.7 Ų | 67.7 | 35% | 0.35 | 34% | 0.34 | S | S | . | . | H | α-helix | trans | -64.5 | -47.3 | 177.5 | -57.7 | 0 | 0 | 0 | 0 | 111.4 | L84 V85 T86 N90 Y91 F92 | L84-S88 WeakPolarHBondContact O-CB 3.48Å; L84-S88 PolarHBondContact O-N 3.29Å; L84-S88 PolarHBondContact O-OG 3.41Å; V85-S88 WeakPolarHBondContact O-CB 3.45Å; V85-S88 PolarHBondContact O-N 3.29Å; V85-S88 VanDerWaalsContact O-N 3.13Å; T86-S88 VanDerWaalsContact C-N 3.29Å; T86-S88 PolarHBondContact O-N 3.42Å; S88-N90 VanDerWaalsContact C-N 3.35Å; S88-N90 PolarHBondContact O-N 3.44Å; S88-Y91 WeakPolarHBondContact O-CB 3.1Å; S88-Y91 PolarHBondContact O-N 3.41Å; S88-F92 WeakPolarHBondContact O-CD2 3.47Å; S88-F92 PolarHBondContact O-N 2.86Å |
| 89 | V | 82.8 | Confident | 77.3 | Confident | 46 Ų | 46 | 70.9 Ų | 70.9 | 28% | 0.279 | 36% | 0.356 | S | S | . | . | H | α-helix | trans | -64.4 | -42.2 | 177.4 | -178.7 | 0 | 0 | 0 | 0 | 110.4 | V85 T86 Y91 F92 V93 M130 L133 | V85-V89 HydrophobicContact CG1-CG2 4.31Å; V85-V89 WeakPolarHBondContact O-CG2 3.29Å; V85-V89 PolarHBondContact O-N 3.16Å; T86-V89 PolarHBondContact O-N 2.89Å; V89-Y91 VanDerWaalsContact C-N 3.31Å; V89-Y91 PolarHBondContact O-N 3.01Å; V89-F92 PolarHBondContact O-N 3.46Å; V89-F92 VanDerWaalsContact O-N 3.16Å; V89-V93 HydrophobicContact CG1-CG2 4.29Å; V89-V93 WeakPolarHBondContact O-CG2 3.38Å; V89-V93 PolarHBondContact O-N 2.95Å; V89-M130 HydrophobicContact CB-CE 4.42Å; V89-M130 HydrophobicContact CG1-CE 3.38Å; V89-M130 HydrophobicContact CG1-SD 4.27Å; V89-L133 HydrophobicContact CB-CD2 4.16Å; V89-L133 HydrophobicContact CG1-CD2 3.96Å; V89-L133 HydrophobicContact CG2-CD2 4.34Å |
| 90 | N | 78.7 | Confident | 76.5 | Confident | 10 Ų | 10 | 73.9 Ų | 73.9 | 5% | 0.053 | 38% | 0.377 | C | S | . | . | H | α-helix | trans | -62.1 | -36.8 | 175.5 | -177.4 | 59.9 | 0 | 0 | 0 | 112.7 | T86 V87 S88 E94 I99 | T86-N90 VanDerWaalsContact O-CB 3.24Å; T86-N90 WeakPolarHBondContact O-CB 3.09Å; T86-N90 PolarHBondContact O-N 3.48Å; V87-N90 PolarHBondContact O-N 3Å; S88-N90 VanDerWaalsContact C-N 3.35Å; S88-N90 PolarHBondContact O-N 3.44Å; N90-E94 PolarHBondContact O-N 3.31Å; N90-I99 WeakPolarHBondContact ND2-CD1 3.46Å; N90-I99 VanDerWaalsContact ND2-CG1 3.33Å; N90-I99 WeakPolarHBondContact ND2-CG1 3.27Å |
| 91 | Y | 80.5 | Confident | 75.5 | Confident | 131 Ų | 131 | 72.3 Ų | 72.3 | 51% | 0.514 | 37% | 0.365 | S | S | . | . | H | α-helix | trans | -63.2 | -44.6 | 172.9 | 177.5 | -95.1 | 0 | 0 | 0 | 111.7 | V87 S88 V89 R95 L96 | V87-Y91 WeakPolarHBondContact O-CB 3.17Å; V87-Y91 PolarHBondContact O-N 3.44Å; S88-Y91 WeakPolarHBondContact O-CB 3.1Å; S88-Y91 PolarHBondContact O-N 3.41Å; V89-Y91 VanDerWaalsContact C-N 3.31Å; V89-Y91 PolarHBondContact O-N 3.01Å; Y91-R95 WeakPolarHBondContact O-CA 2.84Å; Y91-R95 PolarHBondContact O-N 3.38Å; Y91-L96 HydrophobicContact CD2-CD1 4.14Å; Y91-L96 HydrophobicContact CD2-CD2 4.29Å; Y91-L96 HydrophobicContact CD2-CG 3.96Å |
| 92 | F | 80.8 | Confident | 74.4 | Confident | 168 Ų | 168 | 74 Ų | 74 | 74% | 0.737 | 37% | 0.365 | S | S | * | . | H | α-helix | trans | -70.2 | -38.9 | -177.3 | -83.5 | -66.4 | 0 | 0 | 0 | 113.9 | S88 V89 | S88-F92 WeakPolarHBondContact O-CD2 3.47Å; S88-F92 PolarHBondContact O-N 2.86Å; V89-F92 PolarHBondContact O-N 3.46Å; V89-F92 VanDerWaalsContact O-N 3.16Å |
| 93 | V | 72.4 | Confident | 73.5 | Confident | 78 Ų | 78 | 79.3 Ų | 79.3 | 47% | 0.473 | 39% | 0.392 | S | S | . | . | H | α-helix | trans | -85.1 | -35.1 | -172.6 | -172.6 | 0 | 0 | 0 | 0 | 113 | V89 Y126 | V89-V93 HydrophobicContact CG1-CG2 4.29Å; V89-V93 WeakPolarHBondContact O-CG2 3.38Å; V89-V93 PolarHBondContact O-N 2.95Å; V93-Y126 HydrophobicContact CB-CE1 4.34Å; V93-Y126 WeakPolarHBondContact CB-OH 2.88Å; V93-Y126 HydrophobicContact CG1-CE1 3.82Å; V93-Y126 HydrophobicContact CG1-CE2 3.88Å; V93-Y126 WeakPolarHBondContact CG1-OH 2.91Å; V93-Y126 WeakPolarHBondContact CG2-OH 3.38Å |
| 94 | E | 68.2 | Low | 72.6 | Confident | 59 Ų | 59 | 81.9 Ų | 81.9 | 28% | 0.276 | 41% | 0.409 | S | S | . | . | H | α-helix | trans | -134.9 | 15.3 | -173.9 | -68.8 | -168.7 | -169.8 | 0 | 0 | 114.8 | N90 L96 Y97 L98 Y126 | N90-E94 PolarHBondContact O-N 3.31Å; E94-L96 PolarHBondContact O-N 3.42Å; E94-L96 VanDerWaalsContact O-N 3.08Å; E94-Y97 WeakPolarHBondContact O-CB 3.24Å; E94-Y97 PolarHBondContact O-N 3.46Å; E94-L98 VanDerWaalsContact OE2-CD2 3.29Å; E94-L98 WeakPolarHBondContact OE2-CD2 3.32Å; E94-L98 WeakPolarHBondContact OE2-CG 3.45Å; E94-Y126 HydrophobicContact CG-CE1 4.14Å; E94-Y126 WeakPolarHBondContact OE1-CD1 3.16Å; E94-Y126 VanDerWaalsContact OE1-CE1 3.24Å; E94-Y126 WeakPolarHBondContact OE1-CE1 3.38Å |
| 95 | R | 67.6 | Low | 71.5 | Confident | 221 Ų | 221 | 77.4 Ų | 77.4 | 83% | 0.834 | 39% | 0.387 | S | S | * | . | T | Hydrogen-bonded Turn | trans | 55.2 | 32.5 | 177.4 | -148 | -178.9 | -133.2 | -118.6 | 3.1 | 112.9 | Y91 | Y91-R95 WeakPolarHBondContact O-CA 2.84Å; Y91-R95 PolarHBondContact O-N 3.38Å |
| 96 | L | 62.8 | Low | 70.3 | Confident | 68 Ų | 68 | 80.3 Ų | 80.3 | 36% | 0.356 | 40% | 0.398 | S | S | . | . | T | Hydrogen-bonded Turn | trans | 73.2 | 14.2 | -176.2 | -51.8 | 169 | 0 | 0 | 0 | 116.8 | Y91 E94 L98 I99 S100 | Y91-L96 HydrophobicContact CD2-CD1 4.14Å; Y91-L96 HydrophobicContact CD2-CD2 4.29Å; Y91-L96 HydrophobicContact CD2-CG 3.96Å; E94-L96 PolarHBondContact O-N 3.42Å; E94-L96 VanDerWaalsContact O-N 3.08Å; L96-L98 PolarHBondContact O-N 3.2Å; L96-I99 HydrophobicContact CD2-CD1 4.03Å; L96-I99 PolarHBondContact O-N 2.93Å; L96-I99 VanDerWaalsContact O-N 3.17Å; L96-S100 PolarHBondContact O-N 2.89Å |
| 97 | Y | 65.4 | Low | 69.3 | Low | 147 Ų | 147 | 87.2 Ų | 87.2 | 58% | 0.576 | 43% | 0.429 | S | S | * | . | H | α-helix | trans | -58.3 | -42.2 | -178.9 | -168.9 | -107.6 | 0 | 0 | 0 | 113.2 | E94 I99 S100 R101 | E94-Y97 WeakPolarHBondContact O-CB 3.24Å; E94-Y97 PolarHBondContact O-N 3.46Å; Y97-I99 VanDerWaalsContact C-N 3.34Å; Y97-I99 PolarHBondContact O-N 2.89Å; Y97-S100 PolarHBondContact O-N 3.19Å; Y97-S100 PolarHBondContact O-OG 3.41Å; Y97-R101 WeakPolarHBondContact O-CB 3.27Å; Y97-R101 PolarHBondContact O-N 3.07Å |
| 98 | L | 64 | Low | 68.2 | Low | 9 Ų | 9 | 90.1 Ų | 90.1 | 5% | 0.047 | 43% | 0.432 | C | S | . | . | H | α-helix | trans | -58.5 | -40.7 | 176.1 | -63.5 | 179.1 | 0 | 0 | 0 | 113.3 | E94 L96 R101 M102 Y126 D127 M130 | E94-L98 VanDerWaalsContact OE2-CD2 3.29Å; E94-L98 WeakPolarHBondContact OE2-CD2 3.32Å; E94-L98 WeakPolarHBondContact OE2-CG 3.45Å; L96-L98 PolarHBondContact O-N 3.2Å; L98-R101 PolarHBondContact O-N 2.87Å; L98-M102 WeakPolarHBondContact O-CB 3.22Å; L98-M102 WeakPolarHBondContact O-CG 3.42Å; L98-M102 PolarHBondContact O-N 2.96Å; L98-Y126 HydrophobicContact CD1-CE1 4.44Å; L98-D127 HydrophobicContact CD2-CB 4.4Å; L98-M130 HydrophobicContact CD1-CB 3.87Å; L98-M130 HydrophobicContact CD1-CG 3.74Å |
| 99 | I | 63.4 | Low | 66.9 | Low | 73 Ų | 73 | 93.8 Ų | 93.8 | 37% | 0.374 | 44% | 0.442 | S | S | . | . | H | α-helix | trans | -67.6 | -42.2 | 179.5 | -71.4 | 171.4 | 0 | 0 | 0 | 110 | N90 L96 Y97 R101 M102 L103 | N90-I99 WeakPolarHBondContact ND2-CD1 3.46Å; N90-I99 VanDerWaalsContact ND2-CG1 3.33Å; N90-I99 WeakPolarHBondContact ND2-CG1 3.27Å; L96-I99 HydrophobicContact CD2-CD1 4.03Å; L96-I99 PolarHBondContact O-N 2.93Å; L96-I99 VanDerWaalsContact O-N 3.17Å; Y97-I99 VanDerWaalsContact C-N 3.34Å; Y97-I99 PolarHBondContact O-N 2.89Å; I99-R101 VanDerWaalsContact C-N 3.27Å; I99-R101 PolarHBondContact O-N 3.38Å; I99-M102 PolarHBondContact O-N 2.98Å; I99-L103 WeakPolarHBondContact O-CB 3.41Å; I99-L103 PolarHBondContact O-N 3.13Å |
| 100 | S | 65.8 | Low | 65.8 | Low | 65 Ų | 65 | 96.8 Ų | 96.8 | 46% | 0.455 | 46% | 0.462 | S | S | . | . | H | α-helix | trans | -61.1 | -39.5 | 175.7 | 75.9 | 0 | 0 | 0 | 0 | 111.6 | L96 Y97 S104 | L96-S100 PolarHBondContact O-N 2.89Å; Y97-S100 PolarHBondContact O-N 3.19Å; Y97-S100 PolarHBondContact O-OG 3.41Å; S100-S104 WeakPolarHBondContact O-CB 3.47Å; S100-S104 PolarHBondContact O-N 3.14Å; S100-S104 PolarHBondContact O-OG 3.49Å |
| 101 | R | 64.2 | Low | 64.8 | Low | 64 Ų | 64 | 103.4 Ų | 103.4 | 24% | 0.242 | 49% | 0.493 | C | S | . | . | H | α-helix | trans | -67.5 | -49.5 | 176.1 | -166 | 165.8 | 71.3 | 167.5 | 2.4 | 110.7 | Y97 L98 I99 L103 S104 T105 D127 | Y97-R101 WeakPolarHBondContact O-CB 3.27Å; Y97-R101 PolarHBondContact O-N 3.07Å; L98-R101 PolarHBondContact O-N 2.87Å; I99-R101 VanDerWaalsContact C-N 3.27Å; I99-R101 PolarHBondContact O-N 3.38Å; R101-L103 VanDerWaalsContact C-N 3.32Å; R101-L103 PolarHBondContact O-N 3.49Å; R101-S104 WeakPolarHBondContact CA-OG 3.43Å; R101-S104 CarbonylContact O-C 3.59Å; R101-S104 PolarHBondContact O-N 2.89Å; R101-S104 VanDerWaalsContact O-N 3.11Å; R101-S104 PolarHBondContact O-OG 3.04Å; R101-T105 WeakPolarHBondContact O-CB 3.44Å; R101-T105 PolarHBondContact O-N 2.82Å; R101-T105 PolarHBondContact O-OG1 2.83Å; R101-D127 IonicContact CZ-OD2 3.86Å; R101-D127 IonicContact NH2-OD2 2.76Å; R101-D127 PolarHBondContact NH2-OD2 3.04Å |
| 102 | M | 62.4 | Low | 63.6 | Low | 66 Ų | 66 | 102.8 Ų | 102.8 | 33% | 0.325 | 50% | 0.503 | S | S | . | . | H | α-helix | trans | -58.7 | -40.4 | 177 | -69.7 | -69.6 | 176.1 | 0 | 0 | 112.3 | L98 I99 T105 I106 | L98-M102 WeakPolarHBondContact O-CB 3.22Å; L98-M102 WeakPolarHBondContact O-CG 3.42Å; L98-M102 PolarHBondContact O-N 2.96Å; I99-M102 PolarHBondContact O-N 2.98Å; M102-T105 CarbonylContact O-C 3.59Å; M102-T105 PolarHBondContact O-N 3.25Å; M102-I106 WeakPolarHBondContact O-CG1 3.45Å; M102-I106 PolarHBondContact O-N 3.01Å |
| 103 | L | 63.7 | Low | 62.3 | Low | 114 Ų | 114 | 97.3 Ų | 97.3 | 60% | 0.597 | 49% | 0.485 | S | S | * | . | H | α-helix | trans | -65.9 | -42.9 | 174.4 | -122.4 | 74.2 | 0 | 0 | 0 | 112.1 | I99 R101 T105 I106 H107 | I99-L103 WeakPolarHBondContact O-CB 3.41Å; I99-L103 PolarHBondContact O-N 3.13Å; R101-L103 VanDerWaalsContact C-N 3.32Å; R101-L103 PolarHBondContact O-N 3.49Å; L103-T105 PolarHBondContact O-N 3.29Å; L103-I106 PolarHBondContact O-N 3.16Å; L103-H107 WeakPolarHBondContact O-CB 3.35Å; L103-H107 PolarHBondContact O-N 3.1Å |
| 104 | S | 63.4 | Low | 61.6 | Low | 76 Ų | 76 | 99.4 Ų | 99.4 | 53% | 0.531 | 50% | 0.501 | S | S | . | . | H | α-helix | trans | -64 | -29.6 | 174.9 | 74.4 | 0 | 0 | 0 | 0 | 112.3 | S100 R101 W108 | S100-S104 WeakPolarHBondContact O-CB 3.47Å; S100-S104 PolarHBondContact O-N 3.14Å; S100-S104 PolarHBondContact O-OG 3.49Å; R101-S104 WeakPolarHBondContact CA-OG 3.43Å; R101-S104 CarbonylContact O-C 3.59Å; R101-S104 PolarHBondContact O-N 2.89Å; R101-S104 VanDerWaalsContact O-N 3.11Å; R101-S104 PolarHBondContact O-OG 3.04Å; S104-W108 PolarHBondContact O-N 2.85Å |
