| 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 | 34.1 | Very low | 56.4 | Low | 229 Ų | 229 | 93.6 Ų | 93.6 | 100% | 1.128 | 57% | 0.569 | S | S | * | * | 0 | 95 | 0 | -61.7 | -72.3 | -85 | 0 | 0 | 107.5 | |||||
| 2 | P | 41.3 | Very low | 58.5 | Low | 132 Ų | 132 | 87.8 Ų | 87.8 | 86% | 0.857 | 53% | 0.532 | S | S | * | . | trans | -84.1 | 133.2 | 173.5 | 32.8 | -25.9 | 0 | 0 | 0 | 109.1 | ||||
| 3 | V | 45.8 | Very low | 60.4 | Low | 119 Ų | 119 | 88 Ų | 88 | 72% | 0.721 | 52% | 0.523 | S | S | * | . | trans | -80.7 | 119.9 | 179.8 | -77.7 | 0 | 0 | 0 | 0 | 109.1 | A5 | V3-A5 PolarHBondContact O-N 3.23Š| ||
| 4 | A | 48.8 | Very low | 62.1 | Low | 82 Ų | 82 | 90.5 Ų | 90.5 | 68% | 0.678 | 53% | 0.527 | S | S | * | . | S | Bend | trans | -72.4 | 43.8 | 178.7 | 0 | 0 | 0 | 0 | 0 | 113.3 | ||
| 5 | A | 51.8 | Low | 63.5 | Low | 54 Ų | 54 | 88.5 Ų | 88.5 | 45% | 0.446 | 52% | 0.516 | S | S | . | . | trans | -108.3 | 1.6 | -172.7 | 0 | 0 | 0 | 0 | 0 | 114.2 | V3 | V3-A5 PolarHBondContact O-N 3.23Š| ||
| 6 | T | 55.8 | Low | 64.9 | Low | 85 Ų | 85 | 83.8 Ų | 83.8 | 52% | 0.521 | 49% | 0.488 | S | S | . | . | H | α-helix | trans | -87.7 | -25.8 | -162.7 | 52 | 0 | 0 | 0 | 0 | 115.2 | T10 | T6-T10 WeakPolarHBondContact O-CB 3.28Å; T6-T10 WeakPolarHBondContact O-CG2 3.4Å; T6-T10 PolarHBondContact O-N 3.07Å; T6-T10 PolarHBondContact O-OG1 3.1Å |
| 7 | N | 61.6 | Low | 66.1 | Low | 82 Ų | 82 | 84.2 Ų | 84.2 | 44% | 0.439 | 49% | 0.488 | S | S | . | . | H | α-helix | trans | -81.9 | -44.5 | -166.8 | -62.1 | -11.4 | 0 | 0 | 0 | 112.6 | E9 T10 A11 E53 | N7-E9 PolarHBondContact O-N 3.19Å; N7-T10 WeakPolarHBondContact CA-OG1 3.33Å; N7-T10 PolarHBondContact O-N 3.38Å; N7-T10 PolarHBondContact O-OG1 3.34Å; N7-A11 WeakPolarHBondContact O-CB 3.35Å; N7-A11 PolarHBondContact O-N 3.37Å; N7-E53 WeakPolarHBondContact CB-OE1 3.45Å |
| 8 | S | 63 | Low | 67.1 | Low | 12 Ų | 12 | 85.1 Ų | 85.1 | 8% | 0.084 | 49% | 0.491 | C | S | . | . | H | α-helix | trans | -63.6 | -41.5 | 175.7 | -122.1 | 0 | 0 | 0 | 0 | 114 | T10 M12 A49 K50 E53 | S8-T10 VanDerWaalsContact C-N 3.29Å; S8-M12 WeakPolarHBondContact O-CB 3.37Å; S8-M12 PolarHBondContact O-N 3.08Å; S8-A49 PolarHBondContact OG-O 2.66Å; S8-K50 WeakPolarHBondContact OG-CA 3.42Å; S8-K50 PolarHBondContact OG-N 3.48Å; S8-E53 WeakPolarHBondContact CA-OE2 3.27Å; S8-E53 WeakPolarHBondContact CB-OE2 3.22Å; S8-E53 PolarHBondContact N-OE1 3.02Å; S8-E53 PolarHBondContact N-OE2 3.19Å; S8-E53 PolarHBondContact OG-OE2 3.1Å |
| 9 | E | 67.1 | Low | 67.9 | Low | 108 Ų | 108 | 82.1 Ų | 82.1 | 51% | 0.505 | 47% | 0.472 | S | S | . | . | H | α-helix | trans | -64.8 | -39.5 | 177.9 | -70 | -169.8 | 161.4 | 0 | 0 | 110.4 | N7 Q13 K50 | N7-E9 PolarHBondContact O-N 3.19Å; E9-Q13 WeakPolarHBondContact O-CB 3.24Å; E9-Q13 PolarHBondContact O-N 3.12Å; E9-K50 WeakPolarHBondContact OE1-CE 3.37Å; E9-K50 IonicContact OE1-NZ 2.81Å; E9-K50 PolarHBondContact OE1-NZ 3.37Å |
| 10 | T | 73.1 | Confident | 68.2 | Low | 78 Ų | 78 | 81 Ų | 81 | 48% | 0.479 | 48% | 0.48 | S | S | . | . | H | α-helix | trans | -71.4 | -41.9 | 177.1 | 41.4 | 0 | 0 | 0 | 0 | 112.7 | T6 N7 S8 Q13 Q14 | T6-T10 WeakPolarHBondContact O-CB 3.28Å; T6-T10 WeakPolarHBondContact O-CG2 3.4Å; T6-T10 PolarHBondContact O-N 3.07Å; T6-T10 PolarHBondContact O-OG1 3.1Å; N7-T10 WeakPolarHBondContact CA-OG1 3.33Å; N7-T10 PolarHBondContact O-N 3.38Å; N7-T10 PolarHBondContact O-OG1 3.34Å; S8-T10 VanDerWaalsContact C-N 3.29Å; T10-Q13 PolarHBondContact O-N 2.85Å; T10-Q14 WeakPolarHBondContact O-CB 3.43Å; T10-Q14 VanDerWaalsContact O-CG 3.23Å; T10-Q14 WeakPolarHBondContact O-CG 3.38Å; T10-Q14 PolarHBondContact O-N 3.36Å |
| 11 | A | 78.4 | Confident | 68.5 | Low | 49 Ų | 49 | 81 Ų | 81 | 41% | 0.405 | 48% | 0.484 | S | S | . | . | H | α-helix | trans | -65 | -44.9 | 177.1 | 0 | 0 | 0 | 0 | 0 | 112.3 | N7 Q14 V15 | N7-A11 WeakPolarHBondContact O-CB 3.35Å; N7-A11 PolarHBondContact O-N 3.37Å; A11-Q14 WeakPolarHBondContact O-CB 3.25Å; A11-Q14 PolarHBondContact O-N 3.49Å; A11-V15 WeakPolarHBondContact O-CG2 3.39Å; A11-V15 PolarHBondContact O-N 3.15Å |
| 12 | M | 81.6 | Confident | 70.3 | Confident | 24 Ų | 24 | 73.7 Ų | 73.7 | 12% | 0.118 | 45% | 0.449 | C | S | . | . | H | α-helix | trans | -66.6 | -38.5 | 177.2 | -174.3 | 63.5 | 66.2 | 0 | 0 | 111.7 | S8 V15 L16 M40 V45 R46 A49 | S8-M12 WeakPolarHBondContact O-CB 3.37Å; S8-M12 PolarHBondContact O-N 3.08Å; M12-V15 PolarHBondContact O-N 2.86Å; M12-L16 WeakPolarHBondContact O-CG 3.48Å; M12-L16 PolarHBondContact O-N 3.14Å; M12-L16 VanDerWaalsContact O-N 3.08Å; M12-M40 HydrophobicContact CE-CE 3.86Å; M12-M40 HydrophobicContact SD-CB 4.24Å; M12-M40 HydrophobicContact SD-CE 3.22Å; M12-M40 WeakPolarHBondContact SD-CE 3.34Å; M12-M40 HydrophobicContact SD-SD 4.04Å; M12-V45 HydrophobicContact CE-CG1 4.34Å; M12-R46 HydrophobicContact CG-CG 4.17Å; M12-A49 HydrophobicContact CE-CB 3.54Å |
| 13 | Q | 82.6 | Confident | 71.3 | Confident | 90 Ų | 90 | 71.4 Ų | 71.4 | 42% | 0.421 | 43% | 0.434 | S | S | . | . | H | α-helix | trans | -64.5 | -41.7 | 174.8 | -170.7 | 60.4 | 51.2 | 0 | 0 | 111.3 | E9 T10 V15 L16 D17 | E9-Q13 WeakPolarHBondContact O-CB 3.24Å; E9-Q13 PolarHBondContact O-N 3.12Å; T10-Q13 PolarHBondContact O-N 2.85Å; Q13-V15 VanDerWaalsContact C-N 3.33Å; Q13-V15 PolarHBondContact O-N 3.44Å; Q13-L16 PolarHBondContact O-N 2.99Å; Q13-D17 PolarHBondContact NE2-OD1 2.81Å; Q13-D17 WeakPolarHBondContact O-CB 3.26Å; Q13-D17 PolarHBondContact O-N 3.37Å |
| 14 | Q | 84.1 | Confident | 71.9 | Confident | 123 Ų | 123 | 72 Ų | 72 | 58% | 0.575 | 44% | 0.444 | S | S | * | . | H | α-helix | trans | -59.9 | -40.4 | 174.1 | -76.5 | 172.7 | -4.3 | 0 | 0 | 112.4 | T10 A11 D17 N18 | T10-Q14 WeakPolarHBondContact O-CB 3.43Å; T10-Q14 VanDerWaalsContact O-CG 3.23Å; T10-Q14 WeakPolarHBondContact O-CG 3.38Å; T10-Q14 PolarHBondContact O-N 3.36Å; A11-Q14 WeakPolarHBondContact O-CB 3.25Å; A11-Q14 PolarHBondContact O-N 3.49Å; Q14-D17 PolarHBondContact O-N 3.13Å; Q14-N18 WeakPolarHBondContact O-CB 3.43Å; Q14-N18 PolarHBondContact O-N 3.49Å; Q14-N18 PolarHBondContact O-ND2 2.8Å |
| 15 | V | 83.8 | Confident | 72.2 | Confident | 60 Ų | 60 | 72.5 Ų | 72.5 | 36% | 0.364 | 45% | 0.448 | S | S | . | . | H | α-helix | trans | -64.5 | -41.3 | 175.6 | 176.9 | 0 | 0 | 0 | 0 | 111.4 | A11 M12 Q13 N18 L19 M40 | A11-V15 WeakPolarHBondContact O-CG2 3.39Å; A11-V15 PolarHBondContact O-N 3.15Å; M12-V15 PolarHBondContact O-N 2.86Å; Q13-V15 VanDerWaalsContact C-N 3.33Å; Q13-V15 PolarHBondContact O-N 3.44Å; V15-N18 PolarHBondContact O-N 3.39Å; V15-L19 HydrophobicContact CG1-CD1 4.18Å; V15-L19 HydrophobicContact CG1-CG 4.43Å; V15-L19 VanDerWaalsContact O-CG 3.3Å; V15-L19 WeakPolarHBondContact O-CG 3.43Å; V15-L19 PolarHBondContact O-N 2.94Å; V15-M40 HydrophobicContact CB-CE 4.04Å; V15-M40 HydrophobicContact CG1-CE 3.52Å; V15-M40 HydrophobicContact CG2-CE 4.48Å |
| 16 | L | 85.2 | Confident | 72.6 | Confident | 13 Ų | 13 | 73 Ų | 73 | 7% | 0.068 | 45% | 0.446 | C | S | . | . | H | α-helix | trans | -65.6 | -40.4 | 176.7 | -71.8 | 169.4 | 0 | 0 | 0 | 112.5 | M12 Q13 N18 L19 G20 R37 M40 E41 | M12-L16 WeakPolarHBondContact O-CG 3.48Å; M12-L16 PolarHBondContact O-N 3.14Å; M12-L16 VanDerWaalsContact O-N 3.08Å; Q13-L16 PolarHBondContact O-N 2.99Å; L16-N18 VanDerWaalsContact C-N 3.33Å; L16-L19 PolarHBondContact O-N 3.27Å; L16-G20 PolarHBondContact O-N 3.41Å; L16-R37 HydrophobicContact CD2-CG 4.18Å; L16-M40 HydrophobicContact CD2-CB 3.56Å; L16-M40 HydrophobicContact CG-CB 4.28Å; L16-E41 HydrophobicContact CD1-CG 4.26Å; L16-E41 HydrophobicContact CD2-CG 3.78Å |
