| 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 | I | 43.3 | Very low | 66.8 | Low | 209 Ų | 209 | 118.1 Ų | 118.1 | 100% | 1.072 | 59% | 0.586 | S | S | * | * | 0 | 98.7 | 0 | -53.2 | 173.2 | 0 | 0 | 0 | 105.2 | |||||
| 2 | K | 41 | Very low | 68.8 | Low | 166 Ų | 166 | 109.1 Ų | 109.1 | 72% | 0.722 | 54% | 0.541 | S | S | * | . | trans | -91.6 | 160.2 | -167.5 | -70.6 | -178.9 | 177.6 | 178 | 0 | 110.2 | E4 | K2-E4 PolarHBondContact O-N 2.98Š| ||
| 3 | M | 40.7 | Very low | 70.5 | Confident | 172 Ų | 172 | 105.7 Ų | 105.7 | 85% | 0.847 | 53% | 0.526 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -69.3 | 10.7 | -165.5 | -49.6 | 179.9 | -150.9 | 0 | 0 | 115.7 | T6 | M3-T6 VanDerWaalsContact C-OG1 3.29Å; M3-T6 PolarHBondContact O-OG1 3.11Å |
| 4 | E | 52.5 | Low | 72 | Confident | 147 Ų | 147 | 102.3 Ų | 102.3 | 69% | 0.687 | 52% | 0.523 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -80.1 | -42 | -176.4 | -70.5 | 156.8 | -152.7 | 0 | 0 | 111.3 | K2 T6 K7 Y8 | K2-E4 PolarHBondContact O-N 2.98Å; E4-T6 PolarHBondContact O-N 3.49Å; E4-T6 VanDerWaalsContact O-N 3.15Å; E4-K7 PolarHBondContact O-N 3.37Å; E4-Y8 PolarHBondContact O-N 3.09Å |
| 5 | D | 55.8 | Low | 73.4 | Confident | 101 Ų | 101 | 102.6 Ų | 102.6 | 54% | 0.54 | 52% | 0.521 | S | S | . | . | H | α-helix | trans | -57.6 | -32.6 | 178.2 | -69.2 | -41.7 | 0 | 0 | 0 | 112.4 | K7 | D5-K7 VanDerWaalsContact C-N 3.3Å; D5-K7 PolarHBondContact O-N 2.92Å |
| 6 | T | 63.1 | Low | 74.4 | Confident | 112 Ų | 112 | 100 Ų | 100 | 69% | 0.687 | 51% | 0.505 | S | S | * | . | H | α-helix | trans | -69.4 | -20.4 | 178 | 26.6 | 0 | 0 | 0 | 0 | 114.7 | M3 E4 | M3-T6 VanDerWaalsContact C-OG1 3.29Å; M3-T6 PolarHBondContact O-OG1 3.11Å; E4-T6 PolarHBondContact O-N 3.49Å; E4-T6 VanDerWaalsContact O-N 3.15Å |
| 7 | K | 81.1 | Confident | 75.5 | Confident | 131 Ų | 131 | 101.2 Ų | 101.2 | 57% | 0.57 | 51% | 0.513 | S | S | * | . | H | α-helix | trans | -102.7 | -24.5 | 179.4 | -163.6 | 170 | 179.4 | -88.8 | 0 | 112.7 | E4 D5 P10 E11 | E4-K7 PolarHBondContact O-N 3.37Å; D5-K7 VanDerWaalsContact C-N 3.3Å; D5-K7 PolarHBondContact O-N 2.92Å; K7-P10 VanDerWaalsContact O-CD 3.23Å; K7-P10 WeakPolarHBondContact O-CD 3.35Å; K7-P10 VanDerWaalsContact O-CG 3.27Å; K7-P10 WeakPolarHBondContact O-CG 3.17Å; K7-E11 HydrophobicContact CG-CG 4.38Å; K7-E11 IonicContact NZ-OE1 3.64Å; K7-E11 PolarHBondContact NZ-OE1 3Å; K7-E11 VanDerWaalsContact O-CG 3.31Å; K7-E11 WeakPolarHBondContact O-CG 3.31Å; K7-E11 PolarHBondContact O-N 2.96Å |
| 8 | Y | 87.3 | Confident | 76.4 | Confident | 68 Ų | 68 | 101.1 Ų | 101.1 | 27% | 0.267 | 52% | 0.523 | S | S | . | . | H | α-helix | trans | -64.8 | -42.1 | -175.5 | -172.5 | -133 | 0 | 0 | 0 | 114.6 | E4 E11 L12 E33 I37 K43 | E4-Y8 PolarHBondContact O-N 3.09Å; Y8-E11 PolarHBondContact O-N 3.14Å; Y8-L12 HydrophobicContact CD1-CD1 4.1Å; Y8-L12 HydrophobicContact CD2-CD1 4.34Å; Y8-L12 HydrophobicContact CD2-CG 4.38Å; Y8-L12 HydrophobicContact CE1-CD1 3.78Å; Y8-L12 HydrophobicContact CE2-CD1 4.02Å; Y8-L12 HydrophobicContact CE2-CD2 4.28Å; Y8-L12 HydrophobicContact CE2-CG 4.07Å; Y8-L12 HydrophobicContact CG-CD1 4.37Å; Y8-L12 WeakPolarHBondContact O-CG 3.47Å; Y8-L12 PolarHBondContact O-N 3.39Å; Y8-E33 HydrophobicContact CE1-CG 4.44Å; Y8-E33 PolarHBondContact OH-OE1 3.46Å; Y8-I37 HydrophobicContact CD1-CD1 3.61Å; Y8-I37 HydrophobicContact CE1-CD1 3.64Å; Y8-K43 PolarHBondContact OH-NZ 2.88Å |