| 105 | T | 62.1 | Low | 61.1 | Low | 21 Ų | 21 | 103 Ų | 103 | 13% | 0.129 | 52% | 0.522 | C | S | . | . | H | α-helix | trans | -71 | -60.8 | 174.4 | -35.6 | 0 | 0 | 0 | 0 | 105 | R101 M102 L103 H107 W108 I121 | R101-T105 WeakPolarHBondContact O-CB 3.44Å; R101-T105 PolarHBondContact O-N 2.82Å; R101-T105 PolarHBondContact O-OG1 2.83Å; M102-T105 CarbonylContact O-C 3.59Å; M102-T105 PolarHBondContact O-N 3.25Å; L103-T105 PolarHBondContact O-N 3.29Å; T105-H107 PolarHBondContact O-N 3.03Å; T105-W108 VanDerWaalsContact CB-CE3 3.5Å; T105-W108 HydrophobicContact CG2-CD2 4.48Å; T105-W108 HydrophobicContact CG2-CE3 3.12Å; T105-W108 HydrophobicContact CG2-CH2 4.4Å; T105-W108 HydrophobicContact CG2-CZ3 3.11Å; T105-W108 WeakPolarHBondContact O-CA 3.45Å; T105-W108 WeakPolarHBondContact O-CB 3.28Å; T105-W108 WeakPolarHBondContact O-CZ3 3.5Å; T105-W108 PolarHBondContact O-N 3.44Å; T105-I121 HydrophobicContact CG2-CD1 3.51Å; T105-I121 HydrophobicContact CG2-CG1 4.35Å |
| 106 | I | 61.4 | Low | 60.6 | Low | 131 Ų | 131 | 95.9 Ų | 95.9 | 67% | 0.672 | 52% | 0.517 | S | S | * | . | H | α-helix | trans | -53.1 | -31.4 | -179.3 | -64.1 | 159.7 | 0 | 0 | 0 | 114.3 | M102 L103 W108 | M102-I106 WeakPolarHBondContact O-CG1 3.45Å; M102-I106 PolarHBondContact O-N 3.01Å; L103-I106 PolarHBondContact O-N 3.16Å; I106-W108 VanDerWaalsContact C-N 3.27Å; I106-W108 PolarHBondContact O-N 3.39Å |
| 107 | H | 61.1 | Low | 60.2 | Low | 164 Ų | 164 | 99.5 Ų | 99.5 | 76% | 0.759 | 53% | 0.532 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -83.8 | 10.5 | 175.5 | -149.1 | -96.4 | 0 | 0 | 0 | 114.4 | L103 T105 K109 | L103-H107 WeakPolarHBondContact O-CB 3.35Å; L103-H107 PolarHBondContact O-N 3.1Å; T105-H107 PolarHBondContact O-N 3.03Å; H107-K109 PolarHBondContact O-N 3.5Å |
| 108 | W | 56.8 | Low | 59.9 | Low | 132 Ų | 132 | 98.9 Ų | 98.9 | 50% | 0.5 | 53% | 0.529 | S | S | . | . | trans | -62.5 | 106.1 | 176 | 71.3 | 66 | 0 | 0 | 0 | 108 | S104 T105 I106 R118 | S104-W108 PolarHBondContact O-N 2.85Å; T105-W108 VanDerWaalsContact CB-CE3 3.5Å; T105-W108 HydrophobicContact CG2-CD2 4.48Å; T105-W108 HydrophobicContact CG2-CE3 3.12Å; T105-W108 HydrophobicContact CG2-CH2 4.4Å; T105-W108 HydrophobicContact CG2-CZ3 3.11Å; T105-W108 WeakPolarHBondContact O-CA 3.45Å; T105-W108 WeakPolarHBondContact O-CB 3.28Å; T105-W108 WeakPolarHBondContact O-CZ3 3.5Å; T105-W108 PolarHBondContact O-N 3.44Å; I106-W108 VanDerWaalsContact C-N 3.27Å; I106-W108 PolarHBondContact O-N 3.39Å; W108-R118 VanDerWaalsContact CZ3-NH2 3.31Å | ||
| 109 | K | 57.9 | Low | 59.6 | Low | 127 Ų | 127 | 103.2 Ų | 103.2 | 55% | 0.552 | 56% | 0.557 | S | S | * | * | trans | -88.2 | 119.4 | 172.6 | -165.4 | 160.6 | 177.4 | 170.9 | 0 | 107.1 | H107 E111 T112 | H107-K109 PolarHBondContact O-N 3.5Å; K109-E111 WeakPolarHBondContact CE-OE1 3.24Å; K109-E111 WeakPolarHBondContact CE-OE2 3.43Å; K109-E111 HydrophobicContact CG-CB 4.23Å; K109-E111 HydrophobicContact CG-CG 4.07Å; K109-E111 IonicContact NZ-OE1 3.73Å; K109-E111 PolarHBondContact O-N 3.34Å; K109-T112 PolarHBondContact O-N 2.85Å | ||
| 110 | P | 59 | Low | 59.3 | Low | 108 Ų | 108 | 106.2 Ų | 106.2 | 70% | 0.701 | 57% | 0.574 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -61.9 | -11.1 | -175.1 | 22.1 | -31.3 | 0 | 0 | 0 | 113.7 | ||
| 111 | E | 57.3 | Low | 58.9 | Low | 150 Ų | 150 | 105.8 Ų | 105.8 | 70% | 0.701 | 57% | 0.566 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -83.9 | -11.1 | -173.2 | -50.4 | 173.7 | -138.9 | 0 | 0 | 113.4 | K109 | K109-E111 WeakPolarHBondContact CE-OE1 3.24Å; K109-E111 WeakPolarHBondContact CE-OE2 3.43Å; K109-E111 HydrophobicContact CG-CB 4.23Å; K109-E111 HydrophobicContact CG-CG 4.07Å; K109-E111 IonicContact NZ-OE1 3.73Å; K109-E111 PolarHBondContact O-N 3.34Å |
| 112 | T | 57 | Low | 58.6 | Low | 117 Ų | 117 | 109.1 Ų | 109.1 | 72% | 0.718 | 59% | 0.589 | S | S | * | * | S | Bend | trans | -112.6 | 1.5 | -173.5 | -43.6 | 0 | 0 | 0 | 0 | 113.5 | K109 P114 | K109-T112 PolarHBondContact O-N 2.85Å; T112-P114 VanDerWaalsContact O-CD 3.32Å; T112-P114 WeakPolarHBondContact O-CD 3.07Å |
| 113 | S | 52.9 | Low | 58.6 | Low | 53 Ų | 53 | 108.8 Ų | 108.8 | 37% | 0.371 | 59% | 0.588 | S | S | . | * | trans | -92 | 110.5 | 171.8 | -174.7 | 0 | 0 | 0 | 0 | 109.7 | N115 G116 H117 | S113-N115 PolarHBondContact O-N 2.71Å; S113-G116 PolarHBondContact O-N 3.25Å; S113-H117 PolarHBondContact OG-O 2.9Å | ||
| 114 | P | 57.5 | Low | 58.9 | Low | 123 Ų | 123 | 107.1 Ų | 107.1 | 80% | 0.799 | 59% | 0.585 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -63.6 | -9.6 | -177.2 | 23.7 | -32.5 | 0 | 0 | 0 | 114 | T112 | T112-P114 VanDerWaalsContact O-CD 3.32Å; T112-P114 WeakPolarHBondContact O-CD 3.07Å |
| 115 | N | 58 | Low | 59.5 | Low | 134 Ų | 134 | 112.7 Ų | 112.7 | 72% | 0.717 | 59% | 0.594 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -121.7 | 3.7 | -171.2 | -57.9 | -20.9 | 0 | 0 | 0 | 114.2 | S113 H117 | S113-N115 PolarHBondContact O-N 2.71Å; N115-H117 PolarHBondContact O-N 3.13Å |
| 116 | G | 57.4 | Low | 59.7 | Low | 72 Ų | 72 | 113.5 Ų | 113.5 | 74% | 0.742 | 60% | 0.595 | S | S | * | * | trans | 60.8 | -6 | 177.9 | 0 | 0 | 0 | 0 | 0 | 116.3 | S113 | S113-G116 PolarHBondContact O-N 3.25Š| ||
| 117 | H | 53.4 | Low | 60.1 | Low | 143 Ų | 143 | 107.4 Ų | 107.4 | 66% | 0.662 | 56% | 0.564 | S | S | * | * | P | Polyproline II helix | trans | -84.1 | 128.5 | 173.2 | -109.7 | 48.3 | 0 | 0 | 0 | 109.5 | S113 N115 | S113-H117 PolarHBondContact OG-O 2.9Å; N115-H117 PolarHBondContact O-N 3.13Å |
| 118 | R | 58.8 | Low | 60.6 | Low | 135 Ų | 135 | 104.3 Ų | 104.3 | 51% | 0.509 | 55% | 0.546 | S | S | . | . | P | Polyproline II helix | trans | -61 | 134.4 | 165.6 | -166.6 | 177.2 | -161.7 | -136.4 | 2.8 | 106.9 | W108 D120 | W108-R118 VanDerWaalsContact CZ3-NH2 3.31Å; R118-D120 PolarHBondContact O-N 3.42Å |
| 119 | P | 57.9 | Low | 61.3 | Low | 99 Ų | 99 | 102 Ų | 102 | 64% | 0.643 | 54% | 0.543 | S | S | * | . | P | Polyproline II helix | trans | -57.9 | 126.6 | 171.5 | 24 | -31.7 | 0 | 0 | 0 | 108.1 | I121 | P119-I121 PolarHBondContact O-N 2.84Š|
| 120 | D | 56.4 | Low | 61.9 | Low | 136 Ų | 136 | 96.8 Ų | 96.8 | 73% | 0.727 | 52% | 0.52 | S | S | * | . | trans | -59.8 | 108.8 | 171.4 | -70 | -41.1 | 0 | 0 | 0 | 107 | R118 D122 | R118-D120 PolarHBondContact O-N 3.42Å; D120-D122 PolarHBondContact O-N 3.45Å | ||
| 121 | I | 58.2 | Low | 62.3 | Low | 57 Ų | 57 | 92.8 Ų | 92.8 | 29% | 0.292 | 49% | 0.494 | S | S | . | . | trans | -75.3 | 100.7 | 175.3 | -48.2 | 166.1 | 0 | 0 | 0 | 104.3 | T105 P119 L123 | T105-I121 HydrophobicContact CG2-CD1 3.51Å; T105-I121 HydrophobicContact CG2-CG1 4.35Å; P119-I121 PolarHBondContact O-N 2.84Å; I121-L123 HydrophobicContact CB-CD1 3.62Å; I121-L123 HydrophobicContact CG2-CD1 3.35Å; I121-L123 HydrophobicContact CG2-CG 4.25Å; I121-L123 WeakPolarHBondContact O-CD1 3.2Å; I121-L123 PolarHBondContact O-N 3.47Å | ||
| 122 | D | 57.9 | Low | 63 | Low | 134 Ų | 134 | 89 Ų | 89 | 72% | 0.717 | 48% | 0.478 | S | S | * | . | trans | -68.2 | 81.7 | 167.2 | -73.2 | -26.6 | 0 | 0 | 0 | 108 | D120 C124 | D120-D122 PolarHBondContact O-N 3.45Å; D122-C124 VanDerWaalsContact C-N 3.34Å; D122-C124 PolarHBondContact O-N 2.82Å | ||
| 123 | L | 62.6 | Low | 64 | Low | 59 Ų | 59 | 85.5 Ų | 85.5 | 31% | 0.309 | 45% | 0.454 | S | S | . | . | trans | -64.6 | 99.8 | 169.6 | -86 | 84.3 | 0 | 0 | 0 | 106.8 | I121 D127 W128 | I121-L123 HydrophobicContact CB-CD1 3.62Å; I121-L123 HydrophobicContact CG2-CD1 3.35Å; I121-L123 HydrophobicContact CG2-CG 4.25Å; I121-L123 WeakPolarHBondContact O-CD1 3.2Å; I121-L123 PolarHBondContact O-N 3.47Å; L123-D127 HydrophobicContact CB-CB 4.41Å; L123-D127 HydrophobicContact CD2-CB 4.43Å; L123-D127 HydrophobicContact CG-CB 4.29Å; L123-W128 HydrophobicContact CD2-CD2 4.4Å; L123-W128 HydrophobicContact CD2-CZ2 4.31Å | ||
| 124 | C | 69.2 | Low | 64.9 | Low | 78 Ų | 78 | 85.2 Ų | 85.2 | 53% | 0.527 | 45% | 0.445 | S | S | . | . | trans | -54.4 | 147 | 163.8 | -67.3 | 0 | 0 | 0 | 0 | 108.7 | D122 Y126 D127 | D122-C124 VanDerWaalsContact C-N 3.34Å; D122-C124 PolarHBondContact O-N 2.82Å; C124-Y126 PolarHBondContact O-N 3.22Å; C124-D127 WeakPolarHBondContact O-CB 3.1Å; C124-D127 PolarHBondContact O-N 3.23Å | ||
| 125 | W | 76 | Confident | 65.7 | Low | 193 Ų | 193 | 81.2 Ų | 81.2 | 73% | 0.731 | 42% | 0.419 | S | S | * | . | H | α-helix | trans | -48.8 | -26 | 177.4 | 66.6 | -89.4 | 0 | 0 | 0 | 113.5 | W128 L129 | W125-W128 WeakPolarHBondContact O-CB 3.45Å; W125-L129 HydrophobicContact CZ3-CD1 4.07Å; W125-L129 PolarHBondContact O-N 3.25Å |
| 126 | Y | 67.1 | Low | 66.5 | Low | 38 Ų | 38 | 78.6 Ų | 78.6 | 15% | 0.149 | 41% | 0.408 | C | S | . | . | H | α-helix | trans | -70.4 | -36.3 | 178.1 | -173.1 | -95.5 | 0 | 0 | 0 | 113.5 | V93 E94 L98 C124 W128 L129 M130 | V93-Y126 HydrophobicContact CB-CE1 4.34Å; V93-Y126 WeakPolarHBondContact CB-OH 2.88Å; V93-Y126 HydrophobicContact CG1-CE1 3.82Å; V93-Y126 HydrophobicContact CG1-CE2 3.88Å; V93-Y126 WeakPolarHBondContact CG1-OH 2.91Å; V93-Y126 WeakPolarHBondContact CG2-OH 3.38Å; E94-Y126 HydrophobicContact CG-CE1 4.14Å; E94-Y126 WeakPolarHBondContact OE1-CD1 3.16Å; E94-Y126 VanDerWaalsContact OE1-CE1 3.24Å; E94-Y126 WeakPolarHBondContact OE1-CE1 3.38Å; L98-Y126 HydrophobicContact CD1-CE1 4.44Å; C124-Y126 PolarHBondContact O-N 3.22Å; Y126-W128 VanDerWaalsContact C-N 3.3Å; Y126-W128 PolarHBondContact O-N 3.35Å; Y126-L129 WeakPolarHBondContact O-CB 3.22Å; Y126-L129 PolarHBondContact O-N 3.32Å; Y126-L129 VanDerWaalsContact O-N 3.1Å; Y126-M130 HydrophobicContact CD1-CG 4.47Å; Y126-M130 HydrophobicContact CE1-CE 4.33Å; Y126-M130 HydrophobicContact CE1-CG 3.81Å; Y126-M130 HydrophobicContact CE2-CE 4.37Å; Y126-M130 PolarHBondContact O-N 3.4Å; Y126-M130 WeakPolarHBondContact OH-CE 3.49Å |
| 127 | D | 69.2 | Low | 67.3 | Low | 4 Ų | 4 | 77.1 Ų | 77.1 | 2% | 0.021 | 38% | 0.382 | C | S | . | . | H | α-helix | trans | -64.1 | -41.1 | 176.1 | -156.5 | -1.1 | 0 | 0 | 0 | 109.9 | L98 R101 L123 C124 L129 M130 V131 | L98-D127 HydrophobicContact CD2-CB 4.4Å; R101-D127 IonicContact CZ-OD2 3.86Å; R101-D127 IonicContact NH2-OD2 2.76Å; R101-D127 PolarHBondContact NH2-OD2 3.04Å; L123-D127 HydrophobicContact CB-CB 4.41Å; L123-D127 HydrophobicContact CD2-CB 4.43Å; L123-D127 HydrophobicContact CG-CB 4.29Å; C124-D127 WeakPolarHBondContact O-CB 3.1Å; C124-D127 PolarHBondContact O-N 3.23Å; D127-L129 VanDerWaalsContact C-N 3.3Å; D127-L129 PolarHBondContact O-N 2.86Å; D127-M130 PolarHBondContact O-N 3.46Å; D127-V131 VanDerWaalsContact O-CG2 3.26Å; D127-V131 WeakPolarHBondContact O-CG2 3.37Å; D127-V131 PolarHBondContact O-N 3.43Å |
| 128 | W | 71.8 | Confident | 68.5 | Low | 99 Ų | 99 | 72.1 Ų | 72.1 | 38% | 0.375 | 36% | 0.359 | S | S | . | . | H | α-helix | trans | -58 | -40.1 | 171.3 | -76.8 | 101.4 | 0 | 0 | 0 | 113.1 | I40 L123 W125 Y126 V131 M132 | I40-W128 HydrophobicContact CB-CH2 4.2Å; I40-W128 HydrophobicContact CB-CZ3 4.43Å; I40-W128 HydrophobicContact CD1-CE3 4.35Å; I40-W128 HydrophobicContact CD1-CH2 4Å; I40-W128 HydrophobicContact CD1-CZ3 3.36Å; I40-W128 HydrophobicContact CG1-CH2 3.6Å; I40-W128 HydrophobicContact CG1-CZ3 3.47Å; I40-W128 VanDerWaalsContact CG1-CZ3 3.47Å; I40-W128 HydrophobicContact CG2-CH2 3.99Å; I40-W128 HydrophobicContact CG2-CZ3 4.29Å; L123-W128 HydrophobicContact CD2-CD2 4.4Å; L123-W128 HydrophobicContact CD2-CZ2 4.31Å; W125-W128 WeakPolarHBondContact O-CB 3.45Å; Y126-W128 VanDerWaalsContact C-N 3.3Å; Y126-W128 PolarHBondContact O-N 3.35Å; W128-V131 PolarHBondContact O-N 3.07Å; W128-M132 HydrophobicContact CE3-CE 4.34Å; W128-M132 HydrophobicContact CZ3-CE 4.43Å; W128-M132 WeakPolarHBondContact O-CB 3.35Å; W128-M132 VanDerWaalsContact O-CG 3.24Å; W128-M132 WeakPolarHBondContact O-CG 3.34Å; W128-M132 PolarHBondContact O-N 3.1Å |