| 17 | D | 85.7 | Confident | 72.8 | Confident | 91 Ų | 91 | 72.7 Ų | 72.7 | 49% | 0.487 | 46% | 0.46 | S | S | . | . | H | α-helix | trans | -66.4 | -38.2 | 176.6 | -64.3 | -16.6 | 0 | 0 | 0 | 111 | Q13 Q14 G20 S21 | Q13-D17 PolarHBondContact NE2-OD1 2.81Å; Q13-D17 WeakPolarHBondContact O-CB 3.26Å; Q13-D17 PolarHBondContact O-N 3.37Å; Q14-D17 PolarHBondContact O-N 3.13Å; D17-G20 PolarHBondContact O-N 2.97Å; D17-S21 WeakPolarHBondContact O-CB 3.5Å; D17-S21 PolarHBondContact O-N 2.75Å; D17-S21 VanDerWaalsContact O-N 3.12Å; D17-S21 PolarHBondContact O-OG 3.31Å |
| 18 | N | 84.1 | Confident | 73.1 | Confident | 100 Ų | 100 | 70.9 Ų | 70.9 | 54% | 0.535 | 46% | 0.456 | S | S | . | . | H | α-helix | trans | -64.1 | -47.4 | 172.8 | -71.2 | -22.5 | 0 | 0 | 0 | 111 | Q14 V15 L16 G20 S21 L22 | Q14-N18 WeakPolarHBondContact O-CB 3.43Å; Q14-N18 PolarHBondContact O-N 3.49Å; Q14-N18 PolarHBondContact O-ND2 2.8Å; V15-N18 PolarHBondContact O-N 3.39Å; L16-N18 VanDerWaalsContact C-N 3.33Å; N18-G20 VanDerWaalsContact C-N 3.27Å; N18-G20 PolarHBondContact O-N 3.06Å; N18-S21 WeakPolarHBondContact CA-OG 3.29Å; N18-S21 PolarHBondContact O-N 3.22Å; N18-S21 PolarHBondContact O-OG 2.98Å; N18-L22 WeakPolarHBondContact O-CG 3.37Å; N18-L22 PolarHBondContact O-N 2.83Å; N18-L22 VanDerWaalsContact O-N 3.09Å |
| 19 | L | 82.3 | Confident | 73.6 | Confident | 28 Ų | 28 | 72.8 Ų | 72.8 | 15% | 0.147 | 47% | 0.472 | C | S | . | . | H | α-helix | trans | -59.6 | -36.5 | 176.7 | -73 | 172.2 | 0 | 0 | 0 | 112.5 | V15 L16 S21 L22 L36 M40 | V15-L19 HydrophobicContact CG1-CD1 4.18Å; V15-L19 HydrophobicContact CG1-CG 4.43Å; V15-L19 VanDerWaalsContact O-CG 3.3Å; V15-L19 WeakPolarHBondContact O-CG 3.43Å; V15-L19 PolarHBondContact O-N 2.94Å; L16-L19 PolarHBondContact O-N 3.27Å; L19-S21 VanDerWaalsContact C-N 3.32Å; L19-L22 HydrophobicContact CD2-CD1 4Å; L19-L36 HydrophobicContact CD1-CD2 4.43Å; L19-L36 HydrophobicContact CD1-CG 4.14Å; L19-L36 HydrophobicContact CD2-CD2 3.7Å; L19-L36 HydrophobicContact CD2-CG 4.25Å; L19-M40 HydrophobicContact CD1-CG 4.18Å |
| 20 | G | 74.9 | Confident | 74.1 | Confident | 60 Ų | 60 | 75.1 Ų | 75.1 | 62% | 0.619 | 48% | 0.483 | S | S | * | . | H | α-helix | trans | -73.8 | -19 | 176.4 | 0 | 0 | 0 | 0 | 0 | 114.7 | L16 D17 N18 | L16-G20 PolarHBondContact O-N 3.41Å; D17-G20 PolarHBondContact O-N 2.97Å; N18-G20 VanDerWaalsContact C-N 3.27Å; N18-G20 PolarHBondContact O-N 3.06Å |
| 21 | S | 73.6 | Confident | 74.6 | Confident | 82 Ų | 82 | 77.8 Ų | 77.8 | 57% | 0.573 | 49% | 0.494 | S | S | * | . | H | α-helix | trans | -104.2 | -3.2 | -178.9 | 57.1 | 0 | 0 | 0 | 0 | 114 | D17 N18 L19 P23 | D17-S21 WeakPolarHBondContact O-CB 3.5Å; D17-S21 PolarHBondContact O-N 2.75Å; D17-S21 VanDerWaalsContact O-N 3.12Å; D17-S21 PolarHBondContact O-OG 3.31Å; N18-S21 WeakPolarHBondContact CA-OG 3.29Å; N18-S21 PolarHBondContact O-N 3.22Å; N18-S21 PolarHBondContact O-OG 2.98Å; L19-S21 VanDerWaalsContact C-N 3.32Å; S21-P23 WeakPolarHBondContact O-CD 3.49Å |
| 22 | L | 71.1 | Confident | 74.9 | Confident | 76 Ų | 76 | 79.9 Ų | 79.9 | 40% | 0.398 | 50% | 0.498 | S | S | . | . | trans | -61.1 | 125 | 174.4 | -72.1 | 172.9 | 0 | 0 | 0 | 109.8 | N18 L19 T26 L33 | N18-L22 WeakPolarHBondContact O-CG 3.37Å; N18-L22 PolarHBondContact O-N 2.83Å; N18-L22 VanDerWaalsContact O-N 3.09Å; L19-L22 HydrophobicContact CD2-CD1 4Å; L22-T26 HydrophobicContact CB-CG2 4.3Å; L22-T26 HydrophobicContact CD2-CG2 4.12Å; L22-L33 HydrophobicContact CD1-CD2 3.97Å | ||
| 23 | P | 63.7 | Low | 75 | Confident | 83 Ų | 83 | 80.7 Ų | 80.7 | 54% | 0.539 | 50% | 0.503 | S | S | . | . | trans | -63.9 | 145.9 | 174.6 | 23.4 | -29.1 | 0 | 0 | 0 | 109.6 | S21 A25 T26 | S21-P23 WeakPolarHBondContact O-CD 3.49Å; P23-A25 PolarHBondContact O-N 3.38Å; P23-T26 HydrophobicContact CG-CG2 4.23Å; P23-T26 WeakPolarHBondContact O-CG2 3.33Å; P23-T26 PolarHBondContact O-N 2.77Å; P23-T26 VanDerWaalsContact O-N 3.13Å; P23-T26 PolarHBondContact O-OG1 3.41Å; P23-T26 VanDerWaalsContact O-OG1 3.08Å | ||
| 24 | S | 58.1 | Low | 75.1 | Confident | 131 Ų | 131 | 81.7 Ų | 81.7 | 92% | 0.916 | 51% | 0.51 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -57 | -4.7 | 174.5 | -35.7 | 0 | 0 | 0 | 0 | 113.9 | ||
| 25 | A | 54.1 | Low | 75.3 | Confident | 93 Ų | 93 | 82.4 Ų | 82.4 | 77% | 0.769 | 51% | 0.511 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -92.5 | 5 | -180 | 0 | 0 | 0 | 0 | 0 | 114.2 | P23 G27 | P23-A25 PolarHBondContact O-N 3.38Å; A25-G27 PolarHBondContact O-N 3.44Å; A25-G27 VanDerWaalsContact O-N 3.13Å |
| 26 | T | 59.7 | Low | 75.5 | Confident | 65 Ų | 65 | 83.3 Ų | 83.3 | 40% | 0.399 | 51% | 0.514 | S | S | . | . | S | Bend | trans | -71.1 | 0.5 | -178.1 | 43.3 | 0 | 0 | 0 | 0 | 114.7 | L22 P23 A28 | L22-T26 HydrophobicContact CB-CG2 4.3Å; L22-T26 HydrophobicContact CD2-CG2 4.12Å; P23-T26 HydrophobicContact CG-CG2 4.23Å; P23-T26 WeakPolarHBondContact O-CG2 3.33Å; P23-T26 PolarHBondContact O-N 2.77Å; P23-T26 VanDerWaalsContact O-N 3.13Å; P23-T26 PolarHBondContact O-OG1 3.41Å; P23-T26 VanDerWaalsContact O-OG1 3.08Å; T26-A28 PolarHBondContact O-N 3.23Å |
| 27 | G | 61.6 | Low | 75.5 | Confident | 79 Ų | 79 | 88.5 Ų | 88.5 | 81% | 0.814 | 53% | 0.532 | S | S | * | . | S | Bend | trans | 70.4 | -6.4 | 178.6 | 0 | 0 | 0 | 0 | 0 | 114.5 | A25 | A25-G27 PolarHBondContact O-N 3.44Å; A25-G27 VanDerWaalsContact O-N 3.13Å |
| 28 | A | 66.9 | Low | 75.7 | Confident | 44 Ų | 44 | 86.1 Ų | 86.1 | 36% | 0.364 | 53% | 0.529 | S | S | . | . | S | Bend | trans | -73.4 | 141.7 | 167.6 | 0 | 0 | 0 | 0 | 0 | 109.8 | T26 E30 L33 | T26-A28 PolarHBondContact O-N 3.23Å; A28-E30 PolarHBondContact O-N 3Å; A28-L33 HydrophobicContact CB-CD1 4.32Å; A28-L33 HydrophobicContact CB-CD2 4.1Å; A28-L33 HydrophobicContact CB-CG 4.08Å |
| 29 | A | 74.1 | Confident | 76 | Confident | 52 Ų | 52 | 84.5 Ų | 84.5 | 43% | 0.43 | 52% | 0.52 | S | S | . | . | trans | -65.4 | 134.8 | 172.9 | 0 | 0 | 0 | 0 | 0 | 109.1 | L31 D32 L33 | A29-L31 PolarHBondContact O-N 3.34Å; A29-L31 VanDerWaalsContact O-N 3.1Å; A29-D32 WeakPolarHBondContact CB-OD2 3.47Å; A29-D32 WeakPolarHBondContact O-CB 3.48Å; A29-D32 PolarHBondContact O-N 2.95Å; A29-L33 PolarHBondContact O-N 3.44Å | ||
| 30 | E | 77.1 | Confident | 76.2 | Confident | 156 Ų | 156 | 84.8 Ų | 84.8 | 73% | 0.729 | 52% | 0.521 | S | S | * | . | H | α-helix | trans | -52.9 | -35 | 179.4 | -174.7 | 177.5 | -177 | 0 | 0 | 112.1 | A28 D32 L33 I34 | A28-E30 PolarHBondContact O-N 3Å; E30-D32 VanDerWaalsContact C-N 3.35Å; E30-D32 PolarHBondContact O-N 3.48Å; E30-L33 PolarHBondContact O-N 2.88Å; E30-I34 HydrophobicContact CG-CD1 4.15Å; E30-I34 VanDerWaalsContact O-CG1 3.29Å; E30-I34 WeakPolarHBondContact O-CG1 3.42Å; E30-I34 PolarHBondContact O-N 3.39Å |
| 31 | L | 83.6 | Confident | 76.8 | Confident | 134 Ų | 134 | 85.8 Ų | 85.8 | 70% | 0.702 | 51% | 0.51 | S | S | * | . | H | α-helix | trans | -61.1 | -40.2 | 175.4 | -166.3 | 106.8 | 0 | 0 | 0 | 112.8 | A29 I34 F35 | A29-L31 PolarHBondContact O-N 3.34Å; A29-L31 VanDerWaalsContact O-N 3.1Å; L31-I34 PolarHBondContact O-N 3.08Å; L31-F35 WeakPolarHBondContact O-CB 3.41Å; L31-F35 PolarHBondContact O-N 2.96Å |
| 32 | D | 84.3 | Confident | 77.7 | Confident | 94 Ų | 94 | 83.5 Ų | 83.5 | 50% | 0.503 | 49% | 0.494 | S | S | . | . | H | α-helix | trans | -70 | -36.9 | -179.4 | -62.2 | -28.1 | 0 | 0 | 0 | 110.9 | A29 E30 F35 L36 | A29-D32 WeakPolarHBondContact CB-OD2 3.47Å; A29-D32 WeakPolarHBondContact O-CB 3.48Å; A29-D32 PolarHBondContact O-N 2.95Å; E30-D32 VanDerWaalsContact C-N 3.35Å; E30-D32 PolarHBondContact O-N 3.48Å; D32-F35 PolarHBondContact O-N 3.4Å; D32-L36 VanDerWaalsContact O-CB 3.27Å; D32-L36 WeakPolarHBondContact O-CB 3.4Å; D32-L36 PolarHBondContact O-N 2.95Å |