| 9 | L | 88.1 | Confident | 77.2 | Confident | 48 Ų | 48 | 98.3 Ų | 98.3 | 25% | 0.251 | 51% | 0.509 | S | S | . | . | H | α-helix | trans | -65.1 | -47.4 | 178.8 | -177.5 | 148.1 | 0 | 0 | 0 | 113.7 | E11 L12 L13 I37 Q38 | L9-E11 VanDerWaalsContact C-N 3.3Å; L9-E11 PolarHBondContact O-N 3.07Å; L9-L12 PolarHBondContact O-N 3.35Å; L9-L13 HydrophobicContact CD2-CD1 3.69Å; L9-L13 HydrophobicContact CD2-CG 4.44Å; L9-L13 WeakPolarHBondContact O-CG 3.41Å; L9-L13 PolarHBondContact O-N 3.26Å; L9-L13 VanDerWaalsContact O-N 3.1Å; L9-I37 HydrophobicContact CB-CG2 4.37Å; L9-I37 HydrophobicContact CD1-CB 4.32Å; L9-I37 HydrophobicContact CD1-CG2 3.75Å; L9-Q38 HydrophobicContact CD1-CG 4.02Å |
| 10 | P | 90.5 | Very high | 78 | Confident | 68 Ų | 68 | 97.7 Ų | 97.7 | 44% | 0.442 | 51% | 0.506 | S | S | . | . | H | α-helix | trans | -66.9 | -28.8 | 175.8 | 21.9 | -30.6 | 0 | 0 | 0 | 113.3 | K7 L13 A14 | K7-P10 VanDerWaalsContact O-CD 3.23Å; K7-P10 WeakPolarHBondContact O-CD 3.35Å; K7-P10 VanDerWaalsContact O-CG 3.27Å; K7-P10 WeakPolarHBondContact O-CG 3.17Å; P10-L13 PolarHBondContact O-N 2.99Å; P10-A14 PolarHBondContact O-N 3.28Å |
| 11 | E | 91.1 | Very high | 78.5 | Confident | 77 Ų | 77 | 97.5 Ų | 97.5 | 36% | 0.36 | 51% | 0.513 | S | S | . | . | H | α-helix | trans | -63.7 | -48.7 | 171.2 | -74.6 | 171.6 | 161.5 | 0 | 0 | 111.7 | K7 Y8 L9 L13 A14 E15 | K7-E11 HydrophobicContact CG-CG 4.38Å; K7-E11 IonicContact NZ-OE1 3.64Å; K7-E11 PolarHBondContact NZ-OE1 3Å; K7-E11 VanDerWaalsContact O-CG 3.31Å; K7-E11 WeakPolarHBondContact O-CG 3.31Å; K7-E11 PolarHBondContact O-N 2.96Å; Y8-E11 PolarHBondContact O-N 3.14Å; L9-E11 VanDerWaalsContact C-N 3.3Å; L9-E11 PolarHBondContact O-N 3.07Å; E11-L13 VanDerWaalsContact C-N 3.29Å; E11-L13 PolarHBondContact O-N 3.07Å; E11-A14 PolarHBondContact O-N 2.55Å; E11-A14 VanDerWaalsContact O-N 3.12Å; E11-E15 PolarHBondContact O-N 3.42Å |
| 12 | L | 91.2 | Very high | 80.8 | Confident | 10 Ų | 10 | 91.1 Ų | 91.1 | 5% | 0.052 | 49% | 0.487 | C | S | . | . | H | α-helix | trans | -61 | -35.7 | 176.5 | -72.5 | 167.8 | 0 | 0 | 0 | 113 | Y8 L9 K16 I30 E33 I34 I37 | Y8-L12 HydrophobicContact CD1-CD1 4.1Å; Y8-L12 HydrophobicContact CD2-CD1 4.34Å; Y8-L12 HydrophobicContact CD2-CG 4.38Å; Y8-L12 HydrophobicContact CE1-CD1 3.78Å; Y8-L12 HydrophobicContact CE2-CD1 4.02Å; Y8-L12 HydrophobicContact CE2-CD2 4.28Å; Y8-L12 HydrophobicContact CE2-CG 4.07Å; Y8-L12 HydrophobicContact CG-CD1 4.37Å; Y8-L12 WeakPolarHBondContact O-CG 3.47Å; Y8-L12 PolarHBondContact O-N 3.39Å; L9-L12 PolarHBondContact O-N 3.35Å; L12-K16 VanDerWaalsContact O-CB 3.31Å; L12-K16 WeakPolarHBondContact O-CB 3.15Å; L12-K16 PolarHBondContact O-N 3.4Å; L12-I30 HydrophobicContact CB-CG2 4.46Å; L12-I30 HydrophobicContact CD2-CG2 4.33Å; L12-I30 WeakPolarHBondContact O-CG2 3.3Å; L12-E33 HydrophobicContact CD1-CB 4.41Å; L12-E33 HydrophobicContact CD1-CG 3.6Å; L12-E33 HydrophobicContact CD2-CG 4.2Å; L12-I34 HydrophobicContact CB-CD1 4.25Å; L12-I34 HydrophobicContact CB-CG1 3.76Å; L12-I34 HydrophobicContact CD1-CG1 4.46Å; L12-I37 HydrophobicContact CD1-CD1 3.34Å |