| 129 | L | 71.4 | Confident | 69.4 | Low | 84 Ų | 84 | 70.2 Ų | 70.2 | 44% | 0.44 | 36% | 0.357 | S | S | . | . | H | α-helix | trans | -66.8 | -40.6 | 178.9 | -164.7 | 148.4 | 0 | 0 | 0 | 111.3 | W125 Y126 D127 M132 L133 | W125-L129 HydrophobicContact CZ3-CD1 4.07Å; W125-L129 PolarHBondContact O-N 3.25Å; Y126-L129 WeakPolarHBondContact O-CB 3.22Å; Y126-L129 PolarHBondContact O-N 3.32Å; Y126-L129 VanDerWaalsContact O-N 3.1Å; D127-L129 VanDerWaalsContact C-N 3.3Å; D127-L129 PolarHBondContact O-N 2.86Å; L129-M132 PolarHBondContact O-N 2.92Å; L129-L133 VanDerWaalsContact O-CB 3.32Å; L129-L133 WeakPolarHBondContact O-CB 3.43Å; L129-L133 PolarHBondContact O-N 3.43Å |
| 130 | M | 70.4 | Confident | 70.4 | Confident | 16 Ų | 16 | 68.8 Ų | 68.8 | 8% | 0.079 | 35% | 0.347 | C | S | . | . | H | α-helix | trans | -65.7 | -40.8 | 174.7 | -78.1 | -66.2 | 141.2 | 0 | 0 | 112.6 | V89 L98 Y126 D127 M132 L133 | V89-M130 HydrophobicContact CB-CE 4.42Å; V89-M130 HydrophobicContact CG1-CE 3.38Å; V89-M130 HydrophobicContact CG1-SD 4.27Å; L98-M130 HydrophobicContact CD1-CB 3.87Å; L98-M130 HydrophobicContact CD1-CG 3.74Å; Y126-M130 HydrophobicContact CD1-CG 4.47Å; Y126-M130 HydrophobicContact CE1-CE 4.33Å; Y126-M130 HydrophobicContact CE1-CG 3.81Å; Y126-M130 HydrophobicContact CE2-CE 4.37Å; Y126-M130 PolarHBondContact O-N 3.4Å; Y126-M130 WeakPolarHBondContact OH-CE 3.49Å; D127-M130 PolarHBondContact O-N 3.46Å; M130-M132 VanDerWaalsContact C-N 3.31Å; M130-M132 PolarHBondContact O-N 3.35Å; M130-L133 HydrophobicContact CE-CD2 4.05Å; M130-L133 PolarHBondContact O-N 3.37Å; M130-L133 HydrophobicContact SD-CD2 4.14Å |
| 131 | V | 68.8 | Low | 71.4 | Confident | 24 Ų | 24 | 64.1 Ų | 64.1 | 15% | 0.145 | 33% | 0.325 | C | S | . | . | H | α-helix | trans | -62.3 | -39.1 | 174.7 | 170.1 | 0 | 0 | 0 | 0 | 111.5 | L36 D127 W128 P135 | L36-V131 HydrophobicContact CB-CG1 4Å; L36-V131 HydrophobicContact CD2-CB 4.24Å; L36-V131 HydrophobicContact CD2-CG1 3.62Å; L36-V131 HydrophobicContact CD2-CG2 3.56Å; L36-V131 HydrophobicContact CG-CG1 4.45Å; D127-V131 VanDerWaalsContact O-CG2 3.26Å; D127-V131 WeakPolarHBondContact O-CG2 3.37Å; D127-V131 PolarHBondContact O-N 3.43Å; W128-V131 PolarHBondContact O-N 3.07Å; V131-P135 WeakPolarHBondContact O-CD 3.22Å |
| 132 | M | 71.4 | Confident | 72.3 | Confident | 72 Ų | 72 | 62 Ų | 62 | 36% | 0.355 | 32% | 0.315 | S | S | . | . | H | α-helix | trans | -80 | -24.2 | 178.2 | -68 | -65.5 | 174.4 | 0 | 0 | 113.5 | L37 I40 W128 L129 M130 W134 P135 V136 | L37-M132 HydrophobicContact CD1-CE 4.08Å; I40-M132 HydrophobicContact CD1-CE 3.44Å; I40-M132 VanDerWaalsContact CD1-CE 3.44Å; W128-M132 HydrophobicContact CE3-CE 4.34Å; W128-M132 HydrophobicContact CZ3-CE 4.43Å; W128-M132 WeakPolarHBondContact O-CB 3.35Å; W128-M132 VanDerWaalsContact O-CG 3.24Å; W128-M132 WeakPolarHBondContact O-CG 3.34Å; W128-M132 PolarHBondContact O-N 3.1Å; L129-M132 PolarHBondContact O-N 2.92Å; M130-M132 VanDerWaalsContact C-N 3.31Å; M130-M132 PolarHBondContact O-N 3.35Å; M132-W134 VanDerWaalsContact C-N 3.34Å; M132-W134 PolarHBondContact O-N 3.4Å; M132-P135 VanDerWaalsContact O-CD 3.22Å; M132-P135 WeakPolarHBondContact O-CD 3.36Å; M132-P135 VanDerWaalsContact O-CG 3.27Å; M132-P135 WeakPolarHBondContact O-CG 3.26Å; M132-V136 WeakPolarHBondContact O-CB 3.21Å; M132-V136 WeakPolarHBondContact O-CG2 3.36Å; M132-V136 PolarHBondContact O-N 3.34Å |
| 133 | L | 76.8 | Confident | 73.3 | Confident | 42 Ų | 42 | 59.8 Ų | 59.8 | 22% | 0.22 | 30% | 0.303 | C | S | . | . | H | α-helix | trans | -63.5 | -40.8 | -179.2 | -178.5 | 62.3 | 0 | 0 | 0 | 111.7 | V89 L129 M130 V136 L137 | V89-L133 HydrophobicContact CB-CD2 4.16Å; V89-L133 HydrophobicContact CG1-CD2 3.96Å; V89-L133 HydrophobicContact CG2-CD2 4.34Å; L129-L133 VanDerWaalsContact O-CB 3.32Å; L129-L133 WeakPolarHBondContact O-CB 3.43Å; L129-L133 PolarHBondContact O-N 3.43Å; M130-L133 HydrophobicContact CE-CD2 4.05Å; M130-L133 PolarHBondContact O-N 3.37Å; M130-L133 HydrophobicContact SD-CD2 4.14Å; L133-V136 PolarHBondContact O-N 2.91Å; L133-L137 HydrophobicContact CD1-CD1 4.06Å; L133-L137 HydrophobicContact CD1-CG 4.07Å; L133-L137 HydrophobicContact CG-CD1 3.88Å; L133-L137 HydrophobicContact CG-CG 4.31Å; L133-L137 WeakPolarHBondContact O-CB 3.45Å; L133-L137 VanDerWaalsContact O-CG 3.27Å; L133-L137 WeakPolarHBondContact O-CG 3.29Å; L133-L137 PolarHBondContact O-N 3.22Å |
| 134 | W | 72.8 | Confident | 73.8 | Confident | 48 Ų | 48 | 59.1 Ų | 59.1 | 18% | 0.182 | 30% | 0.301 | C | S | . | . | H | α-helix | trans | -60.4 | -53.9 | -179.6 | -171.4 | 8.1 | 0 | 0 | 0 | 113.7 | L29 V32 P33 T86 M132 V136 L137 F138 | L29-W134 HydrophobicContact CD1-CH2 4.26Å; L29-W134 HydrophobicContact CD1-CZ2 4.31Å; L29-W134 HydrophobicContact CG-CH2 4.34Å; L29-W134 HydrophobicContact CG-CZ2 3.99Å; L29-W134 WeakPolarHBondContact O-CH2 3.42Å; V32-W134 HydrophobicContact CB-CH2 4.47Å; V32-W134 HydrophobicContact CB-CZ3 4.41Å; V32-W134 HydrophobicContact CG1-CZ3 4.25Å; P33-W134 HydrophobicContact CB-CD2 4.41Å; P33-W134 HydrophobicContact CB-CE3 4.07Å; P33-W134 HydrophobicContact CB-CZ3 4.43Å; P33-W134 HydrophobicContact CG-CD2 4.13Å; P33-W134 HydrophobicContact CG-CE3 3.99Å; P33-W134 HydrophobicContact CG-CH2 4.25Å; P33-W134 HydrophobicContact CG-CZ2 4.39Å; P33-W134 HydrophobicContact CG-CZ3 4.06Å; T86-W134 HydrophobicContact CG2-CB 4.11Å; M132-W134 VanDerWaalsContact C-N 3.34Å; M132-W134 PolarHBondContact O-N 3.4Å; W134-V136 VanDerWaalsContact C-N 3.32Å; W134-V136 PolarHBondContact O-N 2.78Å; W134-L137 PolarHBondContact O-N 3.46Å; W134-F138 PolarHBondContact O-N 3.2Å |
| 135 | P | 75 | Confident | 73.9 | Confident | 39 Ų | 39 | 57.2 Ų | 57.2 | 25% | 0.253 | 29% | 0.285 | S | S | . | . | H | α-helix | trans | -65.8 | -34.4 | 177.2 | 25.6 | -34.2 | 0 | 0 | 0 | 112.1 | V131 M132 L137 F138 I139 | V131-P135 WeakPolarHBondContact O-CD 3.22Å; M132-P135 VanDerWaalsContact O-CD 3.22Å; M132-P135 WeakPolarHBondContact O-CD 3.36Å; M132-P135 VanDerWaalsContact O-CG 3.27Å; M132-P135 WeakPolarHBondContact O-CG 3.26Å; P135-L137 PolarHBondContact O-N 2.97Å; P135-F138 PolarHBondContact O-N 2.94Å; P135-I139 WeakPolarHBondContact O-CB 3.17Å; P135-I139 WeakPolarHBondContact O-CG1 3.43Å; P135-I139 PolarHBondContact O-N 3.32Å |
| 136 | V | 73.8 | Confident | 73.6 | Confident | 79 Ų | 79 | 52.1 Ų | 52.1 | 48% | 0.479 | 27% | 0.271 | S | S | . | . | H | α-helix | trans | -61 | -46.7 | 175.2 | 170.4 | 0 | 0 | 0 | 0 | 110.5 | M132 L133 W134 F138 I139 V140 | M132-V136 WeakPolarHBondContact O-CB 3.21Å; M132-V136 WeakPolarHBondContact O-CG2 3.36Å; M132-V136 PolarHBondContact O-N 3.34Å; L133-V136 PolarHBondContact O-N 2.91Å; W134-V136 VanDerWaalsContact C-N 3.32Å; W134-V136 PolarHBondContact O-N 2.78Å; V136-F138 VanDerWaalsContact C-N 3.33Å; V136-F138 PolarHBondContact O-N 3.03Å; V136-I139 PolarHBondContact O-N 3.49Å; V136-V140 HydrophobicContact CG1-CG2 4.31Å; V136-V140 WeakPolarHBondContact O-CB 3.33Å; V136-V140 WeakPolarHBondContact O-CG2 3.36Å; V136-V140 PolarHBondContact O-N 2.95Å |
| 137 | L | 75.3 | Confident | 73.4 | Confident | 40 Ų | 40 | 55.1 Ų | 55.1 | 21% | 0.209 | 29% | 0.289 | C | S | . | . | H | α-helix | trans | -64.2 | -37.5 | 177.1 | -71.6 | 174.1 | 0 | 0 | 0 | 112.3 | V85 L133 W134 P135 S141 | V85-L137 HydrophobicContact CB-CD1 4.14Å; V85-L137 HydrophobicContact CG1-CD1 3.71Å; L133-L137 HydrophobicContact CD1-CD1 4.06Å; L133-L137 HydrophobicContact CD1-CG 4.07Å; L133-L137 HydrophobicContact CG-CD1 3.88Å; L133-L137 HydrophobicContact CG-CG 4.31Å; L133-L137 WeakPolarHBondContact O-CB 3.45Å; L133-L137 VanDerWaalsContact O-CG 3.27Å; L133-L137 WeakPolarHBondContact O-CG 3.29Å; L133-L137 PolarHBondContact O-N 3.22Å; W134-L137 PolarHBondContact O-N 3.46Å; P135-L137 PolarHBondContact O-N 2.97Å; L137-S141 WeakPolarHBondContact O-CB 3.35Å; L137-S141 PolarHBondContact O-N 3.46Å; L137-S141 PolarHBondContact O-OG 2.88Å |
| 138 | F | 76.9 | Confident | 72.9 | Confident | 39 Ų | 39 | 56.1 Ų | 56.1 | 17% | 0.171 | 29% | 0.294 | C | S | . | . | H | α-helix | trans | -65.3 | -46.7 | 175 | -179.9 | -104.3 | 0 | 0 | 0 | 111.9 | I30 L75 L79 W134 P135 V136 S141 C142 | I30-F138 HydrophobicContact CD1-CE1 4.25Å; I30-F138 HydrophobicContact CD1-CE2 3.94Å; I30-F138 HydrophobicContact CD1-CZ 3.56Å; I30-F138 HydrophobicContact CG1-CE2 4.46Å; I30-F138 HydrophobicContact CG1-CZ 4.3Å; L75-F138 HydrophobicContact CD2-CE2 4.32Å; L75-F138 HydrophobicContact CD2-CZ 3.86Å; L79-F138 HydrophobicContact CB-CD2 4.23Å; L79-F138 HydrophobicContact CB-CE2 4.04Å; L79-F138 HydrophobicContact CD1-CD2 3.72Å; L79-F138 HydrophobicContact CD1-CE2 3.89Å; W134-F138 PolarHBondContact O-N 3.2Å; P135-F138 PolarHBondContact O-N 2.94Å; V136-F138 VanDerWaalsContact C-N 3.33Å; V136-F138 PolarHBondContact O-N 3.03Å; F138-S141 PolarHBondContact O-N 3.43Å; F138-C142 WeakPolarHBondContact O-CB 3.33Å; F138-C142 PolarHBondContact O-N 2.94Å; F138-C142 PolarHBondContact O-SG 2.7Å |
| 139 | I | 78.7 | Confident | 72.4 | Confident | 94 Ų | 94 | 55.8 Ų | 55.8 | 48% | 0.482 | 30% | 0.303 | S | S | . | . | H | α-helix | trans | -63.4 | -46.1 | 177.8 | -68.2 | 164.4 | 0 | 0 | 0 | 110.1 | P135 V136 S141 C142 L143 | P135-I139 WeakPolarHBondContact O-CB 3.17Å; P135-I139 WeakPolarHBondContact O-CG1 3.43Å; P135-I139 PolarHBondContact O-N 3.32Å; V136-I139 PolarHBondContact O-N 3.49Å; I139-S141 VanDerWaalsContact C-N 3.33Å; I139-S141 PolarHBondContact O-N 2.82Å; I139-C142 PolarHBondContact O-N 3.25Å; I139-L143 HydrophobicContact CG2-CD1 3.77Å; I139-L143 HydrophobicContact CG2-CG 4.09Å; I139-L143 VanDerWaalsContact O-CB 3.3Å; I139-L143 WeakPolarHBondContact O-CB 3.4Å; I139-L143 VanDerWaalsContact O-CG 3.27Å; I139-L143 WeakPolarHBondContact O-CG 3.26Å; I139-L143 PolarHBondContact O-N 3.37Å |
| 140 | V | 78.1 | Confident | 71.7 | Confident | 70 Ų | 70 | 55.5 Ų | 55.5 | 42% | 0.424 | 31% | 0.308 | S | S | . | . | H | α-helix | trans | -60 | -45.4 | 176.8 | 170 | 0 | 0 | 0 | 0 | 110.5 | V136 C142 L143 V144 | V136-V140 HydrophobicContact CG1-CG2 4.31Å; V136-V140 WeakPolarHBondContact O-CB 3.33Å; V136-V140 WeakPolarHBondContact O-CG2 3.36Å; V136-V140 PolarHBondContact O-N 2.95Å; V140-C142 PolarHBondContact O-N 3.06Å; V140-L143 PolarHBondContact O-N 3.41Å; V140-V144 HydrophobicContact CG1-CG2 4.39Å; V140-V144 WeakPolarHBondContact O-CB 3.43Å; V140-V144 VanDerWaalsContact O-CG2 3.23Å; V140-V144 WeakPolarHBondContact O-CG2 3.22Å; V140-V144 PolarHBondContact O-N 2.96Å |