| 33 | L | 84.3 | Confident | 78.4 | Confident | 40 Ų | 40 | 84.4 Ų | 84.4 | 21% | 0.209 | 50% | 0.504 | C | S | . | . | H | α-helix | trans | -67.3 | -40.7 | 175.5 | -65.4 | 177.9 | 0 | 0 | 0 | 111.6 | L22 A28 A29 E30 F35 R37 | L22-L33 HydrophobicContact CD1-CD2 3.97Å; A28-L33 HydrophobicContact CB-CD1 4.32Å; A28-L33 HydrophobicContact CB-CD2 4.1Å; A28-L33 HydrophobicContact CB-CG 4.08Å; A29-L33 PolarHBondContact O-N 3.44Å; E30-L33 PolarHBondContact O-N 2.88Å; L33-F35 VanDerWaalsContact C-N 3.35Å; L33-R37 VanDerWaalsContact O-CB 3.27Å; L33-R37 WeakPolarHBondContact O-CB 3.42Å; L33-R37 PolarHBondContact O-N 3.31Å |
| 34 | I | 84.1 | Confident | 79.6 | Confident | 111 Ų | 111 | 86.1 Ų | 86.1 | 57% | 0.569 | 51% | 0.508 | S | S | * | . | H | α-helix | trans | -62.1 | -45 | 173.3 | -68.3 | 164.9 | 0 | 0 | 0 | 110.3 | E30 L31 R37 G38 | E30-I34 HydrophobicContact CG-CD1 4.15Å; E30-I34 VanDerWaalsContact O-CG1 3.29Å; E30-I34 WeakPolarHBondContact O-CG1 3.42Å; E30-I34 PolarHBondContact O-N 3.39Å; L31-I34 PolarHBondContact O-N 3.08Å; I34-R37 PolarHBondContact O-N 2.72Å; I34-G38 PolarHBondContact O-N 3.38Å |
| 35 | F | 88.1 | Confident | 81 | Confident | 138 Ų | 138 | 81.9 Ų | 81.9 | 61% | 0.605 | 48% | 0.476 | S | S | * | . | H | α-helix | trans | -64.5 | -47 | 179.3 | -176 | -106.7 | 0 | 0 | 0 | 112 | L31 D32 L33 R37 G38 I39 | L31-F35 WeakPolarHBondContact O-CB 3.41Å; L31-F35 PolarHBondContact O-N 2.96Å; D32-F35 PolarHBondContact O-N 3.4Å; L33-F35 VanDerWaalsContact C-N 3.35Å; F35-R37 VanDerWaalsContact C-N 3.33Å; F35-R37 PolarHBondContact O-N 3.26Å; F35-G38 PolarHBondContact O-N 3.11Å; F35-G38 VanDerWaalsContact O-N 3.14Å; F35-I39 HydrophobicContact CD1-CD1 3.73Å; F35-I39 HydrophobicContact CD1-CG1 4.44Å; F35-I39 HydrophobicContact CE1-CD1 3.21Å; F35-I39 HydrophobicContact CE1-CG1 4.13Å; F35-I39 HydrophobicContact CE2-CD1 4.46Å; F35-I39 HydrophobicContact CZ-CD1 3.63Å; F35-I39 HydrophobicContact CZ-CG1 4.23Å; F35-I39 PolarHBondContact O-N 3.15Å |
| 36 | L | 88.1 | Confident | 82.5 | Confident | 79 Ų | 79 | 81.9 Ų | 81.9 | 41% | 0.414 | 46% | 0.456 | S | S | . | . | H | α-helix | trans | -60.4 | -44.1 | 177.5 | -177 | 59 | 0 | 0 | 0 | 111.2 | L19 D32 G38 I39 M40 | L19-L36 HydrophobicContact CD1-CD2 4.43Å; L19-L36 HydrophobicContact CD1-CG 4.14Å; L19-L36 HydrophobicContact CD2-CD2 3.7Å; L19-L36 HydrophobicContact CD2-CG 4.25Å; D32-L36 VanDerWaalsContact O-CB 3.27Å; D32-L36 WeakPolarHBondContact O-CB 3.4Å; D32-L36 PolarHBondContact O-N 2.95Å; L36-G38 VanDerWaalsContact C-N 3.34Å; L36-G38 PolarHBondContact O-N 3.33Å; L36-I39 PolarHBondContact O-N 2.76Å; L36-M40 HydrophobicContact CD1-CG 4.46Å; L36-M40 VanDerWaalsContact O-CG 3.27Å; L36-M40 WeakPolarHBondContact O-CG 3.33Å; L36-M40 PolarHBondContact O-N 3.34Å |
| 37 | R | 86.8 | Confident | 83.7 | Confident | 122 Ų | 122 | 82.4 Ų | 82.4 | 46% | 0.46 | 46% | 0.462 | S | S | . | . | H | α-helix | trans | -59.3 | -45.2 | 173.7 | -176.7 | 179.2 | 170.8 | -168.9 | -1.8 | 111.6 | L16 L33 I34 F35 I39 M40 E41 | L16-R37 HydrophobicContact CD2-CG 4.18Å; L33-R37 VanDerWaalsContact O-CB 3.27Å; L33-R37 WeakPolarHBondContact O-CB 3.42Å; L33-R37 PolarHBondContact O-N 3.31Å; I34-R37 PolarHBondContact O-N 2.72Å; F35-R37 VanDerWaalsContact C-N 3.33Å; F35-R37 PolarHBondContact O-N 3.26Å; R37-I39 VanDerWaalsContact C-N 3.33Å; R37-I39 PolarHBondContact O-N 3.41Å; R37-M40 PolarHBondContact O-N 3.18Å; R37-M40 VanDerWaalsContact O-N 3.16Å; R37-E41 HydrophobicContact CG-CG 4.39Å; R37-E41 IonicContact CZ-OE1 3.92Å; R37-E41 IonicContact NE-OE1 3.95Å; R37-E41 PolarHBondContact NE-OE1 2.96Å; R37-E41 IonicContact NH2-OE1 3.37Å; R37-E41 PolarHBondContact NH2-OE1 3.32Å; R37-E41 WeakPolarHBondContact O-CB 3.43Å; R37-E41 WeakPolarHBondContact O-CG 3.34Å; R37-E41 PolarHBondContact O-N 3.11Å |
| 38 | G | 88.8 | Confident | 84.8 | Confident | 41 Ų | 41 | 84 Ų | 84 | 42% | 0.423 | 45% | 0.451 | S | S | . | . | H | α-helix | trans | -60.7 | -38.9 | 176.5 | 0 | 0 | 0 | 0 | 0 | 113.3 | I34 F35 L36 S42 | I34-G38 PolarHBondContact O-N 3.38Å; F35-G38 PolarHBondContact O-N 3.11Å; F35-G38 VanDerWaalsContact O-N 3.14Å; L36-G38 VanDerWaalsContact C-N 3.34Å; L36-G38 PolarHBondContact O-N 3.33Å; G38-S42 PolarHBondContact O-N 2.88Å |
| 39 | I | 90.4 | Very high | 85.6 | Confident | 66 Ų | 66 | 83.2 Ų | 83.2 | 34% | 0.338 | 45% | 0.445 | S | S | . | . | H | α-helix | trans | -62.9 | -46.4 | 172.7 | -71.9 | 177.8 | 0 | 0 | 0 | 110.6 | F35 L36 R37 E41 S42 V45 | F35-I39 HydrophobicContact CD1-CD1 3.73Å; F35-I39 HydrophobicContact CD1-CG1 4.44Å; F35-I39 HydrophobicContact CE1-CD1 3.21Å; F35-I39 HydrophobicContact CE1-CG1 4.13Å; F35-I39 HydrophobicContact CE2-CD1 4.46Å; F35-I39 HydrophobicContact CZ-CD1 3.63Å; F35-I39 HydrophobicContact CZ-CG1 4.23Å; F35-I39 PolarHBondContact O-N 3.15Å; L36-I39 PolarHBondContact O-N 2.76Å; R37-I39 VanDerWaalsContact C-N 3.33Å; R37-I39 PolarHBondContact O-N 3.41Å; I39-E41 VanDerWaalsContact C-N 3.32Å; I39-E41 PolarHBondContact O-N 3.38Å; I39-S42 WeakPolarHBondContact O-CB 3.4Å; I39-S42 PolarHBondContact O-N 3.39Å; I39-S42 VanDerWaalsContact O-N 3.08Å; I39-V45 HydrophobicContact CG2-CG2 3.94Å; I39-V45 WeakPolarHBondContact O-CB 3.41Å; I39-V45 WeakPolarHBondContact O-CG2 3.41Å |
| 40 | M | 86.7 | Confident | 85.9 | Confident | 34 Ų | 34 | 84.5 Ų | 84.5 | 17% | 0.167 | 44% | 0.441 | C | S | . | . | H | α-helix | trans | -70.6 | -26.4 | -177.9 | -64.3 | -58.5 | -85.9 | 0 | 0 | 113.3 | M12 V15 L16 L19 L36 R37 S42 V45 R46 | M12-M40 HydrophobicContact CE-CE 3.86Å; M12-M40 HydrophobicContact SD-CB 4.24Å; M12-M40 HydrophobicContact SD-CE 3.22Å; M12-M40 WeakPolarHBondContact SD-CE 3.34Å; M12-M40 HydrophobicContact SD-SD 4.04Å; V15-M40 HydrophobicContact CB-CE 4.04Å; V15-M40 HydrophobicContact CG1-CE 3.52Å; V15-M40 HydrophobicContact CG2-CE 4.48Å; L16-M40 HydrophobicContact CD2-CB 3.56Å; L16-M40 HydrophobicContact CG-CB 4.28Å; L19-M40 HydrophobicContact CD1-CG 4.18Å; L36-M40 HydrophobicContact CD1-CG 4.46Å; L36-M40 VanDerWaalsContact O-CG 3.27Å; L36-M40 WeakPolarHBondContact O-CG 3.33Å; L36-M40 PolarHBondContact O-N 3.34Å; R37-M40 PolarHBondContact O-N 3.18Å; R37-M40 VanDerWaalsContact O-N 3.16Å; M40-S42 VanDerWaalsContact C-N 3.29Å; M40-V45 HydrophobicContact SD-CG1 4.29Å; M40-R46 PolarHBondContact O-NE 3.38Å |
| 41 | E | 88.7 | Confident | 86 | Confident | 81 Ų | 81 | 79.4 Ų | 79.4 | 38% | 0.379 | 43% | 0.426 | S | S | . | . | H | α-helix | trans | -77.7 | -14.5 | 171.6 | -71.6 | 176.8 | 170.7 | 0 | 0 | 112.7 | L16 R37 I39 | L16-E41 HydrophobicContact CD1-CG 4.26Å; L16-E41 HydrophobicContact CD2-CG 3.78Å; R37-E41 HydrophobicContact CG-CG 4.39Å; R37-E41 IonicContact CZ-OE1 3.92Å; R37-E41 IonicContact NE-OE1 3.95Å; R37-E41 PolarHBondContact NE-OE1 2.96Å; R37-E41 IonicContact NH2-OE1 3.37Å; R37-E41 PolarHBondContact NH2-OE1 3.32Å; R37-E41 WeakPolarHBondContact O-CB 3.43Å; R37-E41 WeakPolarHBondContact O-CG 3.34Å; R37-E41 PolarHBondContact O-N 3.11Å; I39-E41 VanDerWaalsContact C-N 3.32Å; I39-E41 PolarHBondContact O-N 3.38Å |
| 42 | S | 91.4 | Very high | 85.6 | Confident | 34 Ų | 34 | 78.5 Ų | 78.5 | 24% | 0.238 | 42% | 0.418 | C | S | . | . | trans | -59.6 | 128.5 | -179.2 | 178.3 | 0 | 0 | 0 | 0 | 111.7 | G38 I39 M40 I44 V45 R46 | G38-S42 PolarHBondContact O-N 2.88Å; I39-S42 WeakPolarHBondContact O-CB 3.4Å; I39-S42 PolarHBondContact O-N 3.39Å; I39-S42 VanDerWaalsContact O-N 3.08Å; M40-S42 VanDerWaalsContact C-N 3.29Å; S42-I44 PolarHBondContact O-N 3.45Å; S42-I44 PolarHBondContact OG-N 3.46Å; S42-V45 PolarHBondContact O-N 3.46Å; S42-V45 VanDerWaalsContact O-N 3.15Å; S42-R46 WeakPolarHBondContact O-CG 3.44Å; S42-R46 PolarHBondContact O-N 3.01Å | ||
| 43 | P | 85.7 | Confident | 84.9 | Confident | 96 Ų | 96 | 76.3 Ų | 76.3 | 62% | 0.623 | 41% | 0.405 | S | S | * | . | H | α-helix | trans | -61.9 | -26.5 | 177.4 | 24.1 | -32.5 | 0 | 0 | 0 | 112.5 | S47 | P43-S47 WeakPolarHBondContact O-CB 3.33Å; P43-S47 PolarHBondContact O-N 2.84Å; P43-S47 PolarHBondContact O-OG 3.43Å |