| 13 | L | 90.1 | Very high | 83.2 | Confident | 65 Ų | 65 | 88.9 Ų | 88.9 | 34% | 0.34 | 48% | 0.478 | S | S | . | . | H | α-helix | trans | -65 | -44.5 | 173.7 | -72.7 | 170.4 | 0 | 0 | 0 | 111.4 | L9 P10 E11 K16 D17 I34 | L9-L13 HydrophobicContact CD2-CD1 3.69Å; L9-L13 HydrophobicContact CD2-CG 4.44Å; L9-L13 WeakPolarHBondContact O-CG 3.41Å; L9-L13 PolarHBondContact O-N 3.26Å; L9-L13 VanDerWaalsContact O-N 3.1Å; P10-L13 PolarHBondContact O-N 2.99Å; E11-L13 VanDerWaalsContact C-N 3.29Å; E11-L13 PolarHBondContact O-N 3.07Å; L13-K16 WeakPolarHBondContact O-CB 3.33Å; L13-K16 PolarHBondContact O-N 2.62Å; L13-D17 PolarHBondContact O-N 2.87Å; L13-I34 HydrophobicContact CD2-CD1 4.01Å; L13-I34 HydrophobicContact CD2-CG2 4.27Å |
| 14 | A | 92.8 | Very high | 85.7 | Confident | 58 Ų | 58 | 84.3 Ų | 84.3 | 48% | 0.479 | 46% | 0.46 | S | S | . | . | H | α-helix | trans | -64.5 | -39.3 | 176.6 | 0 | 0 | 0 | 0 | 0 | 112.4 | P10 E11 D17 S18 | P10-A14 PolarHBondContact O-N 3.28Å; E11-A14 PolarHBondContact O-N 2.55Å; E11-A14 VanDerWaalsContact O-N 3.12Å; A14-D17 PolarHBondContact O-N 2.77Å; A14-S18 WeakPolarHBondContact O-CB 3.35Å; A14-S18 PolarHBondContact O-N 3.21Å; A14-S18 PolarHBondContact O-OG 3.38Å |
| 15 | E | 91.8 | Very high | 87.7 | Confident | 107 Ų | 107 | 84 Ų | 84 | 50% | 0.5 | 46% | 0.458 | S | S | . | . | H | α-helix | trans | -63.7 | -44.9 | 171.7 | -73.9 | -175.6 | -168.6 | 0 | 0 | 111.3 | E11 D17 S18 L19 I30 | E11-E15 PolarHBondContact O-N 3.42Å; E15-D17 PolarHBondContact O-N 2.68Å; E15-S18 PolarHBondContact O-N 2.87Å; E15-S18 PolarHBondContact O-OG 3.02Å; E15-L19 WeakPolarHBondContact O-CB 3.37Å; E15-L19 PolarHBondContact O-N 3.1Å; E15-I30 HydrophobicContact CB-CD1 4.18Å |
| 16 | K | 90.8 | Very high | 89.4 | Confident | 61 Ų | 61 | 81 Ų | 81 | 27% | 0.265 | 45% | 0.447 | S | S | . | . | H | α-helix | trans | -59.8 | -32.6 | 177.8 | -158.5 | -161.3 | 113.2 | -51.5 | 0 | 113 | L12 L13 M27 I30 I34 | L12-K16 VanDerWaalsContact O-CB 3.31Å; L12-K16 WeakPolarHBondContact O-CB 3.15Å; L12-K16 PolarHBondContact O-N 3.4Å; L13-K16 WeakPolarHBondContact O-CB 3.33Å; L13-K16 PolarHBondContact O-N 2.62Å; K16-M27 HydrophobicContact CG-SD 3.7Å; K16-M27 WeakPolarHBondContact O-CE 3.41Å; K16-I30 HydrophobicContact CB-CG2 3.71Å; K16-I30 HydrophobicContact CG-CG2 4.02Å; K16-I34 HydrophobicContact CB-CD1 4.04Å; K16-I34 HydrophobicContact CD-CD1 3.69Å; K16-I34 HydrophobicContact CG-CD1 4.19Å |
| 17 | D | 91.9 | Very high | 90.8 | Very high | 121 Ų | 121 | 77.8 Ų | 77.8 | 65% | 0.647 | 43% | 0.425 | S | S | * | . | H | α-helix | trans | -92 | -16.2 | -176.9 | -66.8 | -9.9 | 0 | 0 | 0 | 112.8 | L13 A14 E15 | L13-D17 PolarHBondContact O-N 2.87Å; A14-D17 PolarHBondContact O-N 2.77Å; E15-D17 PolarHBondContact O-N 2.68Å |
| 18 | S | 92.9 | Very high | 91.4 | Very high | 98 Ų | 98 | 78.2 Ų | 78.2 | 69% | 0.685 | 43% | 0.427 | S | S | * | . | H | α-helix | trans | -102.2 | -18.1 | 175.6 | 57 | 0 | 0 | 0 | 0 | 114.4 | A14 E15 | A14-S18 WeakPolarHBondContact O-CB 3.35Å; A14-S18 PolarHBondContact O-N 3.21Å; A14-S18 PolarHBondContact O-OG 3.38Å; E15-S18 PolarHBondContact O-N 2.87Å; E15-S18 PolarHBondContact O-OG 3.02Å |