| 141 | S | 78.6 | Confident | 71.1 | Confident | 37 Ų | 37 | 58.2 Ų | 58.2 | 26% | 0.259 | 33% | 0.325 | S | S | . | . | H | α-helix | trans | -64 | -41.5 | 178.9 | -62.3 | 0 | 0 | 0 | 0 | 112 | S78 L137 F138 I139 Q145 | S78-S141 WeakPolarHBondContact OG-CB 3.24Å; L137-S141 WeakPolarHBondContact O-CB 3.35Å; L137-S141 PolarHBondContact O-N 3.46Å; L137-S141 PolarHBondContact O-OG 2.88Å; F138-S141 PolarHBondContact O-N 3.43Å; I139-S141 VanDerWaalsContact C-N 3.33Å; I139-S141 PolarHBondContact O-N 2.82Å; S141-Q145 VanDerWaalsContact O-CD 3.28Å; S141-Q145 WeakPolarHBondContact O-CG 3.02Å; S141-Q145 PolarHBondContact O-N 3.3Å; S141-Q145 PolarHBondContact O-OE1 3.2Å |
| 142 | C | 76.5 | Confident | 70.1 | Confident | 14 Ų | 14 | 62.3 Ų | 62.3 | 10% | 0.095 | 35% | 0.347 | C | S | . | . | H | α-helix | trans | -65.4 | -45.5 | 173.6 | -67.6 | 0 | 0 | 0 | 0 | 112.1 | L75 F138 I139 V140 V144 Q145 I146 | L75-C142 WeakPolarHBondContact CD2-SG 3.42Å; F138-C142 WeakPolarHBondContact O-CB 3.33Å; F138-C142 PolarHBondContact O-N 2.94Å; F138-C142 PolarHBondContact O-SG 2.7Å; I139-C142 PolarHBondContact O-N 3.25Å; V140-C142 PolarHBondContact O-N 3.06Å; C142-V144 PolarHBondContact O-N 3.46Å; C142-Q145 CarbonylContact O-C 3.52Å; C142-Q145 PolarHBondContact O-N 2.83Å; C142-Q145 VanDerWaalsContact O-N 3.12Å; C142-I146 WeakPolarHBondContact O-CB 3.04Å; C142-I146 VanDerWaalsContact O-CG1 3.27Å; C142-I146 WeakPolarHBondContact O-CG1 3.16Å; C142-I146 PolarHBondContact O-N 2.62Å |
| 143 | L | 78 | Confident | 68.9 | Low | 86 Ų | 86 | 67.5 Ų | 67.5 | 45% | 0.45 | 37% | 0.367 | S | S | . | . | H | α-helix | trans | -62.5 | -43.9 | 178.9 | -76.9 | 177.7 | 0 | 0 | 0 | 110.9 | I139 V140 Q145 I146 L147 | I139-L143 HydrophobicContact CG2-CD1 3.77Å; I139-L143 HydrophobicContact CG2-CG 4.09Å; I139-L143 VanDerWaalsContact O-CB 3.3Å; I139-L143 WeakPolarHBondContact O-CB 3.4Å; I139-L143 VanDerWaalsContact O-CG 3.27Å; I139-L143 WeakPolarHBondContact O-CG 3.26Å; I139-L143 PolarHBondContact O-N 3.37Å; V140-L143 PolarHBondContact O-N 3.41Å; L143-Q145 PolarHBondContact O-N 3.2Å; L143-I146 PolarHBondContact O-N 3.26Å; L143-L147 HydrophobicContact CB-CD1 4.45Å; L143-L147 WeakPolarHBondContact O-CB 3.43Å; L143-L147 WeakPolarHBondContact O-CD1 3.35Å; L143-L147 WeakPolarHBondContact O-CG 3.15Å; L143-L147 PolarHBondContact O-N 2.84Å |
| 144 | V | 74.3 | Confident | 67.3 | Low | 46 Ų | 46 | 71.1 Ų | 71.1 | 28% | 0.279 | 39% | 0.392 | S | S | . | . | H | α-helix | trans | -55.9 | -43.2 | 174.2 | 168.8 | 0 | 0 | 0 | 0 | 110 | V140 C142 L148 L174 | V140-V144 HydrophobicContact CG1-CG2 4.39Å; V140-V144 WeakPolarHBondContact O-CB 3.43Å; V140-V144 VanDerWaalsContact O-CG2 3.23Å; V140-V144 WeakPolarHBondContact O-CG2 3.22Å; V140-V144 PolarHBondContact O-N 2.96Å; C142-V144 PolarHBondContact O-N 3.46Å; V144-L148 HydrophobicContact CG1-CD1 4.03Å; V144-L148 WeakPolarHBondContact O-CB 3.38Å; V144-L148 WeakPolarHBondContact O-CD1 3.34Å; V144-L148 PolarHBondContact O-N 2.83Å; V144-L174 HydrophobicContact CG2-CD1 4.39Å |
| 145 | Q | 71.4 | Confident | 66.4 | Low | 38 Ų | 38 | 78.4 Ų | 78.4 | 18% | 0.178 | 43% | 0.427 | C | S | . | . | H | α-helix | trans | -73.6 | -35 | -179.7 | -66.7 | 163.3 | -20.8 | 0 | 0 | 113.8 | I74 S141 C142 L143 L148 T149 | I74-Q145 HydrophobicContact CG2-CB 3.46Å; I74-Q145 VanDerWaalsContact CG2-CB 3.46Å; I74-Q145 HydrophobicContact CG2-CG 3.77Å; I74-Q145 PolarHBondContact O-NE2 2.82Å; I74-Q145 PolarHBondContact O-OE1 3.4Å; I74-Q145 VanDerWaalsContact O-OE1 3.14Å; S141-Q145 VanDerWaalsContact O-CD 3.28Å; S141-Q145 WeakPolarHBondContact O-CG 3.02Å; S141-Q145 PolarHBondContact O-N 3.3Å; S141-Q145 PolarHBondContact O-OE1 3.2Å; C142-Q145 CarbonylContact O-C 3.52Å; C142-Q145 PolarHBondContact O-N 2.83Å; C142-Q145 VanDerWaalsContact O-N 3.12Å; L143-Q145 PolarHBondContact O-N 3.2Å; Q145-L148 WeakPolarHBondContact O-CB 3.24Å; Q145-T149 PolarHBondContact O-N 3.48Å; Q145-T149 VanDerWaalsContact O-N 3.15Å; Q145-T149 PolarHBondContact O-OG1 3.23Å |
| 146 | I | 68.4 | Low | 65.2 | Low | 85 Ų | 85 | 85 Ų | 85 | 44% | 0.436 | 45% | 0.452 | S | S | . | . | H | α-helix | trans | -72.8 | -43 | 176 | -68.2 | 164.8 | 0 | 0 | 0 | 110.4 | C142 L143 L148 T149 S150 | C142-I146 WeakPolarHBondContact O-CB 3.04Å; C142-I146 VanDerWaalsContact O-CG1 3.27Å; C142-I146 WeakPolarHBondContact O-CG1 3.16Å; C142-I146 PolarHBondContact O-N 2.62Å; L143-I146 PolarHBondContact O-N 3.26Å; I146-L148 VanDerWaalsContact C-N 3.3Å; I146-L148 PolarHBondContact O-N 2.99Å; I146-T149 CarbonylContact O-C 3.59Å; I146-T149 WeakPolarHBondContact O-CA 3.48Å; I146-T149 WeakPolarHBondContact O-CB 3.36Å; I146-T149 PolarHBondContact O-N 2.93Å; I146-S150 PolarHBondContact O-N 3.44Å; I146-S150 PolarHBondContact O-OG 2.85Å |
| 147 | L | 64.2 | Low | 63.7 | Low | 101 Ų | 101 | 89.3 Ų | 89.3 | 53% | 0.529 | 47% | 0.467 | S | S | . | . | H | α-helix | trans | -63.7 | -37.3 | 173.4 | -68.3 | 167.7 | 0 | 0 | 0 | 110.8 | L143 T149 S150 V151 | L143-L147 HydrophobicContact CB-CD1 4.45Å; L143-L147 WeakPolarHBondContact O-CB 3.43Å; L143-L147 WeakPolarHBondContact O-CD1 3.35Å; L143-L147 WeakPolarHBondContact O-CG 3.15Å; L143-L147 PolarHBondContact O-N 2.84Å; L147-T149 PolarHBondContact O-N 3.49Å; L147-S150 PolarHBondContact O-OG 3.07Å; L147-V151 WeakPolarHBondContact O-CG2 3.2Å; L147-V151 PolarHBondContact O-N 3.34Å |
| 148 | L | 58.9 | Low | 62.4 | Low | 25 Ų | 25 | 89.3 Ų | 89.3 | 13% | 0.131 | 48% | 0.476 | C | S | . | . | H | α-helix | trans | -57.8 | -35 | 168.8 | -111.5 | 83.1 | 0 | 0 | 0 | 112.7 | V144 Q145 I146 F163 F166 R167 A170 | V144-L148 HydrophobicContact CG1-CD1 4.03Å; V144-L148 WeakPolarHBondContact O-CB 3.38Å; V144-L148 WeakPolarHBondContact O-CD1 3.34Å; V144-L148 PolarHBondContact O-N 2.83Å; Q145-L148 WeakPolarHBondContact O-CB 3.24Å; I146-L148 VanDerWaalsContact C-N 3.3Å; I146-L148 PolarHBondContact O-N 2.99Å; L148-F163 HydrophobicContact CD2-CE1 4.29Å; L148-F163 HydrophobicContact CD2-CZ 4.42Å; L148-F166 HydrophobicContact CD1-CD1 3.37Å; L148-F166 HydrophobicContact CD1-CE1 3.18Å; L148-F166 HydrophobicContact CD1-CZ 4.39Å; L148-F166 HydrophobicContact CD2-CD1 4Å; L148-F166 HydrophobicContact CG-CD1 3.33Å; L148-F166 HydrophobicContact CG-CE1 3.56Å; L148-F166 HydrophobicContact CG-CG 4.35Å; L148-R167 HydrophobicContact CD2-CG 3.59Å; L148-A170 HydrophobicContact CD1-CB 4.48Å |
| 149 | T | 61.6 | Low | 61.1 | Low | 92 Ų | 92 | 90.2 Ų | 90.2 | 56% | 0.564 | 50% | 0.497 | S | S | * | . | H | α-helix | trans | -86.8 | -32.2 | -174 | -57.7 | 0 | 0 | 0 | 0 | 112.2 | Q145 I146 L147 | Q145-T149 PolarHBondContact O-N 3.48Å; Q145-T149 VanDerWaalsContact O-N 3.15Å; Q145-T149 PolarHBondContact O-OG1 3.23Å; I146-T149 CarbonylContact O-C 3.59Å; I146-T149 WeakPolarHBondContact O-CA 3.48Å; I146-T149 WeakPolarHBondContact O-CB 3.36Å; I146-T149 PolarHBondContact O-N 2.93Å; L147-T149 PolarHBondContact O-N 3.49Å |
| 150 | S | 56.8 | Low | 59.6 | Low | 78 Ų | 78 | 92.9 Ų | 92.9 | 55% | 0.545 | 51% | 0.511 | S | S | . | . | H | α-helix | trans | -80.6 | -19.7 | -178.1 | 68.4 | 0 | 0 | 0 | 0 | 113.4 | I146 L147 N152 | I146-S150 PolarHBondContact O-N 3.44Å; I146-S150 PolarHBondContact O-OG 2.85Å; L147-S150 PolarHBondContact O-OG 3.07Å; S150-N152 VanDerWaalsContact C-N 3.28Å; S150-N152 PolarHBondContact O-N 2.88Å |
| 151 | V | 56.7 | Low | 58.4 | Low | 73 Ų | 73 | 93.8 Ų | 93.8 | 44% | 0.442 | 52% | 0.517 | S | S | . | . | S | Bend | trans | -81.1 | 81 | 177.2 | -174.8 | 0 | 0 | 0 | 0 | 109.9 | L147 | L147-V151 WeakPolarHBondContact O-CG2 3.2Å; L147-V151 PolarHBondContact O-N 3.34Å |
| 152 | N | 47 | Very low | 57.3 | Low | 111 Ų | 111 | 95.7 Ų | 95.7 | 59% | 0.594 | 53% | 0.53 | S | S | * | . | trans | 59.6 | 128.5 | 140.5 | -59.1 | -74 | 0 | 0 | 0 | 119.1 | S150 | S150-N152 VanDerWaalsContact C-N 3.28Å; S150-N152 PolarHBondContact O-N 2.88Å | ||
| 153 | F | 46.4 | Very low | 56.2 | Low | 180 Ų | 180 | 99 Ų | 99 | 79% | 0.789 | 54% | 0.543 | S | S | * | . | 151 | 95.8 | 110.5 | -76.7 | -65.6 | 0 | 0 | 0 | 110.2 | H155 | F153-H155 PolarHBondContact O-N 2.87Š| |||
| 154 | T | 44.1 | Very low | 55.2 | Low | 119 Ų | 119 | 99.8 Ų | 99.8 | 73% | 0.73 | 55% | 0.547 | S | S | * | . | trans | 29.7 | 92.8 | 134.8 | -50.9 | 0 | 0 | 0 | 0 | 116.7 | K156 | T154-K156 PolarHBondContact O-N 3.47Š| ||
| 155 | H | 52.7 | Low | 54.6 | Low | 201 Ų | 201 | 104.7 Ų | 104.7 | 93% | 0.931 | 57% | 0.565 | S | S | * | * | S | Bend | trans | 28.8 | 23.5 | 140.8 | -102.7 | -80.3 | 0 | 0 | 0 | 122.3 | F153 | F153-H155 PolarHBondContact O-N 2.87Š|
| 156 | K | 50.4 | Low | 54.1 | Low | 178 Ų | 178 | 107.2 Ų | 107.2 | 77% | 0.774 | 58% | 0.575 | S | S | * | * | S | Bend | trans | -134 | 107.1 | 174.2 | -69 | -169.7 | 172.9 | -177.9 | 0 | 109.9 | T154 | T154-K156 PolarHBondContact O-N 3.47Š|
| 157 | E | 43.6 | Very low | 53.8 | Low | 168 Ų | 168 | 110.3 Ų | 110.3 | 79% | 0.785 | 58% | 0.581 | S | S | * | * | S | Bend | trans | 39.6 | 92.4 | 151 | -74.1 | 162.4 | 139.2 | 0 | 0 | 117.2 | ||
| 158 | G | 47.4 | Very low | 53.7 | Low | 40 Ų | 40 | 110.4 Ų | 110.4 | 41% | 0.412 | 58% | 0.582 | S | S | . | * | trans | 148 | 1.2 | 161.9 | 0 | 0 | 0 | 0 | 0 | 118.1 | L160 V161 S162 | G158-L160 PolarHBondContact O-N 3.11Å; G158-V161 PolarHBondContact O-N 3.25Å; G158-S162 PolarHBondContact O-N 3.41Å | ||
| 159 | G | 49.1 | Very low | 54 | Low | 59 Ų | 59 | 112.3 Ų | 112.3 | 61% | 0.608 | 60% | 0.597 | S | S | * | * | H | α-helix | trans | -48.1 | -34.2 | -166 | 0 | 0 | 0 | 0 | 0 | 117 | F163 | G159-F163 WeakPolarHBondContact O-CB 3.42Å; G159-F163 PolarHBondContact O-N 3.27Å; G159-F163 VanDerWaalsContact O-N 3.13Å |
| 160 | L | 46.5 | Very low | 53.9 | Low | 149 Ų | 149 | 108.8 Ų | 108.8 | 78% | 0.78 | 58% | 0.577 | S | S | * | * | H | α-helix | trans | -76 | -30.4 | -178.7 | -160.2 | 128.8 | 0 | 0 | 0 | 113.6 | G158 L164 | G158-L160 PolarHBondContact O-N 3.11Å; L160-L164 PolarHBondContact O-N 3.11Å |
| 161 | V | 54 | Low | 54 | Low | 89 Ų | 89 | 108.6 Ų | 108.6 | 54% | 0.539 | 58% | 0.575 | S | S | . | * | H | α-helix | trans | -75.5 | -40.2 | 178.3 | 178.6 | 0 | 0 | 0 | 0 | 110.4 | G158 F163 L164 K165 | G158-V161 PolarHBondContact O-N 3.25Å; V161-F163 VanDerWaalsContact C-N 3.28Å; V161-F163 PolarHBondContact O-N 2.92Å; V161-L164 PolarHBondContact O-N 3.31Å; V161-K165 HydrophobicContact CG1-CD 4.37Å; V161-K165 WeakPolarHBondContact O-CB 3.32Å; V161-K165 WeakPolarHBondContact O-CG 3.29Å; V161-K165 PolarHBondContact O-N 2.95Å |
| 162 | S | 55.9 | Low | 54.2 | Low | 78 Ų | 78 | 114.5 Ų | 114.5 | 55% | 0.545 | 59% | 0.59 | S | S | . | * | H | α-helix | trans | -61.5 | -40.8 | 172.8 | -55 | 0 | 0 | 0 | 0 | 110.8 | G158 L164 K165 F166 | G158-S162 PolarHBondContact O-N 3.41Å; S162-L164 PolarHBondContact O-N 3.5Å; S162-K165 PolarHBondContact O-N 3.3Å; S162-F166 WeakPolarHBondContact O-CB 3.15Å; S162-F166 PolarHBondContact O-N 2.94Å |