| 44 | I | 89.1 | Confident | 84.2 | Confident | 119 Ų | 119 | 83.5 Ų | 83.5 | 61% | 0.61 | 43% | 0.429 | S | S | * | . | H | α-helix | trans | -68.2 | -49.8 | 175.9 | -60 | 174.9 | 0 | 0 | 0 | 110 | S42 R46 S47 L48 | S42-I44 PolarHBondContact O-N 3.45Å; S42-I44 PolarHBondContact OG-N 3.46Å; I44-R46 VanDerWaalsContact C-N 3.34Å; I44-R46 PolarHBondContact O-N 3.47Å; I44-S47 PolarHBondContact O-N 2.89Å; I44-S47 VanDerWaalsContact O-N 3.16Å; I44-L48 HydrophobicContact CG2-CD1 4.08Å; I44-L48 WeakPolarHBondContact O-CG 3.49Å; I44-L48 PolarHBondContact O-N 3.14Å |
| 45 | V | 88.1 | Confident | 83.2 | Confident | 41 Ų | 41 | 84.6 Ų | 84.6 | 25% | 0.248 | 44% | 0.435 | C | S | . | . | H | α-helix | trans | -63.7 | -42 | -179.9 | 174.2 | 0 | 0 | 0 | 0 | 110.8 | M12 I39 M40 S42 S47 L48 A49 | M12-V45 HydrophobicContact CE-CG1 4.34Å; I39-V45 HydrophobicContact CG2-CG2 3.94Å; I39-V45 WeakPolarHBondContact O-CB 3.41Å; I39-V45 WeakPolarHBondContact O-CG2 3.41Å; M40-V45 HydrophobicContact SD-CG1 4.29Å; S42-V45 PolarHBondContact O-N 3.46Å; S42-V45 VanDerWaalsContact O-N 3.15Å; V45-S47 VanDerWaalsContact C-N 3.31Å; V45-S47 PolarHBondContact O-N 3.22Å; V45-L48 PolarHBondContact O-N 3.05Å; V45-A49 WeakPolarHBondContact O-CB 3.49Å; V45-A49 PolarHBondContact O-N 2.95Å |
| 46 | R | 84.3 | Confident | 81.9 | Confident | 93 Ų | 93 | 83.7 Ų | 83.7 | 35% | 0.351 | 43% | 0.433 | S | S | . | . | H | α-helix | trans | -61.1 | -39.2 | 174.1 | -70.2 | -179.6 | 170.6 | -167 | -4.3 | 112.7 | M12 M40 S42 I44 K50 | M12-R46 HydrophobicContact CG-CG 4.17Å; M40-R46 PolarHBondContact O-NE 3.38Å; S42-R46 WeakPolarHBondContact O-CG 3.44Å; S42-R46 PolarHBondContact O-N 3.01Å; I44-R46 VanDerWaalsContact C-N 3.34Å; I44-R46 PolarHBondContact O-N 3.47Å; R46-K50 WeakPolarHBondContact O-CG 3.5Å; R46-K50 PolarHBondContact O-N 3.17Å |
| 47 | S | 85.7 | Confident | 80.4 | Confident | 76 Ų | 76 | 85.6 Ų | 85.6 | 53% | 0.531 | 44% | 0.439 | S | S | . | . | H | α-helix | trans | -70 | -38.6 | 177.4 | -59.2 | 0 | 0 | 0 | 0 | 111.9 | P43 I44 V45 A51 | P43-S47 WeakPolarHBondContact O-CB 3.33Å; P43-S47 PolarHBondContact O-N 2.84Å; P43-S47 PolarHBondContact O-OG 3.43Å; I44-S47 PolarHBondContact O-N 2.89Å; I44-S47 VanDerWaalsContact O-N 3.16Å; V45-S47 VanDerWaalsContact C-N 3.31Å; V45-S47 PolarHBondContact O-N 3.22Å; S47-A51 WeakPolarHBondContact O-CB 3.4Å; S47-A51 PolarHBondContact O-N 3.32Å |
| 48 | L | 85.2 | Confident | 79 | Confident | 112 Ų | 112 | 84.7 Ų | 84.7 | 59% | 0.586 | 45% | 0.448 | S | S | * | . | H | α-helix | trans | -65.8 | -44.2 | 175.3 | -74.1 | 169.9 | 0 | 0 | 0 | 112.1 | I44 V45 K50 A51 H52 | I44-L48 HydrophobicContact CG2-CD1 4.08Å; I44-L48 WeakPolarHBondContact O-CG 3.49Å; I44-L48 PolarHBondContact O-N 3.14Å; V45-L48 PolarHBondContact O-N 3.05Å; L48-K50 VanDerWaalsContact C-N 3.33Å; L48-K50 PolarHBondContact O-N 2.92Å; L48-A51 PolarHBondContact O-N 3.28Å; L48-A51 VanDerWaalsContact O-N 3.15Å; L48-H52 WeakPolarHBondContact O-CB 3.45Å; L48-H52 PolarHBondContact O-N 3.37Å |
| 49 | A | 83 | Confident | 77.8 | Confident | 28 Ų | 28 | 91.3 Ų | 91.3 | 23% | 0.231 | 47% | 0.465 | C | S | . | . | H | α-helix | trans | -58.7 | -45.4 | 176.3 | 0 | 0 | 0 | 0 | 0 | 111.7 | S8 M12 V45 A51 H52 E53 | S8-A49 PolarHBondContact OG-O 2.66Å; M12-A49 HydrophobicContact CE-CB 3.54Å; V45-A49 WeakPolarHBondContact O-CB 3.49Å; V45-A49 PolarHBondContact O-N 2.95Å; A49-A51 VanDerWaalsContact C-N 3.34Å; A49-A51 PolarHBondContact O-N 3.31Å; A49-H52 PolarHBondContact O-N 3.33Å; A49-E53 PolarHBondContact O-N 2.97Å |
| 50 | K | 81.3 | Confident | 76.8 | Confident | 79 Ų | 79 | 95.9 Ų | 95.9 | 34% | 0.343 | 49% | 0.489 | S | S | . | . | H | α-helix | trans | -61.1 | -40.2 | 174.1 | -74.8 | 175.2 | 177.4 | -172.5 | 0 | 113 | S8 E9 R46 L48 R54 | S8-K50 WeakPolarHBondContact OG-CA 3.42Å; S8-K50 PolarHBondContact OG-N 3.48Å; E9-K50 WeakPolarHBondContact OE1-CE 3.37Å; E9-K50 IonicContact OE1-NZ 2.81Å; E9-K50 PolarHBondContact OE1-NZ 3.37Å; R46-K50 WeakPolarHBondContact O-CG 3.5Å; R46-K50 PolarHBondContact O-N 3.17Å; L48-K50 VanDerWaalsContact C-N 3.33Å; L48-K50 PolarHBondContact O-N 2.92Å; K50-R54 VanDerWaalsContact O-CG 3.28Å; K50-R54 WeakPolarHBondContact O-CG 3.41Å; K50-R54 PolarHBondContact O-N 3.2Å |
| 51 | A | 79.3 | Confident | 76.5 | Confident | 49 Ų | 49 | 102.1 Ų | 102.1 | 41% | 0.405 | 52% | 0.518 | S | S | . | . | H | α-helix | trans | -68.5 | -38.9 | 178.3 | 0 | 0 | 0 | 0 | 0 | 111.5 | S47 L48 A49 L55 | S47-A51 WeakPolarHBondContact O-CB 3.4Å; S47-A51 PolarHBondContact O-N 3.32Å; L48-A51 PolarHBondContact O-N 3.28Å; L48-A51 VanDerWaalsContact O-N 3.15Å; A49-A51 VanDerWaalsContact C-N 3.34Å; A49-A51 PolarHBondContact O-N 3.31Å; A51-L55 WeakPolarHBondContact O-CG 3.47Å; A51-L55 PolarHBondContact O-N 3.04Å |
| 52 | H | 75.2 | Confident | 76.2 | Confident | 115 Ų | 115 | 100.6 Ų | 100.6 | 53% | 0.532 | 52% | 0.519 | S | S | . | . | H | α-helix | trans | -65.3 | -49 | 179 | -170.8 | 56.9 | 0 | 0 | 0 | 111.9 | L48 A49 R54 L55 E56 | L48-H52 WeakPolarHBondContact O-CB 3.45Å; L48-H52 PolarHBondContact O-N 3.37Å; A49-H52 PolarHBondContact O-N 3.33Å; H52-R54 VanDerWaalsContact C-N 3.34Å; H52-R54 PolarHBondContact O-N 3.23Å; H52-L55 WeakPolarHBondContact O-CA 2.81Å; H52-L55 WeakPolarHBondContact O-CB 2.97Å; H52-L55 PolarHBondContact O-N 3.01Å; H52-E56 IonicContact CD2-OE1 3Å; H52-E56 IonicContact CE1-OE1 2.64Å; H52-E56 IonicContact NE2-OE1 3.33Å; H52-E56 PolarHBondContact NE2-OE1 3.01Å; H52-E56 PolarHBondContact O-N 3.12Å; H52-E56 VanDerWaalsContact O-N 3.1Å |
| 53 | E | 69.5 | Low | 75.8 | Confident | 49 Ų | 49 | 106.1 Ų | 106.1 | 23% | 0.229 | 55% | 0.551 | C | S | . | * | H | α-helix | trans | -63.7 | -38.3 | 180 | -170.9 | -178.4 | -159.6 | 0 | 0 | 112.5 | N7 S8 A49 L55 E56 E57 | N7-E53 WeakPolarHBondContact CB-OE1 3.45Å; S8-E53 WeakPolarHBondContact CA-OE2 3.27Å; S8-E53 WeakPolarHBondContact CB-OE2 3.22Å; S8-E53 PolarHBondContact N-OE1 3.02Å; S8-E53 PolarHBondContact N-OE2 3.19Å; S8-E53 PolarHBondContact OG-OE2 3.1Å; A49-E53 PolarHBondContact O-N 2.97Å; E53-L55 PolarHBondContact O-N 3.47Å; E53-E56 PolarHBondContact O-N 2.88Å; E53-E57 PolarHBondContact O-N 3.45Å |
| 54 | R | 68.7 | Low | 75.6 | Confident | 190 Ų | 190 | 107.3 Ų | 107.3 | 72% | 0.717 | 54% | 0.543 | S | S | * | . | H | α-helix | trans | -62.3 | -24 | 173.8 | -74.9 | 179.8 | 70.1 | -177.4 | 1.6 | 113.4 | K50 H52 | K50-R54 VanDerWaalsContact O-CG 3.28Å; K50-R54 WeakPolarHBondContact O-CG 3.41Å; K50-R54 PolarHBondContact O-N 3.2Å; H52-R54 VanDerWaalsContact C-N 3.34Å; H52-R54 PolarHBondContact O-N 3.23Å |
| 55 | L | 62.5 | Low | 75.4 | Confident | 135 Ų | 135 | 106 Ų | 106 | 71% | 0.707 | 54% | 0.537 | S | S | * | . | H | α-helix | trans | -85.7 | -25.5 | 174.6 | -67 | 167.7 | 0 | 0 | 0 | 111.7 | A51 H52 E53 | A51-L55 WeakPolarHBondContact O-CG 3.47Å; A51-L55 PolarHBondContact O-N 3.04Å; H52-L55 WeakPolarHBondContact O-CA 2.81Å; H52-L55 WeakPolarHBondContact O-CB 2.97Å; H52-L55 PolarHBondContact O-N 3.01Å; E53-L55 PolarHBondContact O-N 3.47Å |
| 56 | E | 61.5 | Low | 75.5 | Confident | 119 Ų | 119 | 108 Ų | 108 | 56% | 0.556 | 55% | 0.547 | S | S | * | . | H | α-helix | trans | -78 | -28.2 | 177.9 | -69.9 | -170.2 | 147.9 | 0 | 0 | 113.9 | H52 E53 T58 K59 | H52-E56 IonicContact CD2-OE1 3Å; H52-E56 IonicContact CE1-OE1 2.64Å; H52-E56 IonicContact NE2-OE1 3.33Å; H52-E56 PolarHBondContact NE2-OE1 3.01Å; H52-E56 PolarHBondContact O-N 3.12Å; H52-E56 VanDerWaalsContact O-N 3.1Å; E53-E56 PolarHBondContact O-N 2.88Å; E56-T58 PolarHBondContact O-N 2.74Å; E56-T58 VanDerWaalsContact O-N 3.15Å; E56-K59 PolarHBondContact O-N 3.1Å |
| 57 | E | 57.3 | Low | 75.9 | Confident | 118 Ų | 118 | 104.3 Ų | 104.3 | 55% | 0.551 | 53% | 0.534 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -63.8 | -19.1 | -177.4 | -77.9 | -174.5 | 168.1 | 0 | 0 | 114.3 | E53 | E53-E57 PolarHBondContact O-N 3.45Š|