| 19 | L | 91.6 | Very high | 91.7 | Very high | 48 Ų | 48 | 81 Ų | 81 | 25% | 0.251 | 45% | 0.446 | S | S | . | . | S | Bend | trans | -70.4 | 130 | 177.5 | -178.2 | 69.8 | 0 | 0 | 0 | 111.3 | E15 F23 A26 M27 I30 | E15-L19 WeakPolarHBondContact O-CB 3.37Å; E15-L19 PolarHBondContact O-N 3.1Å; L19-F23 HydrophobicContact CD1-CB 3.99Å; L19-F23 HydrophobicContact CD1-CD2 3.78Å; L19-F23 HydrophobicContact CD1-CG 4.07Å; L19-F23 HydrophobicContact CD2-CB 4.13Å; L19-F23 HydrophobicContact CG-CB 4.12Å; L19-F23 HydrophobicContact CG-CD2 4.44Å; L19-A26 HydrophobicContact CD2-CB 3.72Å; L19-M27 HydrophobicContact CB-CE 4.02Å; L19-M27 HydrophobicContact CD2-CB 4.24Å; L19-M27 HydrophobicContact CD2-CE 4.13Å; L19-M27 HydrophobicContact CG-CE 4.24Å; L19-M27 WeakPolarHBondContact O-CE 2.96Å; L19-I30 HydrophobicContact CD2-CD1 3.85Å |
| 20 | D | 91.9 | Very high | 91.9 | Very high | 86 Ų | 86 | 79.8 Ų | 79.8 | 46% | 0.46 | 44% | 0.439 | S | S | . | . | trans | -64.2 | 140.1 | 176.5 | 176.5 | 37.4 | 0 | 0 | 0 | 112.6 | S22 F23 | D20-S22 PolarHBondContact O-N 3.04Å; D20-S22 VanDerWaalsContact O-N 3.1Å; D20-S22 WeakPolarHBondContact OD2-CB 3.37Å; D20-S22 PolarHBondContact OD2-N 3.05Å; D20-S22 PolarHBondContact OD2-OG 2.91Å; D20-F23 HydrophobicContact CB-CD2 4.18Å; D20-F23 HydrophobicContact CB-CE2 4.43Å; D20-F23 PolarHBondContact O-N 2.84Å | ||
| 21 | S | 88.8 | Confident | 91.9 | Very high | 94 Ų | 94 | 78.9 Ų | 78.9 | 66% | 0.657 | 43% | 0.432 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -53.8 | -23.8 | 177.2 | 63 | 0 | 0 | 0 | 0 | 115.1 | F23 | S21-F23 VanDerWaalsContact C-N 3.25Å; S21-F23 PolarHBondContact O-N 3.03Å |
| 22 | S | 92.5 | Very high | 91.9 | Very high | 75 Ų | 75 | 77.8 Ų | 77.8 | 52% | 0.524 | 44% | 0.437 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -63.1 | -29.5 | 174.1 | 66.7 | 0 | 0 | 0 | 0 | 113 | D20 T24 | D20-S22 PolarHBondContact O-N 3.04Å; D20-S22 VanDerWaalsContact O-N 3.1Å; D20-S22 WeakPolarHBondContact OD2-CB 3.37Å; D20-S22 PolarHBondContact OD2-N 3.05Å; D20-S22 PolarHBondContact OD2-OG 2.91Å; S22-T24 PolarHBondContact O-N 3.26Å |
| 23 | F | 91.6 | Very high | 91.8 | Very high | 120 Ų | 120 | 79.1 Ų | 79.1 | 53% | 0.526 | 44% | 0.442 | S | S | . | . | trans | -80.5 | 56.9 | 179.2 | -64.5 | -75.6 | 0 | 0 | 0 | 112.4 | L19 D20 S21 H25 A26 M27 | L19-F23 HydrophobicContact CD1-CB 3.99Å; L19-F23 HydrophobicContact CD1-CD2 3.78Å; L19-F23 HydrophobicContact CD1-CG 4.07Å; L19-F23 HydrophobicContact CD2-CB 4.13Å; L19-F23 HydrophobicContact CG-CB 4.12Å; L19-F23 HydrophobicContact CG-CD2 4.44Å; D20-F23 HydrophobicContact CB-CD2 4.18Å; D20-F23 HydrophobicContact CB-CE2 4.43Å; D20-F23 PolarHBondContact O-N 2.84Å; S21-F23 VanDerWaalsContact C-N 3.25Å; S21-F23 PolarHBondContact O-N 3.03Å; F23-H25 PolarHBondContact O-N 2.85Å; F23-A26 HydrophobicContact CB-CB 4.17Å; F23-A26 PolarHBondContact O-N 2.89Å; F23-M27 WeakPolarHBondContact O-CB 3.49Å; F23-M27 PolarHBondContact O-N 3.25Å | ||
| 24 | T | 92.7 | Very high | 91.7 | Very high | 76 Ų | 76 | 76.5 Ų | 76.5 | 47% | 0.466 | 43% | 0.429 | S | S | . | . | H | α-helix | trans | -53.5 | -30.7 | -175.2 | 63.5 | 0 | 0 | 0 | 0 | 114.4 | S22 K28 | S22-T24 PolarHBondContact O-N 3.26Å; T24-K28 WeakPolarHBondContact O-CD 3.26Å; T24-K28 WeakPolarHBondContact O-CG 3.27Å; T24-K28 PolarHBondContact O-N 2.97Å |