| 163 | F | 53.2 | Low | 54.9 | Low | 84 Ų | 84 | 113 Ų | 113 | 37% | 0.368 | 59% | 0.592 | S | S | . | * | H | α-helix | trans | -60.9 | -44.8 | 175.3 | -137.8 | -97.6 | 0 | 0 | 0 | 112.5 | L148 G159 V161 F166 R167 | L148-F163 HydrophobicContact CD2-CE1 4.29Å; L148-F163 HydrophobicContact CD2-CZ 4.42Å; G159-F163 WeakPolarHBondContact O-CB 3.42Å; G159-F163 PolarHBondContact O-N 3.27Å; G159-F163 VanDerWaalsContact O-N 3.13Å; V161-F163 VanDerWaalsContact C-N 3.28Å; V161-F163 PolarHBondContact O-N 2.92Å; F163-F166 PolarHBondContact O-N 3.5Å; F163-R167 HydrophobicContact CD1-CG 4.42Å; F163-R167 WeakPolarHBondContact O-CB 3.25Å; F163-R167 VanDerWaalsContact O-CG 3.3Å; F163-R167 WeakPolarHBondContact O-CG 3.34Å; F163-R167 PolarHBondContact O-N 3.44Å |
| 164 | L | 56.4 | Low | 55.3 | Low | 101 Ų | 101 | 110.3 Ų | 110.3 | 53% | 0.529 | 59% | 0.586 | S | S | . | * | H | α-helix | trans | -68.7 | -42.1 | 179.2 | -166.6 | 69.3 | 0 | 0 | 0 | 111.9 | L160 V161 S162 R167 I168 | L160-L164 PolarHBondContact O-N 3.11Å; V161-L164 PolarHBondContact O-N 3.31Å; S162-L164 PolarHBondContact O-N 3.5Å; L164-R167 PolarHBondContact O-N 3.28Å; L164-I168 HydrophobicContact CG-CD1 4.15Å; L164-I168 VanDerWaalsContact O-CG1 3.27Å; L164-I168 WeakPolarHBondContact O-CG1 3.4Å; L164-I168 PolarHBondContact O-N 3.48Å |
| 165 | K | 62 | Low | 56 | Low | 150 Ų | 150 | 109.5 Ų | 109.5 | 65% | 0.652 | 58% | 0.576 | S | S | * | * | H | α-helix | trans | -62.3 | -42.1 | 175.5 | -76.2 | -178 | 176.2 | -179 | 0 | 111.8 | V161 S162 I168 S169 | V161-K165 HydrophobicContact CG1-CD 4.37Å; V161-K165 WeakPolarHBondContact O-CB 3.32Å; V161-K165 WeakPolarHBondContact O-CG 3.29Å; V161-K165 PolarHBondContact O-N 2.95Å; S162-K165 PolarHBondContact O-N 3.3Å; K165-I168 PolarHBondContact O-N 3.42Å; K165-S169 WeakPolarHBondContact O-CB 3.49Å; K165-S169 PolarHBondContact O-N 2.87Å |
| 166 | F | 60.7 | Low | 55.9 | Low | 91 Ų | 91 | 102.2 Ų | 102.2 | 40% | 0.399 | 56% | 0.556 | S | S | . | * | H | α-helix | trans | -68.1 | -44.3 | 177.7 | -163.8 | -77.2 | 0 | 0 | 0 | 111.5 | L148 S162 F163 I168 S169 A170 | L148-F166 HydrophobicContact CD1-CD1 3.37Å; L148-F166 HydrophobicContact CD1-CE1 3.18Å; L148-F166 HydrophobicContact CD1-CZ 4.39Å; L148-F166 HydrophobicContact CD2-CD1 4Å; L148-F166 HydrophobicContact CG-CD1 3.33Å; L148-F166 HydrophobicContact CG-CE1 3.56Å; L148-F166 HydrophobicContact CG-CG 4.35Å; S162-F166 WeakPolarHBondContact O-CB 3.15Å; S162-F166 PolarHBondContact O-N 2.94Å; F163-F166 PolarHBondContact O-N 3.5Å; F166-I168 VanDerWaalsContact C-N 3.3Å; F166-I168 PolarHBondContact O-N 3.26Å; F166-S169 PolarHBondContact O-N 3.45Å; F166-S169 VanDerWaalsContact O-N 3.14Å; F166-A170 HydrophobicContact CD1-CB 4.26Å; F166-A170 HydrophobicContact CE1-CB 4.17Å; F166-A170 WeakPolarHBondContact O-CB 3.2Å; F166-A170 PolarHBondContact O-N 3.21Å |
| 167 | R | 61.8 | Low | 55.7 | Low | 149 Ų | 149 | 105.5 Ų | 105.5 | 56% | 0.562 | 56% | 0.563 | S | S | * | * | H | α-helix | trans | -56.5 | -43 | 174.2 | -76.3 | 179.2 | 71.5 | 178.6 | 3.6 | 112.1 | L148 F163 L164 C171 | L148-R167 HydrophobicContact CD2-CG 3.59Å; F163-R167 HydrophobicContact CD1-CG 4.42Å; F163-R167 WeakPolarHBondContact O-CB 3.25Å; F163-R167 VanDerWaalsContact O-CG 3.3Å; F163-R167 WeakPolarHBondContact O-CG 3.34Å; F163-R167 PolarHBondContact O-N 3.44Å; L164-R167 PolarHBondContact O-N 3.28Å; R167-C171 WeakPolarHBondContact O-CB 3.28Å; R167-C171 PolarHBondContact O-N 2.99Å; R167-C171 PolarHBondContact O-SG 2.97Å |
| 168 | I | 63.1 | Low | 55.6 | Low | 104 Ų | 104 | 107.6 Ų | 107.6 | 53% | 0.533 | 56% | 0.564 | S | S | . | * | H | α-helix | trans | -66.7 | -42.3 | 176.4 | -67.4 | 166 | 0 | 0 | 0 | 111 | L164 K165 F166 C171 R172 | L164-I168 HydrophobicContact CG-CD1 4.15Å; L164-I168 VanDerWaalsContact O-CG1 3.27Å; L164-I168 WeakPolarHBondContact O-CG1 3.4Å; L164-I168 PolarHBondContact O-N 3.48Å; K165-I168 PolarHBondContact O-N 3.42Å; F166-I168 VanDerWaalsContact C-N 3.3Å; F166-I168 PolarHBondContact O-N 3.26Å; I168-C171 PolarHBondContact O-N 2.92Å; I168-R172 WeakPolarHBondContact O-CB 3.3Å; I168-R172 PolarHBondContact O-N 3.4Å |
| 169 | S | 64 | Low | 55.8 | Low | 64 Ų | 64 | 113.8 Ų | 113.8 | 45% | 0.448 | 58% | 0.582 | S | S | . | * | H | α-helix | trans | -67.3 | -38.3 | 178.2 | -167.4 | 0 | 0 | 0 | 0 | 112.7 | K165 F166 R172 A173 | K165-S169 WeakPolarHBondContact O-CB 3.49Å; K165-S169 PolarHBondContact O-N 2.87Å; F166-S169 PolarHBondContact O-N 3.45Å; F166-S169 VanDerWaalsContact O-N 3.14Å; S169-R172 WeakPolarHBondContact O-CB 3.47Å; S169-R172 PolarHBondContact O-N 2.93Å; S169-A173 WeakPolarHBondContact O-CB 3.43Å; S169-A173 PolarHBondContact O-N 3.35Å |
| 170 | A | 60.4 | Low | 55.8 | Low | 19 Ų | 19 | 118.4 Ų | 118.4 | 16% | 0.157 | 59% | 0.592 | C | S | . | * | H | α-helix | trans | -70.2 | -41.6 | 176.1 | 0 | 0 | 0 | 0 | 0 | 111.3 | L148 F166 R172 A173 L174 | L148-A170 HydrophobicContact CD1-CB 4.48Å; F166-A170 HydrophobicContact CD1-CB 4.26Å; F166-A170 HydrophobicContact CE1-CB 4.17Å; F166-A170 WeakPolarHBondContact O-CB 3.2Å; F166-A170 PolarHBondContact O-N 3.21Å; A170-R172 VanDerWaalsContact C-N 3.26Å; A170-R172 PolarHBondContact O-N 3.48Å; A170-A173 PolarHBondContact O-N 3.21Å; A170-L174 WeakPolarHBondContact O-CB 3.39Å; A170-L174 PolarHBondContact O-N 2.96Å |
| 171 | C | 58 | Low | 56.1 | Low | 74 Ų | 74 | 115.4 Ų | 115.4 | 50% | 0.5 | 58% | 0.581 | S | S | . | * | H | α-helix | trans | -58.8 | -39.3 | 168.1 | -80.1 | 0 | 0 | 0 | 0 | 111.3 | R167 I168 A173 L175 | R167-C171 WeakPolarHBondContact O-CB 3.28Å; R167-C171 PolarHBondContact O-N 2.99Å; R167-C171 PolarHBondContact O-SG 2.97Å; I168-C171 PolarHBondContact O-N 2.92Å; C171-A173 PolarHBondContact O-N 2.98Å; C171-L175 HydrophobicContact CB-CD1 4.16Å; C171-L175 VanDerWaalsContact O-CB 3.26Å; C171-L175 WeakPolarHBondContact O-CB 3.44Å; C171-L175 VanDerWaalsContact O-CD1 3.24Å; C171-L175 WeakPolarHBondContact O-CD1 3.14Å; C171-L175 PolarHBondContact O-N 2.89Å |
| 172 | R | 60.9 | Low | 56 | Low | 197 Ų | 197 | 116.2 Ų | 116.2 | 74% | 0.743 | 59% | 0.588 | S | S | * | * | H | α-helix | trans | -66.8 | -34.9 | 176.9 | -161.2 | 176.2 | 78.7 | 108.6 | 1.1 | 112.7 | I168 S169 A170 G176 | I168-R172 WeakPolarHBondContact O-CB 3.3Å; I168-R172 PolarHBondContact O-N 3.4Å; S169-R172 WeakPolarHBondContact O-CB 3.47Å; S169-R172 PolarHBondContact O-N 2.93Å; A170-R172 VanDerWaalsContact C-N 3.26Å; A170-R172 PolarHBondContact O-N 3.48Å; R172-G176 PolarHBondContact O-N 3.39Å |
| 173 | A | 61.2 | Low | 55.5 | Low | 79 Ų | 79 | 122.2 Ų | 122.2 | 65% | 0.653 | 60% | 0.599 | S | S | * | * | H | α-helix | trans | -77.6 | -42.2 | 178.4 | 0 | 0 | 0 | 0 | 0 | 112.6 | S169 A170 C171 | S169-A173 WeakPolarHBondContact O-CB 3.43Å; S169-A173 PolarHBondContact O-N 3.35Å; A170-A173 PolarHBondContact O-N 3.21Å; C171-A173 PolarHBondContact O-N 2.98Å |
| 174 | L | 56.2 | Low | 55.2 | Low | 124 Ų | 124 | 123.4 Ų | 123.4 | 65% | 0.649 | 61% | 0.614 | S | S | * | * | H | α-helix | trans | -77.4 | -37.5 | -178.7 | -75.3 | 165.5 | 0 | 0 | 0 | 112.7 | V144 A170 G176 | V144-L174 HydrophobicContact CG2-CD1 4.39Å; A170-L174 WeakPolarHBondContact O-CB 3.39Å; A170-L174 PolarHBondContact O-N 2.96Å; L174-G176 VanDerWaalsContact C-N 3.32Å |
| 175 | L | 58.1 | Low | 54.7 | Low | 101 Ų | 101 | 123.9 Ų | 123.9 | 53% | 0.529 | 62% | 0.62 | S | S | . | * | S | Bend | trans | -85.2 | -4 | 177.2 | -75.1 | 97.4 | 0 | 0 | 0 | 113.7 | C171 W177 | C171-L175 HydrophobicContact CB-CD1 4.16Å; C171-L175 VanDerWaalsContact O-CB 3.26Å; C171-L175 WeakPolarHBondContact O-CB 3.44Å; C171-L175 VanDerWaalsContact O-CD1 3.24Å; C171-L175 WeakPolarHBondContact O-CD1 3.14Å; C171-L175 PolarHBondContact O-N 2.89Å; L175-W177 PolarHBondContact O-N 3.2Å |
| 176 | G | 50.3 | Low | 53.9 | Low | 49 Ų | 49 | 122.4 Ų | 122.4 | 51% | 0.505 | 62% | 0.619 | S | S | . | * | trans | 50.7 | -31 | 161.4 | 0 | 0 | 0 | 0 | 0 | 120.8 | R172 L174 | R172-G176 PolarHBondContact O-N 3.39Å; L174-G176 VanDerWaalsContact C-N 3.32Å | ||
| 177 | W | 46 | Very low | 53 | Low | 246 Ų | 246 | 124.6 Ų | 124.6 | 93% | 0.932 | 64% | 0.64 | S | S | * | * | S | Bend | trans | -147.4 | 3.9 | -154.5 | -85.4 | 56.9 | 0 | 0 | 0 | 112.4 | L175 | L175-W177 PolarHBondContact O-N 3.2Š|
| 178 | W | 42.9 | Very low | 52.1 | Low | 213 Ų | 213 | 125.5 Ų | 125.5 | 81% | 0.807 | 65% | 0.648 | S | S | * | * | trans | -99.8 | 111.4 | 174.3 | -73.8 | 93.4 | 0 | 0 | 0 | 111.8 | L180 | W178-L180 VanDerWaalsContact C-N 3.27Å; W178-L180 PolarHBondContact O-N 2.91Å | ||
| 179 | H | 51.4 | Low | 51 | Low | 169 Ų | 169 | 129 Ų | 129 | 78% | 0.782 | 66% | 0.662 | S | S | * | * | trans | -59.5 | 76.2 | 175.8 | -172.4 | -75.4 | 0 | 0 | 0 | 111.9 | P181 | H179-P181 WeakPolarHBondContact O-CD 3.43Š| ||
| 180 | L | 48.4 | Very low | 50 | Low | 157 Ų | 157 | 136.2 Ų | 136.2 | 82% | 0.822 | 69% | 0.685 | S | S | * | * | trans | -86.1 | 110.5 | 165.3 | -131.3 | 76.2 | 0 | 0 | 0 | 108.1 | W178 | W178-L180 VanDerWaalsContact C-N 3.27Å; W178-L180 PolarHBondContact O-N 2.91Å | ||
| 181 | P | 53.7 | Low | 49.1 | Very low | 85 Ų | 85 | 140.9 Ų | 140.9 | 55% | 0.552 | 71% | 0.714 | S | S | * | * | trans | -61 | 142.6 | -178.9 | 24 | -32.3 | 0 | 0 | 0 | 110.3 | H179 R183 | H179-P181 WeakPolarHBondContact O-CD 3.43Å; P181-R183 PolarHBondContact O-N 2.98Å | ||
| 182 | P | 51.7 | Low | 48.2 | Very low | 106 Ų | 106 | 141.1 Ų | 141.1 | 69% | 0.688 | 73% | 0.729 | S | S | * | * | trans | -63 | 111.5 | 175.7 | 25.2 | -30.9 | 0 | 0 | 0 | 108.5 | T184 | P182-T184 PolarHBondContact O-N 3.08Š| ||
| 183 | R | 44.3 | Very low | 47.2 | Very low | 205 Ų | 205 | 139.7 Ų | 139.7 | 77% | 0.774 | 74% | 0.736 | S | S | * | * | trans | -74.5 | 59.3 | 162.5 | -89.2 | -168 | 167.9 | 168.3 | -1.5 | 110.2 | P181 | P181-R183 PolarHBondContact O-N 2.98Š| ||
| 184 | T | 48.2 | Very low | 46.2 | Very low | 109 Ų | 109 | 139 Ų | 139 | 67% | 0.669 | 74% | 0.737 | S | S | * | * | trans | -86.1 | 129.4 | 136.4 | 51.1 | 0 | 0 | 0 | 0 | 104.7 | P182 | P182-T184 PolarHBondContact O-N 3.08Š| ||
| 185 | V | 46.4 | Very low | 45.6 | Very low | 111 Ų | 111 | 141.9 Ų | 141.9 | 67% | 0.673 | 75% | 0.747 | S | S | * | * | trans | 91.3 | 58 | -169.5 | -161.2 | 0 | 0 | 0 | 0 | 114.5 | ||||
| 186 | L | 43.5 | Very low | 44.5 | Very low | 118 Ų | 118 | 147 Ų | 147 | 62% | 0.618 | 76% | 0.759 | S | S | * | * | S | Bend | trans | -133 | 45.9 | 151.1 | -155.4 | 81 | 0 | 0 | 0 | 110.7 | ||
| 187 | T | 43.6 | Very low | 44 | Very low | 137 Ų | 137 | 154.2 Ų | 154.2 | 84% | 0.84 | 78% | 0.777 | S | S | * | * | S | Bend | trans | -146.2 | 41 | 164.4 | 48.2 | 0 | 0 | 0 | 0 | 109.8 | ||
| 188 | K | 42 | Very low | 43.8 | Very low | 168 Ų | 168 | 150.1 Ų | 150.1 | 73% | 0.73 | 77% | 0.768 | S | S | * | * | S | Bend | trans | -147.4 | 128.2 | 166.4 | -73.2 | -174.7 | 176.6 | 172.4 | 0 | 106.1 | ||
| 189 | H | 39.1 | Very low | 43.5 | Very low | 178 Ų | 178 | 152.2 Ų | 152.2 | 82% | 0.824 | 78% | 0.776 | S | S | * | * | trans | 89.1 | 78.1 | -169.6 | -71.4 | -95.7 | 0 | 0 | 0 | 116.9 | ||||
| 190 | F | 43.6 | Very low | 42.9 | Very low | 215 Ų | 215 | 151.7 Ų | 151.7 | 94% | 0.943 | 78% | 0.778 | S | S | * | * | trans | -119.8 | 125.2 | 132.1 | -91 | -83 | 0 | 0 | 0 | 107.9 | ||||