| 58 | T | 57 | Low | 76.3 | Confident | 104 Ų | 104 | 102.7 Ų | 102.7 | 64% | 0.638 | 52% | 0.519 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -114.8 | 63 | 175.4 | 51.1 | 0 | 0 | 0 | 0 | 110.8 | E56 L60 | E56-T58 PolarHBondContact O-N 2.74Å; E56-T58 VanDerWaalsContact O-N 3.15Å; T58-L60 VanDerWaalsContact C-N 3.27Å; T58-L60 PolarHBondContact O-N 3.05Å |
| 59 | K | 62.3 | Low | 76.7 | Confident | 179 Ų | 179 | 102.2 Ų | 102.2 | 78% | 0.778 | 51% | 0.514 | S | S | * | . | trans | -71.1 | 87.6 | 170.5 | -162.4 | 178.5 | -177.7 | -174.4 | 0 | 109.5 | E56 | E56-K59 PolarHBondContact O-N 3.1Š| ||
| 60 | L | 71.4 | Confident | 77.2 | Confident | 163 Ų | 163 | 103.2 Ų | 103.2 | 85% | 0.853 | 52% | 0.515 | S | S | * | . | P | Polyproline II helix | trans | -76.4 | 123.6 | 167.5 | -70.9 | 162.4 | 0 | 0 | 0 | 107.6 | T58 | T58-L60 VanDerWaalsContact C-N 3.27Å; T58-L60 PolarHBondContact O-N 3.05Å |
| 61 | E | 78.5 | Confident | 77.9 | Confident | 165 Ų | 165 | 99.9 Ų | 99.9 | 77% | 0.771 | 50% | 0.501 | S | S | * | . | P | Polyproline II helix | trans | -83.5 | 130.3 | 173.4 | -65 | -174.1 | 166.9 | 0 | 0 | 109.1 | V63 | E61-V63 PolarHBondContact O-N 3.46Š|
| 62 | A | 82.6 | Confident | 78.6 | Confident | 48 Ų | 48 | 103.4 Ų | 103.4 | 40% | 0.397 | 51% | 0.509 | S | S | . | . | P | Polyproline II helix | trans | -64 | 130.3 | 172.8 | 0 | 0 | 0 | 0 | 0 | 109 | R64 A111 | A62-R64 PolarHBondContact O-N 2.88Å; A62-A111 HydrophobicContact CB-CB 3.47Å; A62-A111 VanDerWaalsContact CB-CB 3.47Å |
| 63 | V | 83.1 | Confident | 79.5 | Confident | 150 Ų | 150 | 101.8 Ų | 101.8 | 91% | 0.909 | 50% | 0.502 | S | S | * | . | S | Bend | trans | -63.6 | -30.9 | 177.1 | 178.3 | 0 | 0 | 0 | 0 | 110.9 | E61 | E61-V63 PolarHBondContact O-N 3.46Š|
| 64 | R | 82.3 | Confident | 80.8 | Confident | 121 Ų | 121 | 102.2 Ų | 102.2 | 46% | 0.457 | 51% | 0.505 | S | S | . | . | trans | -164.7 | 164.7 | 172.1 | 64.3 | 174.5 | -168.7 | -134.3 | -9.2 | 110.2 | A62 N67 H107 | A62-R64 PolarHBondContact O-N 2.88Å; R64-N67 PolarHBondContact NE-OD1 3.01Å; R64-N67 PolarHBondContact NH2-OD1 3.37Å; R64-N67 PolarHBondContact O-ND2 3.13Å; R64-H107 PolarHBondContact O-CE1 3.18Å | ||
| 65 | D | 85.3 | Confident | 82 | Confident | 92 Ų | 92 | 94.6 Ų | 94.6 | 49% | 0.492 | 48% | 0.479 | S | S | . | . | S | Bend | trans | -97.6 | -177.7 | 164 | 55 | 5.8 | 0 | 0 | 0 | 110.8 | N67 A111 | D65-N67 VanDerWaalsContact C-N 3.35Å; D65-N67 PolarHBondContact O-N 3.15Å; D65-A111 HydrophobicContact CB-CB 4.2Å |
| 66 | N | 90.5 | Very high | 83.6 | Confident | 83 Ų | 83 | 95.6 Ų | 95.6 | 44% | 0.444 | 47% | 0.473 | S | S | . | . | trans | 60.2 | 37.7 | 172.3 | -151.8 | 42.3 | 0 | 0 | 0 | 114.7 | L68 E69 L70 D108 | N66-L68 PolarHBondContact O-N 3.04Å; N66-E69 PolarHBondContact ND2-OE2 3Å; N66-E69 PolarHBondContact O-N 3.1Å; N66-L70 PolarHBondContact O-N 2.75Å; N66-D108 WeakPolarHBondContact CA-OD2 3.28Å; N66-D108 PolarHBondContact N-OD1 3.17Å | ||
| 67 | N | 92.8 | Very high | 85.1 | Confident | 15 Ų | 15 | 94.4 Ų | 94.4 | 8% | 0.08 | 47% | 0.47 | C | S | . | . | H | α-helix | trans | -65.6 | -27.3 | 177.6 | -67.8 | -80.4 | 0 | 0 | 0 | 112.9 | R64 D65 L70 V71 L104 H107 D108 | R64-N67 PolarHBondContact NE-OD1 3.01Å; R64-N67 PolarHBondContact NH2-OD1 3.37Å; R64-N67 PolarHBondContact O-ND2 3.13Å; D65-N67 VanDerWaalsContact C-N 3.35Å; D65-N67 PolarHBondContact O-N 3.15Å; N67-L70 PolarHBondContact O-N 2.77Å; N67-V71 PolarHBondContact O-N 3.13Å; N67-L104 HydrophobicContact CB-CD2 3.93Å; N67-H107 PolarHBondContact ND2-CE1 3.08Å; N67-H107 VanDerWaalsContact ND2-CE1 3.34Å; N67-H107 PolarHBondContact ND2-ND1 3Å; N67-H107 VanDerWaalsContact ND2-ND1 3.18Å; N67-D108 WeakPolarHBondContact CB-OD1 3.33Å; N67-D108 VanDerWaalsContact N-CG 3.27Å; N67-D108 PolarHBondContact N-OD1 3.35Å; N67-D108 PolarHBondContact N-OD2 3.18Å; N67-D108 PolarHBondContact ND2-OD1 3.41Å |
| 68 | L | 92.5 | Very high | 86.9 | Confident | 42 Ų | 42 | 89.7 Ų | 89.7 | 22% | 0.22 | 45% | 0.449 | C | S | . | . | H | α-helix | trans | -62.6 | -43.6 | 177.3 | -150.5 | 80.2 | 0 | 0 | 0 | 111.8 | N66 V71 Q72 Q101 L104 E105 D108 | N66-L68 PolarHBondContact O-N 3.04Å; L68-V71 PolarHBondContact O-N 2.81Å; L68-Q72 WeakPolarHBondContact O-CG 3.43Å; L68-Q72 PolarHBondContact O-N 3.43Å; L68-Q72 VanDerWaalsContact O-N 3.15Å; L68-Q101 VanDerWaalsContact CD1-OE1 3.25Å; L68-L104 HydrophobicContact CD1-CB 4.13Å; L68-E105 HydrophobicContact CD1-CG 3.84Å; L68-E105 HydrophobicContact CD2-CG 4.36Å; L68-D108 PolarHBondContact N-OD2 3.16Å |
| 69 | E | 93.3 | Very high | 88.5 | Confident | 102 Ų | 102 | 87.6 Ų | 87.6 | 48% | 0.477 | 44% | 0.442 | S | S | . | . | H | α-helix | trans | -63.8 | -44.3 | 176.7 | -173.2 | 169.5 | -172.5 | 0 | 0 | 110.5 | N66 V71 Q72 E73 | N66-E69 PolarHBondContact ND2-OE2 3Å; N66-E69 PolarHBondContact O-N 3.1Å; E69-V71 VanDerWaalsContact C-N 3.33Å; E69-V71 PolarHBondContact O-N 3.08Å; E69-Q72 WeakPolarHBondContact O-CB 3.27Å; E69-Q72 PolarHBondContact O-N 3.28Å; E69-Q72 VanDerWaalsContact O-N 3.12Å; E69-E73 PolarHBondContact O-N 3.38Å; E69-E73 VanDerWaalsContact O-N 3.08Å |
| 70 | L | 94.1 | Very high | 89.8 | Confident | 50 Ų | 50 | 86.2 Ų | 86.2 | 26% | 0.262 | 44% | 0.439 | S | S | . | . | H | α-helix | trans | -61.2 | -42.1 | 176.7 | -175.3 | 73.6 | 0 | 0 | 0 | 112.2 | N66 N67 Q72 E73 I74 | N66-L70 PolarHBondContact O-N 2.75Å; N67-L70 PolarHBondContact O-N 2.77Å; L70-Q72 PolarHBondContact O-N 3.48Å; L70-E73 WeakPolarHBondContact O-CB 3.46Å; L70-E73 PolarHBondContact O-N 3.21Å; L70-E73 VanDerWaalsContact O-N 3.1Å; L70-I74 HydrophobicContact CD1-CG1 4.49Å; L70-I74 HydrophobicContact CD2-CD1 3.87Å; L70-I74 HydrophobicContact CG-CD1 3.76Å; L70-I74 HydrophobicContact CG-CG1 4.12Å; L70-I74 WeakPolarHBondContact O-CG1 3.39Å; L70-I74 PolarHBondContact O-N 3.44Å |
| 71 | V | 95.3 | Very high | 90.8 | Very high | 9 Ų | 9 | 83 Ų | 83 | 6% | 0.055 | 42% | 0.422 | C | S | . | . | H | α-helix | trans | -61.7 | -36.3 | 178.2 | 165.7 | 0 | 0 | 0 | 0 | 111.2 | N67 L68 E69 E73 I74 L75 L95 L104 | N67-V71 PolarHBondContact O-N 3.13Å; L68-V71 PolarHBondContact O-N 2.81Å; E69-V71 VanDerWaalsContact C-N 3.33Å; E69-V71 PolarHBondContact O-N 3.08Å; V71-E73 VanDerWaalsContact C-N 3.34Å; V71-E73 PolarHBondContact O-N 3.28Å; V71-I74 PolarHBondContact O-N 2.9Å; V71-L75 HydrophobicContact CG1-CD1 3.98Å; V71-L75 HydrophobicContact CG1-CG 4.22Å; V71-L75 WeakPolarHBondContact O-CB 3.33Å; V71-L75 VanDerWaalsContact O-CG 3.24Å; V71-L75 WeakPolarHBondContact O-CG 3.42Å; V71-L75 PolarHBondContact O-N 3.44Å; V71-L95 HydrophobicContact CG1-CB 4.08Å; V71-L95 HydrophobicContact CG1-CD2 4.46Å; V71-L95 HydrophobicContact CG2-CD2 4.29Å; V71-L104 HydrophobicContact CB-CD1 4.21Å; V71-L104 HydrophobicContact CG2-CD1 3.45Å; V71-L104 VanDerWaalsContact CG2-CD1 3.45Å |
| 72 | Q | 94.2 | Very high | 91.4 | Very high | 122 Ų | 122 | 76.7 Ų | 76.7 | 57% | 0.57 | 40% | 0.398 | S | S | * | . | H | α-helix | trans | -63.4 | -39.6 | 173.7 | -67 | 176.8 | 14.4 | 0 | 0 | 112.2 | L68 E69 L70 L75 R76 | L68-Q72 WeakPolarHBondContact O-CG 3.43Å; L68-Q72 PolarHBondContact O-N 3.43Å; L68-Q72 VanDerWaalsContact O-N 3.15Å; E69-Q72 WeakPolarHBondContact O-CB 3.27Å; E69-Q72 PolarHBondContact O-N 3.28Å; E69-Q72 VanDerWaalsContact O-N 3.12Å; L70-Q72 PolarHBondContact O-N 3.48Å; Q72-L75 PolarHBondContact O-N 3.19Å; Q72-R76 PolarHBondContact O-N 3.05Å; Q72-R76 VanDerWaalsContact O-N 3.13Å |
| 73 | E | 95.8 | Very high | 91.6 | Very high | 81 Ų | 81 | 83 Ų | 83 | 38% | 0.379 | 42% | 0.419 | S | S | . | . | H | α-helix | trans | -64.3 | -47.1 | 173.6 | -62.9 | -169.4 | 146.2 | 0 | 0 | 112 | E69 L70 V71 L75 R76 D77 | E69-E73 PolarHBondContact O-N 3.38Å; E69-E73 VanDerWaalsContact O-N 3.08Å; L70-E73 WeakPolarHBondContact O-CB 3.46Å; L70-E73 PolarHBondContact O-N 3.21Å; L70-E73 VanDerWaalsContact O-N 3.1Å; V71-E73 VanDerWaalsContact C-N 3.34Å; V71-E73 PolarHBondContact O-N 3.28Å; E73-L75 VanDerWaalsContact C-N 3.3Å; E73-L75 PolarHBondContact O-N 3.15Å; E73-R76 WeakPolarHBondContact O-CB 3.33Å; E73-R76 PolarHBondContact O-N 3.3Å; E73-R76 VanDerWaalsContact O-N 3.14Å; E73-D77 PolarHBondContact O-N 2.89Å; E73-D77 VanDerWaalsContact O-N 3.07Å |