| 25 | H | 93.4 | Very high | 91.6 | Very high | 141 Ų | 141 | 78 Ų | 78 | 65% | 0.653 | 43% | 0.426 | S | S | * | . | H | α-helix | trans | -77.1 | -46.6 | 175.7 | -67.8 | -63 | 0 | 0 | 0 | 112.7 | F23 K28 L29 | F23-H25 PolarHBondContact O-N 2.85Å; H25-K28 PolarHBondContact O-N 3.43Å; H25-L29 WeakPolarHBondContact O-CG 3.49Å; H25-L29 PolarHBondContact O-N 3.11Å |
| 26 | A | 92.1 | Very high | 91.3 | Very high | 37 Ų | 37 | 75 Ų | 75 | 31% | 0.306 | 41% | 0.41 | S | S | . | . | H | α-helix | trans | -66.1 | -40.3 | 178.3 | 0 | 0 | 0 | 0 | 0 | 111.3 | L19 F23 K28 L29 I30 | L19-A26 HydrophobicContact CD2-CB 3.72Å; F23-A26 HydrophobicContact CB-CB 4.17Å; F23-A26 PolarHBondContact O-N 2.89Å; A26-K28 VanDerWaalsContact C-N 3.31Å; A26-K28 PolarHBondContact O-N 3.03Å; A26-L29 PolarHBondContact O-N 3.26Å; A26-L29 VanDerWaalsContact O-N 3.11Å; A26-I30 WeakPolarHBondContact O-CG1 3.3Å; A26-I30 PolarHBondContact O-N 3.04Å |
| 27 | M | 92.2 | Very high | 91 | Very high | 45 Ų | 45 | 74.1 Ų | 74.1 | 22% | 0.222 | 41% | 0.408 | C | S | . | . | H | α-helix | trans | -57.3 | -41.9 | 173.3 | -172 | 61.5 | 70.2 | 0 | 0 | 112.3 | K16 L19 F23 T31 | K16-M27 HydrophobicContact CG-SD 3.7Å; K16-M27 WeakPolarHBondContact O-CE 3.41Å; L19-M27 HydrophobicContact CB-CE 4.02Å; L19-M27 HydrophobicContact CD2-CB 4.24Å; L19-M27 HydrophobicContact CD2-CE 4.13Å; L19-M27 HydrophobicContact CG-CE 4.24Å; L19-M27 WeakPolarHBondContact O-CE 2.96Å; F23-M27 WeakPolarHBondContact O-CB 3.49Å; F23-M27 PolarHBondContact O-N 3.25Å; M27-T31 VanDerWaalsContact O-CB 3.3Å; M27-T31 WeakPolarHBondContact O-CB 3.31Å; M27-T31 PolarHBondContact O-N 3.37Å; M27-T31 PolarHBondContact O-OG1 3.06Å |
| 28 | K | 93.6 | Very high | 90.6 | Very high | 140 Ų | 140 | 74.4 Ų | 74.4 | 61% | 0.609 | 41% | 0.405 | S | S | * | . | H | α-helix | trans | -65.8 | -42.1 | 174 | -77.2 | 170.9 | -177.1 | 174.3 | 0 | 112.4 | T24 H25 A26 A32 | T24-K28 WeakPolarHBondContact O-CD 3.26Å; T24-K28 WeakPolarHBondContact O-CG 3.27Å; T24-K28 PolarHBondContact O-N 2.97Å; H25-K28 PolarHBondContact O-N 3.43Å; A26-K28 VanDerWaalsContact C-N 3.31Å; A26-K28 PolarHBondContact O-N 3.03Å; K28-A32 VanDerWaalsContact O-CB 3.3Å; K28-A32 WeakPolarHBondContact O-CB 3.23Å; K28-A32 PolarHBondContact O-N 2.87Å |
| 29 | L | 93.8 | Very high | 90.1 | Very high | 127 Ų | 127 | 76.4 Ų | 76.4 | 67% | 0.665 | 40% | 0.402 | S | S | * | . | H | α-helix | trans | -66.4 | -46.2 | 179.6 | -71 | 170.6 | 0 | 0 | 0 | 111.9 | H25 A26 A32 E33 | H25-L29 WeakPolarHBondContact O-CG 3.49Å; H25-L29 PolarHBondContact O-N 3.11Å; A26-L29 PolarHBondContact O-N 3.26Å; A26-L29 VanDerWaalsContact O-N 3.11Å; L29-A32 PolarHBondContact O-N 3.33Å; L29-E33 WeakPolarHBondContact O-CB 3.37Å; L29-E33 PolarHBondContact O-N 2.85Å |
| 30 | I | 92.3 | Very high | 89.1 | Confident | 21 Ų | 21 | 76.9 Ų | 76.9 | 11% | 0.108 | 42% | 0.418 | C | S | . | . | H | α-helix | trans | -62.4 | -44.7 | 176.2 | -65.3 | 169.5 | 0 | 0 | 0 | 110.3 | L12 E15 K16 L19 A26 A32 E33 I34 | L12-I30 HydrophobicContact CB-CG2 4.46Å; L12-I30 HydrophobicContact CD2-CG2 4.33Å; L12-I30 WeakPolarHBondContact O-CG2 3.3Å; E15-I30 HydrophobicContact CB-CD1 4.18Å; K16-I30 HydrophobicContact CB-CG2 3.71Å; K16-I30 HydrophobicContact CG-CG2 4.02Å; L19-I30 HydrophobicContact CD2-CD1 3.85Å; A26-I30 WeakPolarHBondContact O-CG1 3.3Å; A26-I30 PolarHBondContact O-N 3.04Å; I30-A32 PolarHBondContact O-N 3.48Å; I30-E33 PolarHBondContact O-N 2.87Å; I30-I34 HydrophobicContact CG2-CD1 3.77Å; I30-I34 HydrophobicContact CG2-CG1 4.42Å; I30-I34 WeakPolarHBondContact O-CD1 3.22Å; I30-I34 VanDerWaalsContact O-CG1 3.27Å; I30-I34 WeakPolarHBondContact O-CG1 3.37Å; I30-I34 PolarHBondContact O-N 3.17Å |