| 191 | P | 42.2 | Very low | 42.4 | Very low | 118 Ų | 118 | 153.5 Ų | 153.5 | 77% | 0.766 | 78% | 0.779 | S | S | * | * | trans | -95.2 | 162.1 | -172.5 | 37.6 | -33.6 | 0 | 0 | 0 | 113.1 | ||||
| 192 | G | 39.4 | Very low | 41.9 | Very low | 79 Ų | 79 | 157.5 Ų | 157.5 | 81% | 0.814 | 79% | 0.79 | S | S | * | * | trans | 109.6 | 132.2 | 170.2 | 0 | 0 | 0 | 0 | 0 | 112.5 | ||||
| 193 | N | 39.8 | Very low | 41.5 | Very low | 166 Ų | 166 | 158 Ų | 158 | 89% | 0.888 | 79% | 0.793 | S | S | * | * | cis | -166.3 | 143.2 | 10.4 | -170.8 | 14.1 | 0 | 0 | 0 | 108.2 | ||||
| 194 | G | 40.5 | Very low | 41.3 | Very low | 65 Ų | 65 | 151.7 Ų | 151.7 | 67% | 0.67 | 79% | 0.792 | S | S | * | * | trans | 49 | 139.8 | 157.9 | 0 | 0 | 0 | 0 | 0 | 120.8 | ||||
| 195 | Q | 42 | Very low | 40.8 | Very low | 185 Ų | 185 | 156.5 Ų | 156.5 | 86% | 0.864 | 80% | 0.804 | S | S | * | * | cis | -160.2 | 127.9 | 12.7 | -70.9 | -156.4 | -28.8 | 0 | 0 | 106.4 | ||||
| 196 | R | 35.8 | Very low | 40.4 | Very low | 208 Ų | 208 | 156.1 Ų | 156.1 | 79% | 0.785 | 81% | 0.806 | S | S | * | * | 58.8 | 108 | 86.5 | -155.2 | -179 | -168 | -172.5 | 4.8 | 115.8 | |||||
| 197 | K | 39.6 | Very low | 40.4 | Very low | 201 Ų | 201 | 159 Ų | 159 | 87% | 0.874 | 82% | 0.816 | S | S | * | * | trans | 174.5 | 86 | 131 | -96.2 | 179.1 | -176.5 | -173.7 | 0 | 108.2 | ||||
| 198 | Q | 41.6 | Very low | 40.5 | Very low | 159 Ų | 159 | 158.4 Ų | 158.4 | 74% | 0.743 | 81% | 0.808 | S | S | * | * | 38.1 | 109.8 | 95.4 | -76.7 | -173.3 | -12.9 | 0 | 0 | 115.7 | |||||
| 199 | R | 36.6 | Very low | 40.6 | Very low | 258 Ų | 258 | 157.7 Ų | 157.7 | 97% | 0.974 | 81% | 0.812 | S | S | * | * | -169 | 144.5 | 105.9 | -105.4 | -174.8 | -168.2 | -126.4 | 3.6 | 112.1 | |||||
| 200 | L | 39.1 | Very low | 40.7 | Very low | 158 Ų | 158 | 156.6 Ų | 156.6 | 83% | 0.827 | 81% | 0.806 | S | S | * | * | trans | -124.1 | 143.5 | -166.1 | -175.1 | 96.1 | 0 | 0 | 0 | 107.9 | ||||
| 201 | K | 38.8 | Very low | 40.7 | Very low | 194 Ų | 194 | 155.5 Ų | 155.5 | 84% | 0.843 | 80% | 0.795 | S | S | * | * | trans | 146.7 | 145.1 | 153.4 | -93 | -176.2 | 175.6 | -164.2 | 0 | 109.7 | ||||
| 202 | H | 43.3 | Very low | 40.8 | Very low | 169 Ų | 169 | 156.8 Ų | 156.8 | 78% | 0.782 | 80% | 0.796 | S | S | * | * | cis | -166.6 | 165.8 | -24.9 | -131.2 | -98.1 | 0 | 0 | 0 | 104 | ||||
| 203 | P | 42.9 | Very low | 41 | Very low | 117 Ų | 117 | 157.5 Ų | 157.5 | 76% | 0.76 | 79% | 0.794 | S | S | * | * | trans | -107.3 | 173.6 | -158.8 | 39.4 | -31.1 | 0 | 0 | 0 | 115.5 | ||||
| 204 | G | 38.8 | Very low | 40.9 | Very low | 73 Ų | 73 | 154 Ų | 154 | 75% | 0.753 | 79% | 0.789 | S | S | * | * | trans | 148.1 | 139.4 | 149.3 | 0 | 0 | 0 | 0 | 0 | 118.8 | ||||
| 205 | K | 39.3 | Very low | 41.2 | Very low | 209 Ų | 209 | 158.6 Ų | 158.6 | 91% | 0.909 | 80% | 0.796 | S | S | * | * | trans | 80.1 | 115.9 | 166.2 | -68 | 180 | 171.4 | -179.7 | 0 | 117.3 | ||||
| 206 | S | 37.7 | Very low | 41.1 | Very low | 104 Ų | 104 | 156.8 Ų | 156.8 | 73% | 0.727 | 79% | 0.792 | S | S | * | * | 88.7 | 145.2 | 53.4 | -163.5 | 0 | 0 | 0 | 0 | 112.9 | |||||
| 207 | E | 43.9 | Very low | 41.4 | Very low | 177 Ų | 177 | 152.3 Ų | 152.3 | 83% | 0.827 | 79% | 0.793 | S | S | * | * | trans | 86.8 | 144 | 177.5 | -55.4 | 176.8 | 105.2 | 0 | 0 | 115 | ||||
| 208 | D | 44.2 | Very low | 41.5 | Very low | 125 Ų | 125 | 149 Ų | 149 | 67% | 0.668 | 79% | 0.785 | S | S | * | * | cis | 175.1 | 157.4 | -31.9 | -102.5 | -25.6 | 0 | 0 | 0 | 103.5 | ||||
| 209 | N | 44.8 | Very low | 41.4 | Very low | 153 Ų | 153 | 149 Ų | 149 | 82% | 0.818 | 79% | 0.79 | S | S | * | * | trans | 73.8 | 150.1 | 160.8 | -56.4 | -38.4 | 0 | 0 | 0 | 117.2 | ||||
| 210 | F | 41.4 | Very low | 41.4 | Very low | 155 Ų | 155 | 140.8 Ų | 140.8 | 68% | 0.68 | 78% | 0.777 | S | S | * | * | cis | 173.3 | 155.3 | -9.6 | 172.6 | -121.1 | 0 | 0 | 0 | 104.4 | ||||
| 211 | R | 43.8 | Very low | 41.5 | Very low | 192 Ų | 192 | 141 Ų | 141 | 73% | 0.725 | 77% | 0.773 | S | S | * | * | trans | 74.6 | 116.1 | 165.4 | -86.3 | 170.5 | 152.9 | 149.8 | -7.6 | 118.2 | ||||
| 212 | N | 44.2 | Very low | 41.1 | Very low | 145 Ų | 145 | 137 Ų | 137 | 78% | 0.775 | 77% | 0.769 | S | S | * | * | 89.1 | 147 | 68.6 | -76 | -10.4 | 0 | 0 | 0 | 113.4 | |||||
| 213 | A | 43.1 | Very low | 40.6 | Very low | 95 Ų | 95 | 140.1 Ų | 140.1 | 79% | 0.785 | 77% | 0.773 | S | S | * | * | trans | 85.4 | 99.2 | 172.4 | 0 | 0 | 0 | 0 | 0 | 114.3 | ||||
| 214 | A | 37.1 | Very low | 40.1 | Very low | 93 Ų | 93 | 138.4 Ų | 138.4 | 77% | 0.769 | 77% | 0.77 | S | S | * | * | 76.1 | 146.5 | 69.5 | 0 | 0 | 0 | 0 | 0 | 113.7 | |||||
| 215 | I | 48.2 | Very low | 40.1 | Very low | 161 Ų | 161 | 142.7 Ų | 142.7 | 83% | 0.826 | 78% | 0.775 | S | S | * | * | trans | 99.6 | 88.7 | 160.1 | -50 | 166.9 | 0 | 0 | 0 | 116 | ||||
| 216 | N | 38.8 | Very low | 40 | Very low | 146 Ų | 146 | 136.7 Ų | 136.7 | 78% | 0.781 | 76% | 0.764 | S | S | * | * | 8.8 | 120.3 | 127.9 | -155.8 | 14.5 | 0 | 0 | 0 | 117.9 | |||||
| 217 | S | 43 | Very low | 39.8 | Very low | 114 Ų | 114 | 143.1 Ų | 143.1 | 80% | 0.797 | 77% | 0.773 | S | S | * | * | trans | -169.7 | 129.8 | 148.1 | 175.8 | 0 | 0 | 0 | 0 | 110.8 | ||||
| 218 | N | 41.2 | Very low | 39.3 | Very low | 132 Ų | 132 | 141.8 Ų | 141.8 | 71% | 0.706 | 77% | 0.771 | S | S | * | * | trans | -59.9 | 163.5 | 175.1 | -65.8 | -55.1 | 0 | 0 | 0 | 113.7 | ||||
| 219 | N | 39.2 | Very low | 39 | Very low | 160 Ų | 160 | 143 Ų | 143 | 86% | 0.856 | 78% | 0.778 | S | S | * | * | trans | 78.2 | 139.7 | 160.2 | -75.7 | -20 | 0 | 0 | 0 | 118.5 | ||||
| 220 | A | 37.8 | Very low | 38.7 | Very low | 84 Ų | 84 | 142.8 Ų | 142.8 | 69% | 0.694 | 78% | 0.782 | S | S | * | * | trans | 96.4 | 138.4 | 157.9 | 0 | 0 | 0 | 0 | 0 | 116.9 | ||||
| 221 | Q | 40.2 | Very low | 38.4 | Very low | 163 Ų | 163 | 141 Ų | 141 | 76% | 0.762 | 79% | 0.789 | S | S | * | * | trans | 80.1 | 88.1 | 148.9 | -114.3 | 73.6 | -8.5 | 0 | 0 | 117.7 | ||||
| 222 | C | 30.3 | Very low | 38.1 | Very low | 110 Ų | 110 | 141.3 Ų | 141.3 | 74% | 0.743 | 80% | 0.799 | S | S | * | * | 49.8 | 140.4 | 114.1 | -61.5 | 0 | 0 | 0 | 0 | 120.7 | |||||
| 223 | R | 33.4 | Very low | 37.8 | Very low | 234 Ų | 234 | 144.7 Ų | 144.7 | 88% | 0.883 | 81% | 0.806 | S | S | * | * | trans | 87.5 | 104.7 | 142.9 | -105.1 | 175.4 | -176.1 | 140.7 | 1.5 | 117.3 | ||||
| 224 | A | 32.4 | Very low | 37.5 | Very low | 82 Ų | 82 | 148.6 Ų | 148.6 | 68% | 0.678 | 81% | 0.81 | S | S | * | * | 51.4 | 95.1 | 120.3 | 0 | 0 | 0 | 0 | 0 | 116.8 | |||||
| 225 | N | 37.7 | Very low | 37.8 | Very low | 163 Ų | 163 | 152.2 Ų | 152.2 | 87% | 0.872 | 82% | 0.817 | S | S | * | * | trans | -160.4 | 99.4 | 133.5 | -91.1 | -29.8 | 0 | 0 | 0 | 106.4 | ||||
| 226 | A | 37.7 | Very low | 38 | Very low | 82 Ų | 82 | 152.7 Ų | 152.7 | 68% | 0.678 | 82% | 0.816 | S | S | * | * | 69.7 | 96.7 | 90.6 | 0 | 0 | 0 | 0 | 0 | 112.4 | |||||
| 227 | R | 33.5 | Very low | 38.7 | Very low | 240 Ų | 240 | 150.9 Ų | 150.9 | 91% | 0.906 | 81% | 0.812 | S | S | * | * | 56.6 | 93.7 | 122.2 | -171.3 | -175 | -114.8 | 159.9 | -3.2 | 114.8 | |||||
| 228 | N | 34.5 | Very low | 39.3 | Very low | 148 Ų | 148 | 151.4 Ų | 151.4 | 79% | 0.791 | 80% | 0.8 | S | S | * | * | trans | -150.8 | 131.7 | 146.8 | -85.6 | -33.4 | 0 | 0 | 0 | 109.6 | ||||
| 229 | N | 36.5 | Very low | 40 | Very low | 152 Ų | 152 | 148.6 Ų | 148.6 | 81% | 0.813 | 79% | 0.788 | S | S | * | * | S | Bend | trans | 88.6 | 46.7 | 161 | -47.8 | -17.4 | 0 | 0 | 0 | 119 | ||
| 230 | T | 38.7 | Very low | 40.7 | Very low | 147 Ų | 147 | 148 Ų | 148 | 90% | 0.902 | 78% | 0.775 | S | S | * | * | trans | -136.3 | 64.8 | 157.4 | 41 | 0 | 0 | 0 | 0 | 110.8 | ||||
| 231 | S | 34.5 | Very low | 41.7 | Very low | 118 Ų | 118 | 148.2 Ų | 148.2 | 83% | 0.825 | 76% | 0.764 | S | S | * | * | trans | -154.8 | 73.6 | 173.6 | -168.8 | 0 | 0 | 0 | 0 | 112.1 | ||||
| 232 | Q | 38.6 | Very low | 42.7 | Very low | 199 Ų | 199 | 145.6 Ų | 145.6 | 93% | 0.93 | 76% | 0.755 | S | S | * | * | S | Bend | trans | -162.7 | 61.6 | 158.2 | -118.4 | -178.3 | 18.8 | 0 | 0 | 111.4 | ||
| 233 | K | 36.5 | Very low | 44.1 | Very low | 215 Ų | 215 | 145.4 Ų | 145.4 | 94% | 0.935 | 75% | 0.746 | S | S | * | * | trans | -156.4 | 61.3 | 166.8 | -125.5 | -177.1 | -174.4 | -176.4 | 0 | 110.2 | ||||
| 234 | M | 38.1 | Very low | 45.1 | Very low | 177 Ų | 177 | 139.6 Ų | 139.6 | 87% | 0.872 | 73% | 0.725 | S | S | * | * | trans | -149.4 | 96.6 | 174.4 | -165.9 | 146.9 | 85.8 | 0 | 0 | 109.7 | ||||
| 235 | N | 43.9 | Very low | 46.4 | Very low | 169 Ų | 169 | 141.2 Ų | 141.2 | 90% | 0.904 | 72% | 0.719 | S | S | * | * | trans | -178.5 | 54.2 | 155 | -91.3 | -20.8 | 0 | 0 | 0 | 111.2 | ||||
| 236 | E | 51.8 | Low | 47.3 | Very low | 172 Ų | 172 | 136.6 Ų | 136.6 | 80% | 0.804 | 70% | 0.703 | S | S | * | * | trans | -118.8 | 110.4 | 163 | -149.9 | -173.2 | 124.7 | 0 | 0 | 107.8 | K238 | E236-K238 PolarHBondContact O-N 3.17Å; E236-K238 VanDerWaalsContact O-N 3.14Å | ||
| 237 | P | 52.8 | Low | 48 | Very low | 107 Ų | 107 | 137 Ų | 137 | 70% | 0.695 | 69% | 0.687 | S | S | * | * | trans | -71 | 111.4 | 179.4 | 26.6 | -28.6 | 0 | 0 | 0 | 108.6 | ||||
| 238 | K | 56.3 | Low | 49.1 | Very low | 126 Ų | 126 | 134.9 Ų | 134.9 | 55% | 0.548 | 68% | 0.679 | S | S | . | * | trans | -59.2 | 135.1 | -174.5 | -60.4 | 179.6 | -173.5 | 171.5 | 0 | 111.1 | E236 Y240 L241 | E236-K238 PolarHBondContact O-N 3.17Å; E236-K238 VanDerWaalsContact O-N 3.14Å; K238-Y240 HydrophobicContact CB-CD1 3.58Å; K238-Y240 HydrophobicContact CB-CE1 3.18Å; K238-Y240 HydrophobicContact CB-CG 4.49Å; K238-Y240 HydrophobicContact CD-CD1 4.43Å; K238-Y240 HydrophobicContact CD-CE1 3.37Å; K238-Y240 WeakPolarHBondContact CD-OH 3.5Å; K238-Y240 HydrophobicContact CG-CE1 3.89Å; K238-Y240 PolarHBondContact O-N 3.35Å; K238-L241 WeakPolarHBondContact O-CB 3.38Å; K238-L241 PolarHBondContact O-N 3.18Å | ||
| 239 | P | 55.7 | Low | 49.8 | Very low | 72 Ų | 72 | 138.6 Ų | 138.6 | 47% | 0.468 | 68% | 0.682 | S | S | . | * | H | α-helix | trans | -60 | -21 | -168.6 | 20.4 | -32.8 | 0 | 0 | 0 | 115.1 | L241 L242 L243 | P239-L241 PolarHBondContact O-N 2.91Å; P239-L242 PolarHBondContact O-N 3.4Å; P239-L243 PolarHBondContact O-N 3.33Å |
| 240 | Y | 53.4 | Low | 50.6 | Low | 148 Ų | 148 | 138.4 Ų | 138.4 | 58% | 0.58 | 68% | 0.676 | S | S | * | * | H | α-helix | trans | -64.6 | -26.1 | 174.5 | 64.6 | -103.6 | 0 | 0 | 0 | 113.4 | K238 L243 Y244 | K238-Y240 HydrophobicContact CB-CD1 3.58Å; K238-Y240 HydrophobicContact CB-CE1 3.18Å; K238-Y240 HydrophobicContact CB-CG 4.49Å; K238-Y240 HydrophobicContact CD-CD1 4.43Å; K238-Y240 HydrophobicContact CD-CE1 3.37Å; K238-Y240 WeakPolarHBondContact CD-OH 3.5Å; K238-Y240 HydrophobicContact CG-CE1 3.89Å; K238-Y240 PolarHBondContact O-N 3.35Å; Y240-L243 PolarHBondContact O-N 3.29Å; Y240-Y244 PolarHBondContact O-N 2.79Å |