| 74 | I | 95.1 | Very high | 92.1 | Very high | 58 Ų | 58 | 84.1 Ų | 84.1 | 30% | 0.297 | 41% | 0.414 | S | S | . | . | H | α-helix | trans | -58.7 | -43.2 | 177.3 | -69.4 | 168.4 | 0 | 0 | 0 | 110.6 | L70 V71 R76 D77 L78 L95 | L70-I74 HydrophobicContact CD1-CG1 4.49Å; L70-I74 HydrophobicContact CD2-CD1 3.87Å; L70-I74 HydrophobicContact CG-CD1 3.76Å; L70-I74 HydrophobicContact CG-CG1 4.12Å; L70-I74 WeakPolarHBondContact O-CG1 3.39Å; L70-I74 PolarHBondContact O-N 3.44Å; V71-I74 PolarHBondContact O-N 2.9Å; I74-R76 VanDerWaalsContact C-N 3.32Å; I74-R76 PolarHBondContact O-N 3.35Å; I74-D77 PolarHBondContact O-N 3.46Å; I74-L78 HydrophobicContact CG2-CD1 3.61Å; I74-L78 HydrophobicContact CG2-CG 4.01Å; I74-L78 WeakPolarHBondContact O-CB 3.44Å; I74-L78 VanDerWaalsContact O-CG 3.28Å; I74-L78 WeakPolarHBondContact O-CG 3.46Å; I74-L78 PolarHBondContact O-N 2.87Å; I74-L95 HydrophobicContact CG2-CD1 3.76Å |
| 75 | L | 95.6 | Very high | 92.7 | Very high | 31 Ų | 31 | 80.6 Ų | 80.6 | 16% | 0.162 | 41% | 0.408 | C | S | . | . | H | α-helix | trans | -63.7 | -37.4 | 178.6 | -76.2 | 175.8 | 0 | 0 | 0 | 112.2 | V71 Q72 E73 D77 A79 A92 L95 Q96 | V71-L75 HydrophobicContact CG1-CD1 3.98Å; V71-L75 HydrophobicContact CG1-CG 4.22Å; V71-L75 WeakPolarHBondContact O-CB 3.33Å; V71-L75 VanDerWaalsContact O-CG 3.24Å; V71-L75 WeakPolarHBondContact O-CG 3.42Å; V71-L75 PolarHBondContact O-N 3.44Å; Q72-L75 PolarHBondContact O-N 3.19Å; E73-L75 VanDerWaalsContact C-N 3.3Å; E73-L75 PolarHBondContact O-N 3.15Å; L75-D77 VanDerWaalsContact C-N 3.33Å; L75-A79 PolarHBondContact O-N 3Å; L75-A92 HydrophobicContact CD2-CB 3.86Å; L75-L95 HydrophobicContact CD2-CB 3.96Å; L75-L95 HydrophobicContact CD2-CD1 4.24Å; L75-L95 HydrophobicContact CG-CB 4.43Å; L75-Q96 HydrophobicContact CD1-CG 3.66Å; L75-Q96 HydrophobicContact CD2-CG 4.03Å |
| 76 | R | 94.9 | Very high | 93.1 | Very high | 155 Ų | 155 | 81 Ų | 81 | 59% | 0.585 | 42% | 0.418 | S | S | * | . | H | α-helix | trans | -63.5 | -40.7 | 174.7 | -179.3 | 176.2 | 62.9 | -151.1 | -4.8 | 111.5 | Q72 E73 I74 | Q72-R76 PolarHBondContact O-N 3.05Å; Q72-R76 VanDerWaalsContact O-N 3.13Å; E73-R76 WeakPolarHBondContact O-CB 3.33Å; E73-R76 PolarHBondContact O-N 3.3Å; E73-R76 VanDerWaalsContact O-N 3.14Å; I74-R76 VanDerWaalsContact C-N 3.32Å; I74-R76 PolarHBondContact O-N 3.35Å |
| 77 | D | 93.8 | Very high | 93.3 | Very high | 94 Ų | 94 | 81.4 Ų | 81.4 | 50% | 0.503 | 42% | 0.424 | S | S | . | . | H | α-helix | trans | -73.3 | -40.6 | 179 | -65.9 | -9.6 | 0 | 0 | 0 | 111.4 | E73 I74 L75 A79 Q80 | E73-D77 PolarHBondContact O-N 2.89Å; E73-D77 VanDerWaalsContact O-N 3.07Å; I74-D77 PolarHBondContact O-N 3.46Å; L75-D77 VanDerWaalsContact C-N 3.33Å; D77-A79 VanDerWaalsContact C-N 3.29Å; D77-A79 PolarHBondContact O-N 3.36Å; D77-Q80 PolarHBondContact O-N 3.03Å |
| 78 | L | 94 | Very high | 93.4 | Very high | 19 Ų | 19 | 81.1 Ų | 81.1 | 10% | 0.099 | 42% | 0.424 | C | S | . | . | H | α-helix | trans | -65.7 | -29.4 | 176.7 | -75.6 | 176.2 | 0 | 0 | 0 | 112.8 | I74 Q80 L81 A82 A88 L91 A92 L95 | I74-L78 HydrophobicContact CG2-CD1 3.61Å; I74-L78 HydrophobicContact CG2-CG 4.01Å; I74-L78 WeakPolarHBondContact O-CB 3.44Å; I74-L78 VanDerWaalsContact O-CG 3.28Å; I74-L78 WeakPolarHBondContact O-CG 3.46Å; I74-L78 PolarHBondContact O-N 2.87Å; L78-Q80 PolarHBondContact O-N 2.88Å; L78-L81 HydrophobicContact CD2-CD1 4.4Å; L78-L81 CarbonylContact O-C 3.55Å; L78-L81 PolarHBondContact O-N 3.1Å; L78-A82 WeakPolarHBondContact O-CB 3.23Å; L78-A82 PolarHBondContact O-N 2.83Å; L78-A88 HydrophobicContact CD2-CB 4.03Å; L78-L91 HydrophobicContact CD1-CB 4.35Å; L78-L91 HydrophobicContact CD1-CD2 3.83Å; L78-L91 HydrophobicContact CD1-CG 3.88Å; L78-L91 HydrophobicContact CD2-CD2 4.31Å; L78-A92 HydrophobicContact CB-CB 4.42Å; L78-A92 HydrophobicContact CD1-CB 4.32Å; L78-L95 HydrophobicContact CD1-CD1 4.04Å |
| 79 | A | 90.6 | Very high | 93.5 | Very high | 60 Ų | 60 | 81.1 Ų | 81.1 | 50% | 0.496 | 43% | 0.43 | S | S | . | . | H | α-helix | trans | -55.9 | -35.5 | 178.6 | 0 | 0 | 0 | 0 | 0 | 112.3 | L75 D77 L81 | L75-A79 PolarHBondContact O-N 3Å; D77-A79 VanDerWaalsContact C-N 3.29Å; D77-A79 PolarHBondContact O-N 3.36Å; A79-L81 VanDerWaalsContact C-N 3.34Å |
| 80 | Q | 90.7 | Very high | 93.7 | Very high | 151 Ų | 151 | 82.1 Ų | 82.1 | 71% | 0.706 | 43% | 0.434 | S | S | * | . | H | α-helix | trans | -73.6 | -27.5 | 177.5 | -57.5 | -178 | 17.3 | 0 | 0 | 112.6 | D77 L78 | D77-Q80 PolarHBondContact O-N 3.03Å; L78-Q80 PolarHBondContact O-N 2.88Å |
| 81 | L | 91.9 | Very high | 93.8 | Very high | 95 Ų | 95 | 83.5 Ų | 83.5 | 50% | 0.497 | 44% | 0.441 | S | S | . | . | H | α-helix | trans | -91.5 | -24.8 | -177.1 | -65.5 | 165.8 | 0 | 0 | 0 | 112.5 | L78 A79 E83 Q84 S85 A88 | L78-L81 HydrophobicContact CD2-CD1 4.4Å; L78-L81 CarbonylContact O-C 3.55Å; L78-L81 PolarHBondContact O-N 3.1Å; A79-L81 VanDerWaalsContact C-N 3.34Å; L81-E83 PolarHBondContact O-N 2.91Å; L81-Q84 PolarHBondContact O-N 3.42Å; L81-S85 PolarHBondContact O-N 2.91Å; L81-A88 HydrophobicContact CB-CB 3.91Å |
| 82 | A | 90.1 | Very high | 93.8 | Very high | 32 Ų | 32 | 83.6 Ų | 83.6 | 26% | 0.264 | 44% | 0.443 | S | S | . | . | H | α-helix | trans | -63.4 | -26.9 | -177.1 | 0 | 0 | 0 | 0 | 0 | 113 | L78 Q84 A89 | L78-A82 WeakPolarHBondContact O-CB 3.23Å; L78-A82 PolarHBondContact O-N 2.83Å; A82-Q84 VanDerWaalsContact C-N 3.25Å; A82-Q84 PolarHBondContact O-N 2.85Å; A82-A89 HydrophobicContact CB-CB 4.12Å |
| 83 | E | 88.6 | Confident | 93.9 | Very high | 180 Ų | 180 | 83.7 Ų | 83.7 | 84% | 0.841 | 44% | 0.443 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -68.7 | -25.3 | 175.2 | -63.6 | -162.4 | 166.3 | 0 | 0 | 113.1 | L81 | L81-E83 PolarHBondContact O-N 2.91Š|
| 84 | Q | 91.9 | Very high | 94 | Very high | 175 Ų | 175 | 83 Ų | 83 | 82% | 0.818 | 44% | 0.442 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -111.5 | -15.3 | -172.3 | -59.8 | 179.5 | 14.7 | 0 | 0 | 112.9 | L81 A82 | L81-Q84 PolarHBondContact O-N 3.42Å; A82-Q84 VanDerWaalsContact C-N 3.25Å; A82-Q84 PolarHBondContact O-N 2.85Å |
| 85 | S | 94.8 | Very high | 94 | Very high | 47 Ų | 47 | 81 Ų | 81 | 33% | 0.329 | 43% | 0.432 | S | S | . | . | trans | -135.8 | 115.8 | -175 | 175.4 | 0 | 0 | 0 | 0 | 111 | L81 T87 A88 A89 | L81-S85 PolarHBondContact O-N 2.91Å; S85-T87 PolarHBondContact O-N 2.64Å; S85-T87 PolarHBondContact OG-N 3.43Å; S85-A88 PolarHBondContact O-N 3.45Å; S85-A88 VanDerWaalsContact O-N 3.15Å; S85-A88 PolarHBondContact OG-N 2.91Å; S85-A89 PolarHBondContact O-N 3.28Å; S85-A89 VanDerWaalsContact O-N 3.08Å | ||
| 86 | S | 94.4 | Very high | 94 | Very high | 99 Ų | 99 | 85.1 Ų | 85.1 | 69% | 0.692 | 45% | 0.45 | S | S | * | . | H | α-helix | trans | -60.3 | -32.7 | 173 | 58.8 | 0 | 0 | 0 | 0 | 112 | A89 E90 | S86-A89 PolarHBondContact O-N 3.09Å; S86-E90 WeakPolarHBondContact O-CB 3.44Å; S86-E90 PolarHBondContact O-N 3.07Å |
| 87 | T | 95.7 | Very high | 94.1 | Very high | 93 Ų | 93 | 81.5 Ų | 81.5 | 57% | 0.571 | 44% | 0.44 | S | S | * | . | H | α-helix | trans | -68 | -38.4 | 176.5 | -53.4 | 0 | 0 | 0 | 0 | 111.8 | S85 E90 L91 | S85-T87 PolarHBondContact O-N 2.64Å; S85-T87 PolarHBondContact OG-N 3.43Å; T87-E90 PolarHBondContact O-N 3.12Å; T87-L91 WeakPolarHBondContact O-CB 3.48Å; T87-L91 PolarHBondContact O-N 3.25Å |