| 31 | T | 91.1 | Very high | 87.6 | Confident | 49 Ų | 49 | 79 Ų | 79 | 30% | 0.301 | 43% | 0.425 | S | S | . | . | H | α-helix | trans | -61.6 | -43.5 | 176.9 | -56.4 | 0 | 0 | 0 | 0 | 111.8 | M27 E33 I34 E35 | M27-T31 VanDerWaalsContact O-CB 3.3Å; M27-T31 WeakPolarHBondContact O-CB 3.31Å; M27-T31 PolarHBondContact O-N 3.37Å; M27-T31 PolarHBondContact O-OG1 3.06Å; T31-E33 PolarHBondContact O-N 2.68Å; T31-I34 PolarHBondContact O-N 3.41Å; T31-E35 PolarHBondContact O-N 3.12Å |
| 32 | A | 90.6 | Very high | 86.1 | Confident | 55 Ų | 55 | 79.5 Ų | 79.5 | 46% | 0.455 | 42% | 0.424 | S | S | . | . | H | α-helix | trans | -65.1 | -36.7 | 175.8 | 0 | 0 | 0 | 0 | 0 | 112.8 | K28 L29 I30 E35 R36 | K28-A32 VanDerWaalsContact O-CB 3.3Å; K28-A32 WeakPolarHBondContact O-CB 3.23Å; K28-A32 PolarHBondContact O-N 2.87Å; L29-A32 PolarHBondContact O-N 3.33Å; I30-A32 PolarHBondContact O-N 3.48Å; A32-E35 PolarHBondContact O-N 3.1Å; A32-R36 WeakPolarHBondContact O-CB 3.34Å; A32-R36 PolarHBondContact O-N 3.19Å |
| 33 | E | 88.5 | Confident | 84.3 | Confident | 37 Ų | 37 | 81.1 Ų | 81.1 | 17% | 0.173 | 42% | 0.422 | C | S | . | . | H | α-helix | trans | -68.1 | -41.9 | 176.5 | -175.7 | 70.9 | 170.8 | 0 | 0 | 111.6 | Y8 L12 L29 I30 T31 R36 I37 K43 | Y8-E33 HydrophobicContact CE1-CG 4.44Å; Y8-E33 PolarHBondContact OH-OE1 3.46Å; L12-E33 HydrophobicContact CD1-CB 4.41Å; L12-E33 HydrophobicContact CD1-CG 3.6Å; L12-E33 HydrophobicContact CD2-CG 4.2Å; L29-E33 WeakPolarHBondContact O-CB 3.37Å; L29-E33 PolarHBondContact O-N 2.85Å; I30-E33 PolarHBondContact O-N 2.87Å; T31-E33 PolarHBondContact O-N 2.68Å; E33-R36 WeakPolarHBondContact O-CB 3.29Å; E33-R36 PolarHBondContact O-N 3.44Å; E33-R36 IonicContact OE1-CZ 3.1Å; E33-R36 IonicContact OE1-NE 2.6Å; E33-R36 IonicContact OE1-NH2 2.71Å; E33-R36 PolarHBondContact OE1-NH2 3.24Å; E33-R36 IonicContact OE2-CZ 3.62Å; E33-R36 VanDerWaalsContact OE2-CZ 3.31Å; E33-R36 IonicContact OE2-NE 3.19Å; E33-R36 PolarHBondContact OE2-NE 3.23Å; E33-R36 IonicContact OE2-NH2 2.68Å; E33-R36 PolarHBondContact OE2-NH2 3.22Å; E33-R36 VanDerWaalsContact OE2-NH2 3.11Å; E33-I37 HydrophobicContact CG-CD1 4.3Å; E33-I37 WeakPolarHBondContact O-CD1 3.47Å; E33-I37 VanDerWaalsContact O-CG1 3.29Å; E33-I37 WeakPolarHBondContact O-CG1 3.45Å; E33-I37 PolarHBondContact O-N 2.88Å; E33-K43 WeakPolarHBondContact OE1-CE 3.43Å; E33-K43 IonicContact OE1-NZ 2.62Å; E33-K43 PolarHBondContact OE1-NZ 3.45Å |