| 241 | L | 59.7 | Low | 51.3 | Low | 89 Ų | 89 | 135.9 Ų | 135.9 | 47% | 0.466 | 68% | 0.679 | S | S | . | * | H | α-helix | trans | -78.1 | -29.2 | -176.1 | -140.5 | 146.5 | 0 | 0 | 0 | 111.4 | K238 P239 Y244 Q245 | K238-L241 WeakPolarHBondContact O-CB 3.38Å; K238-L241 PolarHBondContact O-N 3.18Å; P239-L241 PolarHBondContact O-N 2.91Å; L241-Y244 PolarHBondContact O-N 3.2Å; L241-Q245 PolarHBondContact O-N 2.88Å |
| 242 | L | 61 | Low | 52.3 | Low | 108 Ų | 108 | 135.7 Ų | 135.7 | 57% | 0.565 | 67% | 0.669 | S | S | * | * | H | α-helix | trans | -72.1 | -37.2 | 171.6 | -76.3 | 171.5 | 0 | 0 | 0 | 112.1 | P239 Y244 Q245 A246 | P239-L242 PolarHBondContact O-N 3.4Å; L242-Y244 VanDerWaalsContact C-N 3.27Å; L242-Y244 PolarHBondContact O-N 3.35Å; L242-Q245 PolarHBondContact O-N 2.93Å; L242-A246 WeakPolarHBondContact O-CB 3.39Å; L242-A246 PolarHBondContact O-N 3.45Å |
| 243 | L | 60.4 | Low | 53.2 | Low | 106 Ų | 106 | 132.8 Ų | 132.8 | 56% | 0.555 | 66% | 0.658 | S | S | * | * | H | α-helix | trans | -65.8 | -33 | 175.3 | -132.7 | 151.2 | 0 | 0 | 0 | 111.3 | P239 Y240 R247 | P239-L243 PolarHBondContact O-N 3.33Å; Y240-L243 PolarHBondContact O-N 3.29Å; L243-R247 WeakPolarHBondContact O-CB 3.38Å; L243-R247 PolarHBondContact O-N 2.76Å |
| 244 | Y | 53 | Low | 54.1 | Low | 112 Ų | 112 | 127.6 Ų | 127.6 | 44% | 0.439 | 64% | 0.639 | S | S | . | * | H | α-helix | trans | -71.1 | -34.9 | 173.7 | -155.6 | -94.1 | 0 | 0 | 0 | 113 | Y240 L241 L242 Y258 | Y240-Y244 PolarHBondContact O-N 2.79Å; L241-Y244 PolarHBondContact O-N 3.2Å; L242-Y244 VanDerWaalsContact C-N 3.27Å; L242-Y244 PolarHBondContact O-N 3.35Å; Y244-Y258 HydrophobicContact CE2-CE1 4.49Å |
| 245 | Q | 60.8 | Low | 55.1 | Low | 116 Ų | 116 | 122.2 Ų | 122.2 | 54% | 0.542 | 62% | 0.618 | S | S | . | * | H | α-helix | trans | -77.1 | -32 | 175.2 | -83.4 | -177.5 | -13.9 | 0 | 0 | 113.4 | L241 L242 R247 R248 | L241-Q245 PolarHBondContact O-N 2.88Å; L242-Q245 PolarHBondContact O-N 2.93Å; Q245-R247 VanDerWaalsContact C-N 3.34Å; Q245-R248 PolarHBondContact O-N 2.79Å |
| 246 | A | 56.2 | Low | 56 | Low | 66 Ų | 66 | 121.6 Ų | 121.6 | 55% | 0.545 | 61% | 0.61 | S | S | . | * | H | α-helix | trans | -67.6 | -34.2 | 173.6 | 0 | 0 | 0 | 0 | 0 | 112.2 | L242 R248 R249 | L242-A246 WeakPolarHBondContact O-CB 3.39Å; L242-A246 PolarHBondContact O-N 3.45Å; A246-R248 VanDerWaalsContact C-N 3.28Å; A246-R248 PolarHBondContact O-N 3.39Å; A246-R249 PolarHBondContact O-N 3.11Å |
| 247 | R | 53.2 | Low | 56.8 | Low | 90 Ų | 90 | 117.5 Ų | 117.5 | 34% | 0.34 | 60% | 0.601 | S | S | . | * | T | Hydrogen-bonded Turn | trans | -74.2 | -11.6 | 179 | -143.8 | -176 | -65.1 | 160.2 | -5.2 | 114.4 | L243 Q245 | L243-R247 WeakPolarHBondContact O-CB 3.38Å; L243-R247 PolarHBondContact O-N 2.76Å; Q245-R247 VanDerWaalsContact C-N 3.34Å |
| 248 | R | 55.8 | Low | 57.6 | Low | 195 Ų | 195 | 116.9 Ų | 116.9 | 74% | 0.736 | 59% | 0.585 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -79.7 | -16.9 | 172.2 | -69.6 | -166.6 | -173 | 173 | 0.9 | 113.5 | Q245 A246 | Q245-R248 PolarHBondContact O-N 2.79Å; A246-R248 VanDerWaalsContact C-N 3.28Å; A246-R248 PolarHBondContact O-N 3.39Å |
| 249 | R | 49.2 | Very low | 58.2 | Low | 226 Ų | 226 | 116.4 Ų | 116.4 | 85% | 0.853 | 59% | 0.586 | S | S | * | * | S | Bend | trans | -93.8 | -13.8 | 179.6 | -67 | -151.7 | -150 | -165.4 | 8.3 | 114.2 | A246 | A246-R249 PolarHBondContact O-N 3.11Š|
| 250 | H | 53.1 | Low | 59.1 | Low | 149 Ų | 149 | 117.8 Ų | 117.8 | 69% | 0.69 | 59% | 0.586 | S | S | * | * | S | Bend | trans | -127.7 | 105.6 | 175.2 | -81.6 | 55.9 | 0 | 0 | 0 | 106.2 | D252 | H250-D252 PolarHBondContact O-N 3.48Š|
| 251 | G | 52.7 | Low | 60.2 | Low | 93 Ų | 93 | 113.1 Ų | 113.1 | 96% | 0.959 | 58% | 0.575 | S | S | * | * | trans | -71.1 | 57.3 | -174.4 | 0 | 0 | 0 | 0 | 0 | 113.6 | ||||
| 252 | D | 55.8 | Low | 60.9 | Low | 115 Ų | 115 | 112.9 Ų | 112.9 | 62% | 0.615 | 57% | 0.574 | S | S | * | * | trans | -124.8 | 120.2 | -172.6 | -147.2 | -1.9 | 0 | 0 | 0 | 112 | H250 | H250-D252 PolarHBondContact O-N 3.48Š| ||
| 253 | I | 58.4 | Low | 61.7 | Low | 137 Ų | 137 | 114 Ų | 114 | 70% | 0.703 | 58% | 0.576 | S | S | * | * | trans | 30.2 | 103.5 | 166.9 | -56.1 | 157.8 | 0 | 0 | 0 | 117.1 | C255 | I253-C255 PolarHBondContact O-N 3.49Š| ||
| 254 | I | 55.8 | Low | 62.7 | Low | 107 Ų | 107 | 117.8 Ų | 117.8 | 55% | 0.549 | 58% | 0.583 | S | S | . | * | trans | -55.9 | 120.3 | 161 | -71.9 | 165.9 | 0 | 0 | 0 | 108.5 | Q256 M259 | I254-Q256 PolarHBondContact O-N 3.39Å; I254-M259 HydrophobicContact CG2-CG 3.54Å; I254-M259 HydrophobicContact CG2-SD 3.92Å | ||
| 255 | C | 57.9 | Low | 63.8 | Low | 64 Ų | 64 | 117.7 Ų | 117.7 | 43% | 0.432 | 59% | 0.59 | S | S | . | * | trans | -56.1 | 122.8 | 174.6 | -52.2 | 0 | 0 | 0 | 0 | 109.5 | I253 S257 Y258 | I253-C255 PolarHBondContact O-N 3.49Å; C255-S257 PolarHBondContact O-N 3.03Å; C255-S257 VanDerWaalsContact O-N 3.12Å; C255-Y258 WeakPolarHBondContact O-CB 2.99Å; C255-Y258 PolarHBondContact O-N 3.31Å | ||
| 256 | Q | 63.1 | Low | 64.5 | Low | 155 Ų | 155 | 115.7 Ų | 115.7 | 72% | 0.724 | 59% | 0.589 | S | S | * | * | H | α-helix | trans | -50.7 | -37.7 | -179.9 | -167.3 | 171.4 | -1.8 | 0 | 0 | 112.6 | I254 Y258 M259 E260 | I254-Q256 PolarHBondContact O-N 3.39Å; Q256-Y258 VanDerWaalsContact C-N 3.28Å; Q256-Y258 PolarHBondContact O-N 2.99Å; Q256-M259 PolarHBondContact O-N 3.36Å; Q256-E260 PolarHBondContact O-N 2.96Å; Q256-E260 VanDerWaalsContact O-N 3.09Å |
| 257 | S | 68.5 | Low | 65.3 | Low | 87 Ų | 87 | 118.5 Ų | 118.5 | 61% | 0.608 | 59% | 0.594 | S | S | * | * | H | α-helix | trans | -57.5 | -33.4 | 173.7 | 166.9 | 0 | 0 | 0 | 0 | 114.3 | C255 S261 | C255-S257 PolarHBondContact O-N 3.03Å; C255-S257 VanDerWaalsContact O-N 3.12Å; S257-S261 PolarHBondContact O-N 2.65Å |
| 258 | Y | 70.1 | Confident | 65.9 | Low | 93 Ų | 93 | 120.9 Ų | 120.9 | 37% | 0.365 | 61% | 0.609 | S | S | . | * | H | α-helix | trans | -73.7 | -39.7 | 178.7 | -176.9 | -101.3 | 0 | 0 | 0 | 111.5 | Y244 C255 Q256 E260 S261 L262 | Y244-Y258 HydrophobicContact CE2-CE1 4.49Å; C255-Y258 WeakPolarHBondContact O-CB 2.99Å; C255-Y258 PolarHBondContact O-N 3.31Å; Q256-Y258 VanDerWaalsContact C-N 3.28Å; Q256-Y258 PolarHBondContact O-N 2.99Å; Y258-E260 VanDerWaalsContact C-N 3.34Å; Y258-S261 PolarHBondContact O-N 3.46Å; Y258-S261 PolarHBondContact O-OG 2.83Å; Y258-L262 HydrophobicContact CD1-CD1 4Å; Y258-L262 HydrophobicContact CE1-CD1 3.38Å; Y258-L262 HydrophobicContact CE1-CG 4.07Å; Y258-L262 PolarHBondContact O-N 3.34Å |
| 259 | M | 68.2 | Low | 66.2 | Low | 117 Ų | 117 | 118.4 Ų | 118.4 | 58% | 0.576 | 60% | 0.603 | S | S | * | * | H | α-helix | trans | -63 | -42.8 | 174 | -69.7 | -172.9 | 66.7 | 0 | 0 | 111.3 | I254 Q256 S261 L262 Q263 | I254-M259 HydrophobicContact CG2-CG 3.54Å; I254-M259 HydrophobicContact CG2-SD 3.92Å; Q256-M259 PolarHBondContact O-N 3.36Å; M259-S261 VanDerWaalsContact C-N 3.28Å; M259-S261 PolarHBondContact O-N 2.96Å; M259-L262 PolarHBondContact O-N 3.29Å; M259-Q263 WeakPolarHBondContact O-CB 3.06Å; M259-Q263 PolarHBondContact O-N 3.26Å |
| 260 | E | 75.1 | Confident | 66.4 | Low | 101 Ų | 101 | 109.7 Ų | 109.7 | 47% | 0.472 | 58% | 0.584 | S | S | . | * | H | α-helix | trans | -60.1 | -39 | 174.5 | -71.4 | -174.2 | 159.1 | 0 | 0 | 112 | Q256 Y258 Q263 R264 | Q256-E260 PolarHBondContact O-N 2.96Å; Q256-E260 VanDerWaalsContact O-N 3.09Å; Y258-E260 VanDerWaalsContact C-N 3.34Å; E260-Q263 PolarHBondContact O-N 2.7Å; E260-R264 WeakPolarHBondContact O-CG 3.47Å; E260-R264 PolarHBondContact O-N 2.94Å |
| 261 | S | 76.7 | Confident | 66.2 | Low | 49 Ų | 49 | 110.2 Ų | 110.2 | 34% | 0.343 | 58% | 0.584 | S | S | . | * | H | α-helix | trans | -66.8 | -38.6 | 177.4 | 76.9 | 0 | 0 | 0 | 0 | 113 | S257 Y258 M259 R264 L265 | S257-S261 PolarHBondContact O-N 2.65Å; Y258-S261 PolarHBondContact O-N 3.46Å; Y258-S261 PolarHBondContact O-OG 2.83Å; M259-S261 VanDerWaalsContact C-N 3.28Å; M259-S261 PolarHBondContact O-N 2.96Å; S261-R264 PolarHBondContact O-N 3.11Å; S261-L265 WeakPolarHBondContact O-CG 3.12Å; S261-L265 PolarHBondContact O-N 2.58Å |
| 262 | L | 73.9 | Confident | 66.1 | Low | 85 Ų | 85 | 110.2 Ų | 110.2 | 45% | 0.445 | 57% | 0.566 | S | S | . | * | H | α-helix | trans | -67.7 | -37.7 | 175.4 | -84.7 | 173.9 | 0 | 0 | 0 | 111.8 | Y258 M259 R264 L265 S266 | Y258-L262 HydrophobicContact CD1-CD1 4Å; Y258-L262 HydrophobicContact CE1-CD1 3.38Å; Y258-L262 HydrophobicContact CE1-CG 4.07Å; Y258-L262 PolarHBondContact O-N 3.34Å; M259-L262 PolarHBondContact O-N 3.29Å; L262-R264 VanDerWaalsContact C-N 3.32Å; L262-L265 PolarHBondContact O-N 2.85Å; L262-S266 PolarHBondContact O-N 2.98Å; L262-S266 PolarHBondContact O-OG 3.34Å |
| 263 | Q | 78.6 | Confident | 65.8 | Low | 130 Ų | 130 | 110.5 Ų | 110.5 | 61% | 0.607 | 57% | 0.567 | S | S | * | * | H | α-helix | trans | -68.3 | -33.3 | 177 | -158.9 | 173.7 | -11 | 0 | 0 | 111.8 | M259 E260 S266 L267 | M259-Q263 WeakPolarHBondContact O-CB 3.06Å; M259-Q263 PolarHBondContact O-N 3.26Å; E260-Q263 PolarHBondContact O-N 2.7Å; Q263-S266 PolarHBondContact O-OG 2.77Å; Q263-L267 WeakPolarHBondContact O-CB 3.16Å; Q263-L267 PolarHBondContact O-N 3.44Å; Q263-L267 VanDerWaalsContact O-N 3.14Å |
| 264 | R | 79.7 | Confident | 65.4 | Low | 186 Ų | 186 | 109.8 Ų | 109.8 | 70% | 0.702 | 57% | 0.569 | S | S | * | * | H | α-helix | trans | -68.4 | -39 | 170.7 | -72.6 | -175.9 | -175.5 | 171.2 | 4.8 | 112.5 | E260 S261 L262 L267 Q268 | E260-R264 WeakPolarHBondContact O-CG 3.47Å; E260-R264 PolarHBondContact O-N 2.94Å; S261-R264 PolarHBondContact O-N 3.11Å; L262-R264 VanDerWaalsContact C-N 3.32Å; R264-L267 PolarHBondContact O-N 3.27Å; R264-Q268 PolarHBondContact O-N 3.37Å |
| 265 | L | 77.8 | Confident | 64.8 | Low | 110 Ų | 110 | 110.4 Ų | 110.4 | 58% | 0.576 | 58% | 0.582 | S | S | * | * | H | α-helix | trans | -67.2 | -39.6 | 176.8 | -77.7 | 162 | 0 | 0 | 0 | 112.2 | S261 L262 Q268 K269 | S261-L265 WeakPolarHBondContact O-CG 3.12Å; S261-L265 PolarHBondContact O-N 2.58Å; L262-L265 PolarHBondContact O-N 2.85Å; L265-Q268 PolarHBondContact O-N 3.04Å; L265-K269 WeakPolarHBondContact O-CB 3.32Å; L265-K269 PolarHBondContact O-N 2.72Å |
| 266 | S | 74.4 | Confident | 63.8 | Low | 75 Ų | 75 | 110.4 Ų | 110.4 | 52% | 0.524 | 59% | 0.592 | S | S | . | * | H | α-helix | trans | -68 | -37.6 | 175.8 | 63.6 | 0 | 0 | 0 | 0 | 112.3 | L262 Q263 K269 G270 | L262-S266 PolarHBondContact O-N 2.98Å; L262-S266 PolarHBondContact O-OG 3.34Å; Q263-S266 PolarHBondContact O-OG 2.77Å; S266-K269 PolarHBondContact O-N 3.45Å; S266-G270 PolarHBondContact O-N 2.91Å |
| 267 | L | 73.8 | Confident | 62.6 | Low | 124 Ų | 124 | 108.1 Ų | 108.1 | 65% | 0.649 | 60% | 0.6 | S | S | * | * | H | α-helix | trans | -64.4 | -38 | 172.3 | -97.5 | 161.2 | 0 | 0 | 0 | 113 | Q263 R264 K271 | Q263-L267 WeakPolarHBondContact O-CB 3.16Å; Q263-L267 PolarHBondContact O-N 3.44Å; Q263-L267 VanDerWaalsContact O-N 3.14Å; R264-L267 PolarHBondContact O-N 3.27Å; L267-K271 PolarHBondContact O-N 3.2Å |