| 88 | A | 94.8 | Very high | 94.3 | Very high | 9 Ų | 9 | 81.3 Ų | 81.3 | 7% | 0.074 | 44% | 0.444 | C | S | . | . | H | α-helix | trans | -67.1 | -39.3 | 175.2 | 0 | 0 | 0 | 0 | 0 | 111.3 | L78 L81 S85 A92 | L78-A88 HydrophobicContact CD2-CB 4.03Å; L81-A88 HydrophobicContact CB-CB 3.91Å; S85-A88 PolarHBondContact O-N 3.45Å; S85-A88 VanDerWaalsContact O-N 3.15Å; S85-A88 PolarHBondContact OG-N 2.91Å; A88-A92 WeakPolarHBondContact O-CB 3.41Å; A88-A92 PolarHBondContact O-N 2.89Å |
| 89 | A | 94.5 | Very high | 94.4 | Very high | 42 Ų | 42 | 87.5 Ų | 87.5 | 35% | 0.347 | 47% | 0.472 | S | S | . | . | H | α-helix | trans | -64.5 | -42.4 | 174.4 | 0 | 0 | 0 | 0 | 0 | 112.3 | A82 S85 S86 A92 H93 | A82-A89 HydrophobicContact CB-CB 4.12Å; S85-A89 PolarHBondContact O-N 3.28Å; S85-A89 VanDerWaalsContact O-N 3.08Å; S86-A89 PolarHBondContact O-N 3.09Å; A89-A92 PolarHBondContact O-N 3.38Å; A89-H93 WeakPolarHBondContact O-CB 3.49Å; A89-H93 PolarHBondContact O-N 3.08Å |
| 90 | E | 96.8 | Very high | 94.7 | Very high | 123 Ų | 123 | 87.7 Ų | 87.7 | 58% | 0.575 | 46% | 0.462 | S | S | * | . | H | α-helix | trans | -63.7 | -45.1 | 176.3 | -174.8 | 178.1 | -164.8 | 0 | 0 | 111.6 | S86 T87 A92 H93 I94 | S86-E90 WeakPolarHBondContact O-CB 3.44Å; S86-E90 PolarHBondContact O-N 3.07Å; T87-E90 PolarHBondContact O-N 3.12Å; E90-A92 PolarHBondContact O-N 2.87Å; E90-H93 WeakPolarHBondContact O-CB 3.4Å; E90-H93 PolarHBondContact O-N 3.31Å; E90-I94 HydrophobicContact CG-CD1 4.18Å; E90-I94 WeakPolarHBondContact O-CG1 3.48Å; E90-I94 PolarHBondContact O-N 3.4Å |
| 91 | L | 96.4 | Very high | 94.9 | Very high | 78 Ų | 78 | 82.5 Ų | 82.5 | 41% | 0.408 | 44% | 0.437 | S | S | . | . | H | α-helix | trans | -61.4 | -45.3 | 175.6 | 179.6 | 60.2 | 0 | 0 | 0 | 111.4 | L78 T87 H93 I94 L95 | L78-L91 HydrophobicContact CD1-CB 4.35Å; L78-L91 HydrophobicContact CD1-CD2 3.83Å; L78-L91 HydrophobicContact CD1-CG 3.88Å; L78-L91 HydrophobicContact CD2-CD2 4.31Å; T87-L91 WeakPolarHBondContact O-CB 3.48Å; T87-L91 PolarHBondContact O-N 3.25Å; L91-H93 PolarHBondContact O-N 2.96Å; L91-I94 PolarHBondContact O-N 3.33Å; L91-L95 HydrophobicContact CD1-CD1 4.2Å; L91-L95 HydrophobicContact CD1-CG 4.07Å; L91-L95 HydrophobicContact CG-CD1 4.05Å; L91-L95 HydrophobicContact CG-CG 4.35Å; L91-L95 WeakPolarHBondContact O-CB 2.96Å; L91-L95 VanDerWaalsContact O-CG 3.25Å; L91-L95 WeakPolarHBondContact O-CG 3.3Å; L91-L95 PolarHBondContact O-N 3.4Å |
| 92 | A | 95.5 | Very high | 95.1 | Very high | 12 Ų | 12 | 80.9 Ų | 80.9 | 10% | 0.099 | 43% | 0.434 | C | S | . | . | H | α-helix | trans | -60.2 | -36.4 | 176.5 | 0 | 0 | 0 | 0 | 0 | 111.9 | L75 L78 A88 A89 E90 Q96 | L75-A92 HydrophobicContact CD2-CB 3.86Å; L78-A92 HydrophobicContact CB-CB 4.42Å; L78-A92 HydrophobicContact CD1-CB 4.32Å; A88-A92 WeakPolarHBondContact O-CB 3.41Å; A88-A92 PolarHBondContact O-N 2.89Å; A89-A92 PolarHBondContact O-N 3.38Å; E90-A92 PolarHBondContact O-N 2.87Å; A92-Q96 VanDerWaalsContact O-CG 3.26Å; A92-Q96 WeakPolarHBondContact O-CG 3.43Å; A92-Q96 PolarHBondContact O-N 3.18Å |
| 93 | H | 96.1 | Very high | 95.4 | Very high | 123 Ų | 123 | 84.7 Ų | 84.7 | 57% | 0.569 | 45% | 0.449 | S | S | * | . | H | α-helix | trans | -65.3 | -51.3 | 175.7 | -170.2 | 57.4 | 0 | 0 | 0 | 111.9 | A89 E90 L91 L95 Q96 E97 | A89-H93 WeakPolarHBondContact O-CB 3.49Å; A89-H93 PolarHBondContact O-N 3.08Å; E90-H93 WeakPolarHBondContact O-CB 3.4Å; E90-H93 PolarHBondContact O-N 3.31Å; L91-H93 PolarHBondContact O-N 2.96Å; H93-L95 VanDerWaalsContact C-N 3.31Å; H93-L95 PolarHBondContact O-N 3.33Å; H93-Q96 PolarHBondContact O-N 3.05Å; H93-E97 PolarHBondContact O-N 2.99Å |
| 94 | I | 96.9 | Very high | 95.7 | Very high | 68 Ų | 68 | 77.1 Ų | 77.1 | 35% | 0.349 | 41% | 0.414 | S | S | . | . | H | α-helix | trans | -57.6 | -44.9 | 178.4 | -67.5 | 166.3 | 0 | 0 | 0 | 110.9 | E90 L91 Q96 E97 F100 | E90-I94 HydrophobicContact CG-CD1 4.18Å; E90-I94 WeakPolarHBondContact O-CG1 3.48Å; E90-I94 PolarHBondContact O-N 3.4Å; L91-I94 PolarHBondContact O-N 3.33Å; I94-Q96 PolarHBondContact O-N 3.32Å; I94-E97 WeakPolarHBondContact O-CB 3.18Å; I94-E97 PolarHBondContact O-N 2.93Å; I94-E97 VanDerWaalsContact O-N 3.1Å; I94-F100 HydrophobicContact CG2-CD2 4.47Å; I94-F100 WeakPolarHBondContact O-CB 3.11Å |
| 95 | L | 96.3 | Very high | 95.8 | Very high | 15 Ų | 15 | 73.9 Ų | 73.9 | 8% | 0.079 | 40% | 0.399 | C | S | . | . | H | α-helix | trans | -63.2 | -25.4 | 179.5 | -70.5 | 178.9 | 0 | 0 | 0 | 112.6 | V71 I74 L75 L78 L91 H93 F100 Q101 | V71-L95 HydrophobicContact CG1-CB 4.08Å; V71-L95 HydrophobicContact CG1-CD2 4.46Å; V71-L95 HydrophobicContact CG2-CD2 4.29Å; I74-L95 HydrophobicContact CG2-CD1 3.76Å; L75-L95 HydrophobicContact CD2-CB 3.96Å; L75-L95 HydrophobicContact CD2-CD1 4.24Å; L75-L95 HydrophobicContact CG-CB 4.43Å; L78-L95 HydrophobicContact CD1-CD1 4.04Å; L91-L95 HydrophobicContact CD1-CD1 4.2Å; L91-L95 HydrophobicContact CD1-CG 4.07Å; L91-L95 HydrophobicContact CG-CD1 4.05Å; L91-L95 HydrophobicContact CG-CG 4.35Å; L91-L95 WeakPolarHBondContact O-CB 2.96Å; L91-L95 VanDerWaalsContact O-CG 3.25Å; L91-L95 WeakPolarHBondContact O-CG 3.3Å; L91-L95 PolarHBondContact O-N 3.4Å; H93-L95 VanDerWaalsContact C-N 3.31Å; H93-L95 PolarHBondContact O-N 3.33Å; L95-F100 HydrophobicContact CD2-CD1 3.98Å; L95-F100 HydrophobicContact CD2-CE1 3.29Å; L95-F100 HydrophobicContact CD2-CZ 3.77Å; L95-Q101 PolarHBondContact O-NE2 3.41Å |
| 96 | Q | 95.6 | Very high | 95.8 | Very high | 118 Ų | 118 | 75.7 Ų | 75.7 | 55% | 0.551 | 41% | 0.409 | S | S | * | . | H | α-helix | trans | -90.8 | -7.5 | 177.5 | -70 | 172.9 | 30.6 | 0 | 0 | 113.5 | L75 A92 H93 I94 | L75-Q96 HydrophobicContact CD1-CG 3.66Å; L75-Q96 HydrophobicContact CD2-CG 4.03Å; A92-Q96 VanDerWaalsContact O-CG 3.26Å; A92-Q96 WeakPolarHBondContact O-CG 3.43Å; A92-Q96 PolarHBondContact O-N 3.18Å; H93-Q96 PolarHBondContact O-N 3.05Å; I94-Q96 PolarHBondContact O-N 3.32Å |
| 97 | E | 97.8 | Very high | 95.7 | Very high | 78 Ų | 78 | 74.6 Ų | 74.6 | 36% | 0.364 | 39% | 0.392 | S | S | . | . | S | Bend | trans | -62.8 | 140 | -179.7 | -72.8 | -171.8 | 165.5 | 0 | 0 | 111.4 | H93 I94 H99 F100 Q101 | H93-E97 PolarHBondContact O-N 2.99Å; I94-E97 WeakPolarHBondContact O-CB 3.18Å; I94-E97 PolarHBondContact O-N 2.93Å; I94-E97 VanDerWaalsContact O-N 3.1Å; E97-H99 PolarHBondContact O-N 3.4Å; E97-F100 HydrophobicContact CB-CB 4.43Å; E97-F100 PolarHBondContact O-N 3.38Å; E97-Q101 PolarHBondContact O-N 3.44Å |
| 98 | P | 96.3 | Very high | 95.6 | Very high | 90 Ų | 90 | 71.2 Ų | 71.2 | 58% | 0.584 | 37% | 0.371 | S | S | * | . | H | α-helix | trans | -59.9 | -35.6 | -174.8 | 23.2 | -33.8 | 0 | 0 | 0 | 112.3 | F100 Q101 S102 | P98-F100 VanDerWaalsContact C-N 3.35Å; P98-Q101 PolarHBondContact O-N 3.46Å; P98-S102 WeakPolarHBondContact O-CB 3.27Å; P98-S102 PolarHBondContact O-N 3.03Å; P98-S102 PolarHBondContact O-OG 2.92Å; P98-S102 VanDerWaalsContact O-OG 3.1Å |
| 99 | H | 96.7 | Very high | 95.4 | Very high | 150 Ų | 150 | 75 Ų | 75 | 69% | 0.694 | 40% | 0.397 | S | S | * | . | H | α-helix | trans | -67.6 | -36.7 | 178.3 | -57.8 | -48 | 0 | 0 | 0 | 112.2 | E97 L103 | E97-H99 PolarHBondContact O-N 3.4Å; H99-L103 WeakPolarHBondContact O-CB 3.44Å; H99-L103 PolarHBondContact O-N 3.14Å |
| 100 | F | 96.1 | Very high | 95.1 | Very high | 64 Ų | 64 | 78.6 Ų | 78.6 | 28% | 0.281 | 41% | 0.414 | S | S | . | . | H | α-helix | trans | -70.9 | -42.3 | 177.6 | -162.8 | -93.9 | 0 | 0 | 0 | 111 | I94 L95 E97 P98 L103 L104 | I94-F100 HydrophobicContact CG2-CD2 4.47Å; I94-F100 WeakPolarHBondContact O-CB 3.11Å; L95-F100 HydrophobicContact CD2-CD1 3.98Å; L95-F100 HydrophobicContact CD2-CE1 3.29Å; L95-F100 HydrophobicContact CD2-CZ 3.77Å; E97-F100 HydrophobicContact CB-CB 4.43Å; E97-F100 PolarHBondContact O-N 3.38Å; P98-F100 VanDerWaalsContact C-N 3.35Å; F100-L103 WeakPolarHBondContact O-CB 3.41Å; F100-L103 PolarHBondContact O-N 2.94Å; F100-L104 HydrophobicContact CD1-CD1 3.94Å; F100-L104 HydrophobicContact CD1-CG 4.29Å; F100-L104 HydrophobicContact CE1-CD1 3.6Å; F100-L104 HydrophobicContact CE1-CG 4.05Å; F100-L104 PolarHBondContact O-N 2.93Å |