| 34 | I | 89.3 | Confident | 82.1 | Confident | 10 Ų | 10 | 85.2 Ų | 85.2 | 5% | 0.051 | 44% | 0.439 | C | S | . | . | H | α-helix | trans | -59.5 | -48.9 | 171.9 | -68 | 160.3 | 0 | 0 | 0 | 110.3 | L12 L13 K16 I30 T31 R36 I37 Q38 | L12-I34 HydrophobicContact CB-CD1 4.25Å; L12-I34 HydrophobicContact CB-CG1 3.76Å; L12-I34 HydrophobicContact CD1-CG1 4.46Å; L13-I34 HydrophobicContact CD2-CD1 4.01Å; L13-I34 HydrophobicContact CD2-CG2 4.27Å; K16-I34 HydrophobicContact CB-CD1 4.04Å; K16-I34 HydrophobicContact CD-CD1 3.69Å; K16-I34 HydrophobicContact CG-CD1 4.19Å; I30-I34 HydrophobicContact CG2-CD1 3.77Å; I30-I34 HydrophobicContact CG2-CG1 4.42Å; I30-I34 WeakPolarHBondContact O-CD1 3.22Å; I30-I34 VanDerWaalsContact O-CG1 3.27Å; I30-I34 WeakPolarHBondContact O-CG1 3.37Å; I30-I34 PolarHBondContact O-N 3.17Å; T31-I34 PolarHBondContact O-N 3.41Å; I34-R36 VanDerWaalsContact C-N 3.32Å; I34-R36 PolarHBondContact O-N 3.39Å; I34-I37 PolarHBondContact O-N 2.94Å; I34-Q38 HydrophobicContact CG2-CG 4.32Å; I34-Q38 VanDerWaalsContact CG2-NE2 3.34Å; I34-Q38 WeakPolarHBondContact O-CB 3.48Å; I34-Q38 VanDerWaalsContact O-CG 3.32Å; I34-Q38 WeakPolarHBondContact O-CG 3.31Å; I34-Q38 PolarHBondContact O-N 3.36Å |
| 35 | E | 89.7 | Confident | 79.7 | Confident | 89 Ų | 89 | 86.7 Ų | 86.7 | 42% | 0.416 | 45% | 0.449 | S | S | . | . | H | α-helix | trans | -59.1 | -41.2 | 176.4 | -81.3 | -168.9 | -145.3 | 0 | 0 | 112.4 | T31 A32 Q38 K39 | T31-E35 PolarHBondContact O-N 3.12Å; A32-E35 PolarHBondContact O-N 3.1Å; E35-Q38 PolarHBondContact O-N 3Å; E35-K39 WeakPolarHBondContact O-CB 3.27Å; E35-K39 WeakPolarHBondContact O-CD 3.49Å; E35-K39 WeakPolarHBondContact O-CG 3.49Å; E35-K39 PolarHBondContact O-N 3.27Å; E35-K39 IonicContact OE2-NZ 3Å; E35-K39 PolarHBondContact OE2-NZ 3.15Å |
| 36 | R | 86.1 | Confident | 77.4 | Confident | 45 Ų | 45 | 84.5 Ų | 84.5 | 17% | 0.17 | 45% | 0.447 | C | S | . | . | H | α-helix | trans | -60.2 | -47 | 178.2 | -172.8 | -168.8 | 59 | 64.8 | 6 | 111.2 | A32 E33 I34 K39 G40 E41 K43 | A32-R36 WeakPolarHBondContact O-CB 3.34Å; A32-R36 PolarHBondContact O-N 3.19Å; E33-R36 WeakPolarHBondContact O-CB 3.29Å; E33-R36 PolarHBondContact O-N 3.44Å; E33-R36 IonicContact OE1-CZ 3.1Å; E33-R36 IonicContact OE1-NE 2.6Å; E33-R36 IonicContact OE1-NH2 2.71Å; E33-R36 PolarHBondContact OE1-NH2 3.24Å; E33-R36 IonicContact OE2-CZ 3.62Å; E33-R36 VanDerWaalsContact OE2-CZ 3.31Å; E33-R36 IonicContact OE2-NE 3.19Å; E33-R36 PolarHBondContact OE2-NE 3.23Å; E33-R36 IonicContact OE2-NH2 2.68Å; E33-R36 PolarHBondContact OE2-NH2 3.22Å; E33-R36 VanDerWaalsContact OE2-NH2 3.11Å; I34-R36 VanDerWaalsContact C-N 3.32Å; I34-R36 PolarHBondContact O-N 3.39Å; R36-K39 PolarHBondContact O-N 2.73Å; R36-G40 PolarHBondContact O-N 2.69Å; R36-E41 HydrophobicContact CG-CB 3.84Å; R36-E41 WeakPolarHBondContact CG-O 3.47Å; R36-E41 PolarHBondContact NH1-O 2.89Å; R36-E41 PolarHBondContact O-N 3.41Å; R36-K43 VanDerWaalsContact NH1-N 3.15Å |
| 37 | I | 84.9 | Confident | 75.6 | Confident | 42 Ų | 42 | 91.8 Ų | 91.8 | 22% | 0.215 | 47% | 0.474 | C | S | . | . | H | α-helix | trans | -66.3 | -45.1 | 178.3 | -59.5 | 158.8 | 0 | 0 | 0 | 110.7 | Y8 L9 L12 E33 I34 K39 G40 | Y8-I37 HydrophobicContact CD1-CD1 3.61Å; Y8-I37 HydrophobicContact CE1-CD1 3.64Å; L9-I37 HydrophobicContact CB-CG2 4.37Å; L9-I37 HydrophobicContact CD1-CB 4.32Å; L9-I37 HydrophobicContact CD1-CG2 3.75Å; L12-I37 HydrophobicContact CD1-CD1 3.34Å; E33-I37 HydrophobicContact CG-CD1 4.3Å; E33-I37 WeakPolarHBondContact O-CD1 3.47Å; E33-I37 VanDerWaalsContact O-CG1 3.29Å; E33-I37 WeakPolarHBondContact O-CG1 3.45Å; E33-I37 PolarHBondContact O-N 2.88Å; I34-I37 PolarHBondContact O-N 2.94Å; I37-K39 VanDerWaalsContact C-N 3.29Å; I37-K39 PolarHBondContact O-N 3.03Å; I37-G40 PolarHBondContact O-N 2.93Å |