| 268 | Q | 66.1 | Low | 61.2 | Low | 140 Ų | 140 | 107.1 Ų | 107.1 | 65% | 0.654 | 60% | 0.603 | S | S | * | * | H | α-helix | trans | -71.3 | -35 | 176.6 | -114.9 | -162.8 | 40.4 | 0 | 0 | 112.7 | R264 L265 K271 T272 | R264-Q268 PolarHBondContact O-N 3.37Å; L265-Q268 PolarHBondContact O-N 3.04Å; Q268-K271 PolarHBondContact O-N 3.46Å; Q268-T272 PolarHBondContact O-N 3.34Å; Q268-T272 PolarHBondContact O-OG1 2.94Å |
| 269 | K | 60.6 | Low | 59.8 | Low | 143 Ų | 143 | 113.5 Ų | 113.5 | 62% | 0.622 | 63% | 0.626 | S | S | * | * | H | α-helix | trans | -67.2 | -41 | 175.4 | -165.4 | 169.6 | -179.7 | 178.3 | 0 | 111.6 | L265 S266 K271 T272 D273 | L265-K269 WeakPolarHBondContact O-CB 3.32Å; L265-K269 PolarHBondContact O-N 2.72Å; S266-K269 PolarHBondContact O-N 3.45Å; K269-K271 PolarHBondContact O-N 3.43Å; K269-T272 WeakPolarHBondContact CA-OG1 3.43Å; K269-T272 PolarHBondContact O-N 2.98Å; K269-T272 PolarHBondContact O-OG1 2.74Å; K269-T272 VanDerWaalsContact O-OG1 3.11Å; K269-D273 PolarHBondContact O-N 2.99Å; K269-D273 VanDerWaalsContact O-N 3.16Å |
| 270 | G | 53.9 | Low | 58.4 | Low | 43 Ų | 43 | 115.1 Ų | 115.1 | 44% | 0.443 | 64% | 0.638 | S | S | . | * | H | α-helix | trans | -64.2 | -24.5 | 171.3 | 0 | 0 | 0 | 0 | 0 | 114.2 | S266 V274 | S266-G270 PolarHBondContact O-N 2.91Å; G270-V274 WeakPolarHBondContact O-CG2 2.81Å |
| 271 | K | 49.7 | Very low | 56.9 | Low | 161 Ų | 161 | 113.9 Ų | 113.9 | 70% | 0.7 | 65% | 0.651 | S | S | * | * | H | α-helix | trans | -89.2 | -21.3 | 179.1 | -161.8 | 148.6 | -177.5 | 166.5 | 0 | 113.8 | L267 Q268 K269 | L267-K271 PolarHBondContact O-N 3.2Å; Q268-K271 PolarHBondContact O-N 3.46Å; K269-K271 PolarHBondContact O-N 3.43Å |
| 272 | T | 50.9 | Low | 55.2 | Low | 93 Ų | 93 | 120.2 Ų | 120.2 | 57% | 0.571 | 68% | 0.676 | S | S | * | * | H | α-helix | trans | -83.7 | -26.4 | 172.7 | 39.8 | 0 | 0 | 0 | 0 | 112.2 | Q268 K269 V274 | Q268-T272 PolarHBondContact O-N 3.34Å; Q268-T272 PolarHBondContact O-OG1 2.94Å; K269-T272 WeakPolarHBondContact CA-OG1 3.43Å; K269-T272 PolarHBondContact O-N 2.98Å; K269-T272 PolarHBondContact O-OG1 2.74Å; K269-T272 VanDerWaalsContact O-OG1 3.11Å; T272-V274 VanDerWaalsContact C-N 3.32Å |
| 273 | D | 48.3 | Very low | 53.7 | Low | 121 Ų | 121 | 122.7 Ų | 122.7 | 65% | 0.647 | 70% | 0.695 | S | S | * | * | S | Bend | trans | -78.2 | -13.8 | 170.3 | -68.8 | -29.9 | 0 | 0 | 0 | 113.3 | K269 | K269-D273 PolarHBondContact O-N 2.99Å; K269-D273 VanDerWaalsContact O-N 3.16Å |
| 274 | V | 50 | Low | 51.6 | Low | 121 Ų | 121 | 120 Ų | 120 | 73% | 0.733 | 70% | 0.701 | S | S | * | * | S | Bend | trans | -100.8 | -6.5 | -178.2 | 171.1 | 0 | 0 | 0 | 0 | 113.9 | G270 T272 | G270-V274 WeakPolarHBondContact O-CG2 2.81Å; T272-V274 VanDerWaalsContact C-N 3.32Å |
| 275 | C | 42.7 | Very low | 49.7 | Very low | 121 Ų | 121 | 119.7 Ų | 119.7 | 82% | 0.818 | 71% | 0.713 | S | S | * | * | S | Bend | trans | -118.8 | 13.7 | 176.1 | -140.2 | 0 | 0 | 0 | 0 | 114 | ||
| 276 | G | 38.3 | Very low | 47.7 | Very low | 63 Ų | 63 | 119.2 Ų | 119.2 | 65% | 0.649 | 72% | 0.724 | S | S | * | * | trans | -111.2 | 7.8 | -178.4 | 0 | 0 | 0 | 0 | 0 | 115.5 | G278 | G276-G278 PolarHBondContact O-N 3.47Å; G276-G278 VanDerWaalsContact O-N 3.09Å | ||
| 277 | A | 37.9 | Very low | 46.1 | Very low | 107 Ų | 107 | 124.2 Ų | 124.2 | 88% | 0.884 | 74% | 0.744 | S | S | * | * | trans | -84 | 78.9 | 180 | 0 | 0 | 0 | 0 | 0 | 110.8 | ||||
| 278 | G | 38.9 | Very low | 44.3 | Very low | 66 Ų | 66 | 121.5 Ų | 121.5 | 68% | 0.68 | 75% | 0.746 | S | S | * | * | trans | -155.3 | 98.4 | 178.6 | 0 | 0 | 0 | 0 | 0 | 112.9 | G276 | G276-G278 PolarHBondContact O-N 3.47Å; G276-G278 VanDerWaalsContact O-N 3.09Å | ||
| 279 | R | 40.3 | Very low | 42.8 | Very low | 227 Ų | 227 | 124 Ų | 124 | 86% | 0.857 | 76% | 0.755 | S | S | * | * | trans | 74.3 | 108.8 | 161 | -72.4 | -170.4 | -170 | 136.1 | 2.9 | 120.1 | ||||
| 280 | D | 38.5 | Very low | 42.1 | Very low | 152 Ų | 152 | 124.9 Ų | 124.9 | 81% | 0.813 | 77% | 0.765 | S | S | * | * | 77.3 | 120.9 | 123.3 | -47.7 | -22.5 | 0 | 0 | 0 | 120.1 | |||||
| 281 | G | 43.6 | Very low | 41.3 | Very low | 74 Ų | 74 | 129.4 Ų | 129.4 | 76% | 0.763 | 78% | 0.779 | S | S | * | * | trans | 121.2 | 74.3 | 143.4 | 0 | 0 | 0 | 0 | 0 | 118.3 | ||||
| 282 | Q | 41 | Very low | 40.8 | Very low | 182 Ų | 182 | 130.5 Ų | 130.5 | 85% | 0.85 | 79% | 0.787 | S | S | * | * | 54.4 | 107.7 | 125.8 | -146.7 | 173.8 | 45.2 | 0 | 0 | 119.2 | |||||
| 283 | T | 42 | Very low | 40.3 | Very low | 138 Ų | 138 | 131.4 Ų | 131.4 | 85% | 0.847 | 79% | 0.792 | S | S | * | * | 165.8 | 128.5 | 115.1 | 37.3 | 0 | 0 | 0 | 0 | 110.6 | |||||
| 284 | G | 35.7 | Very low | 39.8 | Very low | 72 Ų | 72 | 132.8 Ų | 132.8 | 74% | 0.742 | 80% | 0.8 | S | S | * | * | trans | -85.4 | 168.9 | -161.4 | 0 | 0 | 0 | 0 | 0 | 116.8 | ||||
| 285 | L | 39 | Very low | 39.3 | Very low | 181 Ų | 181 | 131.4 Ų | 131.4 | 95% | 0.948 | 80% | 0.801 | S | S | * | * | trans | -153.6 | 104.1 | 140.7 | -135.9 | 105.8 | 0 | 0 | 0 | 107.8 | ||||
| 286 | A | 36.1 | Very low | 39 | Very low | 99 Ų | 99 | 134.2 Ų | 134.2 | 82% | 0.818 | 81% | 0.806 | S | S | * | * | trans | -106.1 | 117.8 | 171.4 | 0 | 0 | 0 | 0 | 0 | 108.6 | ||||
| 287 | L | 40.8 | Very low | 39.1 | Very low | 180 Ų | 180 | 134.9 Ų | 134.9 | 94% | 0.942 | 81% | 0.812 | S | S | * | * | trans | -163.7 | 126.2 | 161.7 | -142.7 | 99.9 | 0 | 0 | 0 | 106.5 | ||||
| 288 | G | 36.8 | Very low | 39 | Very low | 67 Ų | 67 | 136 Ų | 136 | 69% | 0.691 | 81% | 0.808 | S | S | * | * | cis | -166.9 | 148.7 | -1.2 | 0 | 0 | 0 | 0 | 0 | 106.7 | ||||
| 289 | K | 34.8 | Very low | 38.9 | Very low | 192 Ų | 192 | 139.9 Ų | 139.9 | 84% | 0.835 | 82% | 0.818 | S | S | * | * | trans | -59.5 | 137.3 | 170.4 | -79.2 | -176.6 | 171.4 | 176.7 | 0 | 110.2 | ||||
| 290 | I | 44.5 | Very low | 38.6 | Very low | 163 Ų | 163 | 133.8 Ų | 133.8 | 84% | 0.836 | 81% | 0.811 | S | S | * | * | trans | -132 | 104.4 | 146.2 | -48.7 | 177.8 | 0 | 0 | 0 | 105.7 | ||||
| 291 | N | 37.2 | Very low | 38.6 | Very low | 137 Ų | 137 | 133 Ų | 133 | 73% | 0.733 | 81% | 0.812 | S | S | * | * | trans | -79.9 | 128.1 | 158 | -79 | -6.3 | 0 | 0 | 0 | 105.9 | ||||
| 292 | E | 39.5 | Very low | 38.3 | Very low | 185 Ų | 185 | 135.3 Ų | 135.3 | 86% | 0.864 | 81% | 0.811 | S | S | * | * | trans | -149.7 | 143.7 | 141 | -158.5 | 139.5 | 110.6 | 0 | 0 | 110.1 | ||||
| 293 | T | 40.9 | Very low | 38.2 | Very low | 111 Ų | 111 | 132.8 Ų | 132.8 | 68% | 0.681 | 81% | 0.808 | S | S | * | * | trans | -80.9 | 165.2 | -163.5 | 30.5 | 0 | 0 | 0 | 0 | 113.4 | ||||
| 294 | D | 36.6 | Very low | 38 | Very low | 151 Ų | 151 | 131.8 Ų | 131.8 | 81% | 0.807 | 80% | 0.802 | S | S | * | * | trans | 77.8 | 100.2 | 155.3 | -52 | -29.8 | 0 | 0 | 0 | 119.3 | ||||
| 295 | A | 39.5 | Very low | 38.1 | Very low | 92 Ų | 92 | 135.8 Ų | 135.8 | 76% | 0.76 | 80% | 0.804 | S | S | * | * | -178.1 | 95.2 | 121.1 | 0 | 0 | 0 | 0 | 0 | 111.7 | |||||
| 296 | I | 37.7 | Very low | 38.3 | Very low | 180 Ų | 180 | 133.5 Ų | 133.5 | 92% | 0.923 | 80% | 0.798 | S | S | * | * | 42.7 | 110.8 | 126.9 | -53 | 170.1 | 0 | 0 | 0 | 117.5 | |||||
| 297 | G | 39.3 | Very low | 38.5 | Very low | 76 Ų | 76 | 134.8 Ų | 134.8 | 78% | 0.784 | 80% | 0.801 | S | S | * | * | trans | 170 | 40.3 | 163.2 | 0 | 0 | 0 | 0 | 0 | 116.5 | ||||
| 298 | T | 35.5 | Very low | 38.7 | Very low | 131 Ų | 131 | 130 Ų | 130 | 80% | 0.804 | 80% | 0.796 | S | S | * | * | trans | -86.1 | 119.7 | 173.6 | -53.8 | 0 | 0 | 0 | 0 | 110.3 | ||||
| 299 | V | 38 | Very low | 39.1 | Very low | 147 Ų | 147 | 134.7 Ų | 134.7 | 89% | 0.891 | 81% | 0.805 | S | S | * | * | trans | -117.9 | 121.4 | 155.5 | 175.5 | 0 | 0 | 0 | 0 | 107.7 | ||||
| 300 | S | 34.5 | Very low | 39.6 | Very low | 99 Ų | 99 | 128.7 Ų | 128.7 | 69% | 0.692 | 80% | 0.797 | S | S | * | * | trans | -68.1 | 142.3 | -163.2 | -57.5 | 0 | 0 | 0 | 0 | 116.1 | ||||
| 301 | T | 37 | Very low | 39.6 | Very low | 137 Ų | 137 | 124.5 Ų | 124.5 | 84% | 0.84 | 79% | 0.794 | S | S | * | * | trans | -92.3 | 130.6 | 153.3 | 42.7 | 0 | 0 | 0 | 0 | 109.8 | ||||
| 302 | T | 38 | Very low | 39.7 | Very low | 122 Ų | 122 | 122.6 Ų | 122.6 | 75% | 0.748 | 80% | 0.797 | S | S | * | * | trans | -128.1 | 112 | 161.8 | -57 | 0 | 0 | 0 | 0 | 108.3 | ||||
| 303 | V | 40 | Very low | 40 | Very low | 129 Ų | 129 | 120.6 Ų | 120.6 | 78% | 0.782 | 80% | 0.798 | S | S | * | * | trans | -126.3 | 113.3 | 164.3 | 178.3 | 0 | 0 | 0 | 0 | 106.4 | I305 | V303-I305 HydrophobicContact CG1-CG1 4.35Š| ||
| 304 | T | 35.8 | Very low | 40.1 | Very low | 117 Ų | 117 | 124.5 Ų | 124.5 | 72% | 0.718 | 81% | 0.805 | S | S | * | * | trans | -93.4 | 123.8 | 173.9 | -47.9 | 0 | 0 | 0 | 0 | 108.2 | ||||
| 305 | I | 38.6 | Very low | 40.3 | Very low | 155 Ų | 155 | 122.9 Ų | 122.9 | 80% | 0.795 | 80% | 0.803 | S | S | * | * | trans | -109.8 | 117.9 | 169.8 | -60.3 | 177.5 | 0 | 0 | 0 | 107 | V303 | V303-I305 HydrophobicContact CG1-CG1 4.35Š| ||
| 306 | T | 43.6 | Very low | 40.7 | Very low | 133 Ų | 133 | 129 Ų | 129 | 82% | 0.816 | 83% | 0.83 | S | S | * | * | trans | -106 | 126.1 | 166.8 | 25.3 | 0 | 0 | 0 | 0 | 110.1 | ||||
| 307 | S | 38.9 | Very low | 40.8 | Very low | 126 Ų | 126 | 126.4 Ų | 126.4 | 88% | 0.881 | 83% | 0.825 | S | S | * | * | trans | -77.1 | 143.4 | 175.2 | -174.7 | 0 | 0 | 0 | 0 | 110.8 | ||||
| 308 | G | 46.6 | Very low | 40.9 | Very low | 80 Ų | 80 | 129.1 Ų | 129.1 | 83% | 0.825 | 83% | 0.828 | S | S | * | * | trans | -164.5 | 104.7 | 176.5 | 0 | 0 | 0 | 0 | 0 | 112.3 | ||||
| 309 | N | 44.2 | Very low | 41.2 | Very low | 166 Ų | 166 | 128.9 Ų | 128.9 | 89% | 0.888 | 83% | 0.829 | S | S | * | * | trans | -87.8 | 144.9 | -177 | -176.8 | 28.4 | 0 | 0 | 0 | 111.5 | ||||
| 310 | G | 45.9 | Very low | 41.4 | Very low | 65 Ų | 65 | 127.9 Ų | 127.9 | 67% | 0.67 | 83% | 0.825 | S | S | * | * | trans | 100.1 | 118.6 | 143.6 | 0 | 0 | 0 | 0 | 0 | 119.5 | ||||
| 311 | G | 43.8 | Very low | 41.8 | Very low | 75 Ų | 75 | 129.7 Ų | 129.7 | 77% | 0.773 | 83% | 0.834 | S | S | * | * | trans | 67 | 101.4 | 137.5 | 0 | 0 | 0 | 0 | 0 | 117.7 | ||||
| 312 | A | 40.3 | Very low | 42.2 | Very low | 97 Ų | 97 | 129.2 Ų | 129.2 | 80% | 0.802 | 83% | 0.833 | S | S | * | * | 83.5 | 133.6 | 81.6 | 0 | 0 | 0 | 0 | 0 | 114.1 | |||||
| 313 | V | 44.9 | Very low | 42.5 | Very low | 144 Ų | 144 | 129.7 Ų | 129.7 | 87% | 0.873 | 84% | 0.839 | S | S | * | * | trans | 77.5 | 136.7 | 167.6 | -166.2 | 0 | 0 | 0 | 0 | 114.9 | ||||
| 314 | K | 44.4 | Very low | 42.6 | Very low | 193 Ų | 193 | 129.8 Ų | 129.8 | 84% | 0.839 | 84% | 0.844 | S | S | * | * | cis | -168.1 | 159.2 | -35 | -128.9 | -168.1 | -178.8 | -171.2 | 0 | 103.6 | ||||
| 315 | P | 39.4 | Very low | 43.2 | Very low | 116 Ų | 116 | 130.8 Ų | 130.8 | 75% | 0.753 | 85% | 0.854 | S | S | * | * | trans | -94.5 | 144.7 | -164.4 | 36.8 | -30.9 | 0 | 0 | 0 | 113.2 | ||||
| 316 | V | 48.1 | Very low | 43.6 | Very low | 220 Ų | 220 | 128.6 Ų | 128.6 | 100% | 1.333 | 86% | 0.859 | S | S | * | * | trans | -137.6 | 0 | 141.9 | 177.9 | 0 | 0 | 0 | 0 | 106.3 |
Retrieved 316 of 316 residues in 167.5 ms
(Link to these results)