| 101 | Q | 96.1 | Very high | 94.7 | Very high | 42 Ų | 42 | 74.3 Ų | 74.3 | 20% | 0.196 | 40% | 0.399 | C | S | . | . | H | α-helix | trans | -60.9 | -48.2 | 174.5 | -68.8 | -69.2 | -35.8 | 0 | 0 | 111.5 | L68 L95 E97 P98 L103 L104 E105 | L68-Q101 VanDerWaalsContact CD1-OE1 3.25Å; L95-Q101 PolarHBondContact O-NE2 3.41Å; E97-Q101 PolarHBondContact O-N 3.44Å; P98-Q101 PolarHBondContact O-N 3.46Å; Q101-L103 VanDerWaalsContact C-N 3.29Å; Q101-L103 PolarHBondContact O-N 3.42Å; Q101-L104 PolarHBondContact O-N 3.46Å; Q101-L104 VanDerWaalsContact O-N 3.14Å; Q101-E105 WeakPolarHBondContact O-CG 3.29Å; Q101-E105 PolarHBondContact O-N 3.43Å |
| 102 | S | 96.6 | Very high | 93.8 | Very high | 60 Ų | 60 | 77 Ų | 77 | 42% | 0.42 | 43% | 0.425 | S | S | . | . | H | α-helix | trans | -60.3 | -36.3 | 175.7 | -68.2 | 0 | 0 | 0 | 0 | 113.4 | P98 T106 | P98-S102 WeakPolarHBondContact O-CB 3.27Å; P98-S102 PolarHBondContact O-N 3.03Å; P98-S102 PolarHBondContact O-OG 2.92Å; P98-S102 VanDerWaalsContact O-OG 3.1Å; S102-T106 WeakPolarHBondContact O-CB 3.48Å; S102-T106 PolarHBondContact O-N 3.16Å; S102-T106 PolarHBondContact O-OG1 3.42Å |
| 103 | L | 95.9 | Very high | 93.7 | Very high | 112 Ų | 112 | 80.3 Ų | 80.3 | 59% | 0.586 | 44% | 0.441 | S | S | * | . | H | α-helix | trans | -64.1 | -44.6 | 175.2 | 179 | 64.8 | 0 | 0 | 0 | 111.3 | H99 F100 Q101 T106 H107 | H99-L103 WeakPolarHBondContact O-CB 3.44Å; H99-L103 PolarHBondContact O-N 3.14Å; F100-L103 WeakPolarHBondContact O-CB 3.41Å; F100-L103 PolarHBondContact O-N 2.94Å; Q101-L103 VanDerWaalsContact C-N 3.29Å; Q101-L103 PolarHBondContact O-N 3.42Å; L103-T106 PolarHBondContact O-N 2.97Å; L103-H107 WeakPolarHBondContact O-CB 3.38Å; L103-H107 PolarHBondContact O-N 3.25Å |
| 104 | L | 94.7 | Very high | 93.6 | Very high | 21 Ų | 21 | 78.1 Ų | 78.1 | 11% | 0.11 | 44% | 0.435 | C | S | . | . | H | α-helix | trans | -68.6 | -42 | 178.3 | -70.2 | -177.4 | 0 | 0 | 0 | 112.8 | N67 L68 V71 F100 Q101 T106 H107 D108 | N67-L104 HydrophobicContact CB-CD2 3.93Å; L68-L104 HydrophobicContact CD1-CB 4.13Å; V71-L104 HydrophobicContact CB-CD1 4.21Å; V71-L104 HydrophobicContact CG2-CD1 3.45Å; V71-L104 VanDerWaalsContact CG2-CD1 3.45Å; F100-L104 HydrophobicContact CD1-CD1 3.94Å; F100-L104 HydrophobicContact CD1-CG 4.29Å; F100-L104 HydrophobicContact CE1-CD1 3.6Å; F100-L104 HydrophobicContact CE1-CG 4.05Å; F100-L104 PolarHBondContact O-N 2.93Å; Q101-L104 PolarHBondContact O-N 3.46Å; Q101-L104 VanDerWaalsContact O-N 3.14Å; L104-T106 VanDerWaalsContact C-N 3.3Å; L104-T106 PolarHBondContact O-N 2.9Å; L104-H107 WeakPolarHBondContact O-CB 3.34Å; L104-H107 PolarHBondContact O-N 2.88Å; L104-D108 WeakPolarHBondContact O-CB 3.07Å; L104-D108 PolarHBondContact O-N 3.28Å |
| 105 | E | 94.1 | Very high | 93.4 | Very high | 107 Ų | 107 | 78.6 Ų | 78.6 | 50% | 0.5 | 44% | 0.439 | S | S | . | . | H | α-helix | trans | -58.6 | -44.6 | 173.9 | -72.5 | 175.6 | 174.5 | 0 | 0 | 111.2 | L68 Q101 D108 S109 | L68-E105 HydrophobicContact CD1-CG 3.84Å; L68-E105 HydrophobicContact CD2-CG 4.36Å; Q101-E105 WeakPolarHBondContact O-CG 3.29Å; Q101-E105 PolarHBondContact O-N 3.43Å; E105-D108 PolarHBondContact O-N 2.9Å; E105-S109 WeakPolarHBondContact O-CB 3.48Å; E105-S109 PolarHBondContact O-N 3.02Å |
| 106 | T | 94.6 | Very high | 93.3 | Very high | 86 Ų | 86 | 82.4 Ų | 82.4 | 53% | 0.528 | 46% | 0.461 | S | S | . | . | H | α-helix | trans | -65.4 | -41.8 | 177.3 | -55.9 | 0 | 0 | 0 | 0 | 111 | S102 L103 L104 S109 V110 | S102-T106 WeakPolarHBondContact O-CB 3.48Å; S102-T106 PolarHBondContact O-N 3.16Å; S102-T106 PolarHBondContact O-OG1 3.42Å; L103-T106 PolarHBondContact O-N 2.97Å; L104-T106 VanDerWaalsContact C-N 3.3Å; L104-T106 PolarHBondContact O-N 2.9Å; T106-S109 PolarHBondContact O-N 3.46Å; T106-V110 WeakPolarHBondContact O-CG2 3.45Å; T106-V110 PolarHBondContact O-N 3.39Å; T106-V110 VanDerWaalsContact O-N 3.12Å |
| 107 | H | 93.5 | Very high | 93.1 | Very high | 75 Ų | 75 | 80.1 Ų | 80.1 | 35% | 0.347 | 46% | 0.455 | S | S | . | . | H | α-helix | trans | -60.1 | -51.1 | 176 | 176.1 | -74.4 | 0 | 0 | 0 | 111.3 | R64 N67 L103 L104 S109 V110 A111 | R64-H107 PolarHBondContact O-CE1 3.18Å; N67-H107 PolarHBondContact ND2-CE1 3.08Å; N67-H107 VanDerWaalsContact ND2-CE1 3.34Å; N67-H107 PolarHBondContact ND2-ND1 3Å; N67-H107 VanDerWaalsContact ND2-ND1 3.18Å; L103-H107 WeakPolarHBondContact O-CB 3.38Å; L103-H107 PolarHBondContact O-N 3.25Å; L104-H107 WeakPolarHBondContact O-CB 3.34Å; L104-H107 PolarHBondContact O-N 2.88Å; H107-S109 VanDerWaalsContact C-N 3.29Å; H107-S109 PolarHBondContact O-N 3.23Å; H107-V110 PolarHBondContact O-N 3.15Å; H107-V110 VanDerWaalsContact O-N 3.11Å; H107-A111 VanDerWaalsContact O-CB 3.29Å; H107-A111 WeakPolarHBondContact O-CB 3.38Å; H107-A111 PolarHBondContact O-N 2.85Å |
| 108 | D | 92.6 | Very high | 92.8 | Very high | 23 Ų | 23 | 80.3 Ų | 80.3 | 12% | 0.123 | 46% | 0.461 | C | S | . | . | H | α-helix | trans | -62.6 | -36.7 | -178.8 | -73.4 | -12.7 | 0 | 0 | 0 | 111.9 | N66 N67 L68 L104 E105 V110 A111 S112 | N66-D108 WeakPolarHBondContact CA-OD2 3.28Å; N66-D108 PolarHBondContact N-OD1 3.17Å; N67-D108 WeakPolarHBondContact CB-OD1 3.33Å; N67-D108 VanDerWaalsContact N-CG 3.27Å; N67-D108 PolarHBondContact N-OD1 3.35Å; N67-D108 PolarHBondContact N-OD2 3.18Å; N67-D108 PolarHBondContact ND2-OD1 3.41Å; L68-D108 PolarHBondContact N-OD2 3.16Å; L104-D108 WeakPolarHBondContact O-CB 3.07Å; L104-D108 PolarHBondContact O-N 3.28Å; E105-D108 PolarHBondContact O-N 2.9Å; D108-V110 VanDerWaalsContact C-N 3.33Å; D108-V110 PolarHBondContact O-N 2.7Å; D108-A111 PolarHBondContact O-N 2.88Å; D108-S112 PolarHBondContact O-N 2.64Å; D108-S112 VanDerWaalsContact O-N 3.11Å; D108-S112 PolarHBondContact O-OG 3Å |
| 109 | S | 91.5 | Very high | 92.6 | Very high | 88 Ų | 88 | 79.6 Ų | 79.6 | 62% | 0.615 | 45% | 0.452 | S | S | * | . | H | α-helix | trans | -64.9 | -32.6 | 174.2 | -176.8 | 0 | 0 | 0 | 0 | 113.7 | E105 T106 H107 S112 | E105-S109 WeakPolarHBondContact O-CB 3.48Å; E105-S109 PolarHBondContact O-N 3.02Å; T106-S109 PolarHBondContact O-N 3.46Å; H107-S109 VanDerWaalsContact C-N 3.29Å; H107-S109 PolarHBondContact O-N 3.23Å; S109-S112 PolarHBondContact O-OG 2.81Å |
| 110 | V | 88.2 | Confident | 92.2 | Very high | 118 Ų | 118 | 74.2 Ų | 74.2 | 72% | 0.715 | 43% | 0.434 | S | S | * | . | H | α-helix | trans | -84.4 | -26.3 | 176.9 | 174.8 | 0 | 0 | 0 | 0 | 111.7 | T106 H107 D108 | T106-V110 WeakPolarHBondContact O-CG2 3.45Å; T106-V110 PolarHBondContact O-N 3.39Å; T106-V110 VanDerWaalsContact O-N 3.12Å; H107-V110 PolarHBondContact O-N 3.15Å; H107-V110 VanDerWaalsContact O-N 3.11Å; D108-V110 VanDerWaalsContact C-N 3.33Å; D108-V110 PolarHBondContact O-N 2.7Å |
| 111 | A | 86.8 | Confident | 91.9 | Very high | 32 Ų | 32 | 75 Ų | 75 | 26% | 0.264 | 45% | 0.446 | S | S | . | . | H | α-helix | trans | -82.4 | -25 | -178.1 | 0 | 0 | 0 | 0 | 0 | 114.1 | A62 D65 H107 D108 | A62-A111 HydrophobicContact CB-CB 3.47Å; A62-A111 VanDerWaalsContact CB-CB 3.47Å; D65-A111 HydrophobicContact CB-CB 4.2Å; H107-A111 VanDerWaalsContact O-CB 3.29Å; H107-A111 WeakPolarHBondContact O-CB 3.38Å; H107-A111 PolarHBondContact O-N 2.85Å; D108-A111 PolarHBondContact O-N 2.88Å |
| 112 | S | 78.6 | Confident | 91.6 | Very high | 136 Ų | 136 | 78 Ų | 78 | 95% | 0.951 | 47% | 0.469 | S | S | * | . | trans | -78.5 | 0 | 179.1 | 68 | 0 | 0 | 0 | 0 | 113.5 | D108 S109 | D108-S112 PolarHBondContact O-N 2.64Å; D108-S112 VanDerWaalsContact O-N 3.11Å; D108-S112 PolarHBondContact O-OG 3Å; S109-S112 PolarHBondContact O-OG 2.81Å |
Retrieved 112 of 112 residues in 219.7 ms
(Link to these results)