| 38 | Q | 83 | Confident | 73.7 | Confident | 127 Ų | 127 | 97.5 Ų | 97.5 | 59% | 0.593 | 50% | 0.498 | S | S | * | . | H | α-helix | trans | -63.4 | -32.5 | 178.7 | -72.8 | 179.3 | 3.5 | 0 | 0 | 113 | L9 I34 E35 G40 | L9-Q38 HydrophobicContact CD1-CG 4.02Å; I34-Q38 HydrophobicContact CG2-CG 4.32Å; I34-Q38 VanDerWaalsContact CG2-NE2 3.34Å; I34-Q38 WeakPolarHBondContact O-CB 3.48Å; I34-Q38 VanDerWaalsContact O-CG 3.32Å; I34-Q38 WeakPolarHBondContact O-CG 3.31Å; I34-Q38 PolarHBondContact O-N 3.36Å; E35-Q38 PolarHBondContact O-N 3Å; Q38-G40 PolarHBondContact O-N 3.34Å |
| 39 | K | 82.1 | Confident | 71.8 | Confident | 141 Ų | 141 | 98.9 Ų | 98.9 | 61% | 0.613 | 51% | 0.507 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -75.6 | -3 | 174.1 | -71.1 | 165.8 | -167.9 | 167.2 | 0 | 113.5 | E35 R36 I37 E41 | E35-K39 WeakPolarHBondContact O-CB 3.27Å; E35-K39 WeakPolarHBondContact O-CD 3.49Å; E35-K39 WeakPolarHBondContact O-CG 3.49Å; E35-K39 PolarHBondContact O-N 3.27Å; E35-K39 IonicContact OE2-NZ 3Å; E35-K39 PolarHBondContact OE2-NZ 3.15Å; R36-K39 PolarHBondContact O-N 2.73Å; I37-K39 VanDerWaalsContact C-N 3.29Å; I37-K39 PolarHBondContact O-N 3.03Å; K39-E41 PolarHBondContact O-N 3.42Å |
| 40 | G | 71.6 | Confident | 70.6 | Confident | 57 Ų | 57 | 98 Ų | 98 | 59% | 0.588 | 51% | 0.507 | S | S | * | . | T | Hydrogen-bonded Turn | trans | 73.7 | 8.9 | 179.9 | 0 | 0 | 0 | 0 | 0 | 114.3 | R36 I37 Q38 T42 | R36-G40 PolarHBondContact O-N 2.69Å; I37-G40 PolarHBondContact O-N 2.93Å; Q38-G40 PolarHBondContact O-N 3.34Å; G40-T42 PolarHBondContact O-N 3.5Å |
| 41 | E | 60.4 | Low | 69.7 | Low | 130 Ų | 130 | 107.2 Ų | 107.2 | 61% | 0.607 | 54% | 0.542 | S | S | * | . | trans | -72.3 | 85.8 | 164.2 | -70.6 | -170.9 | 144.4 | 0 | 0 | 107.1 | R36 K39 | R36-E41 HydrophobicContact CG-CB 3.84Å; R36-E41 WeakPolarHBondContact CG-O 3.47Å; R36-E41 PolarHBondContact NH1-O 2.89Å; R36-E41 PolarHBondContact O-N 3.41Å; K39-E41 PolarHBondContact O-N 3.42Å | ||
| 42 | T | 55.9 | Low | 69.2 | Low | 106 Ų | 106 | 109.3 Ų | 109.3 | 65% | 0.65 | 55% | 0.551 | S | S | * | * | trans | -56.5 | 154.8 | 166.9 | 47.5 | 0 | 0 | 0 | 0 | 109.4 | G40 K44 | G40-T42 PolarHBondContact O-N 3.5Å; T42-K44 PolarHBondContact O-N 2.91Å; T42-K44 VanDerWaalsContact O-N 3.1Å | ||
| 43 | K | 55.7 | Low | 68.8 | Low | 108 Ų | 108 | 111 Ų | 111 | 47% | 0.47 | 55% | 0.552 | S | S | . | * | trans | -53.3 | 130 | 175.6 | -79 | 177.3 | 175.3 | 157.4 | 0 | 106.4 | Y8 E33 R36 T45 | Y8-K43 PolarHBondContact OH-NZ 2.88Å; E33-K43 WeakPolarHBondContact OE1-CE 3.43Å; E33-K43 IonicContact OE1-NZ 2.62Å; E33-K43 PolarHBondContact OE1-NZ 3.45Å; R36-K43 VanDerWaalsContact NH1-N 3.15Å; K43-T45 PolarHBondContact O-N 3.23Å | ||
| 44 | K | 45.8 | Very low | 68.4 | Low | 206 Ų | 206 | 114.8 Ų | 114.8 | 90% | 0.896 | 57% | 0.573 | S | S | * | * | trans | -65.1 | 77 | 155.8 | -72 | -176.5 | -178.9 | 178.2 | 0 | 106.2 | T42 | T42-K44 PolarHBondContact O-N 2.91Å; T42-K44 VanDerWaalsContact O-N 3.1Å | ||
| 45 | T | 40.9 | Very low | 67.9 | Low | 108 Ų | 108 | 123.6 Ų | 123.6 | 66% | 0.663 | 61% | 0.611 | S | S | * | * | trans | -46.3 | 124.6 | 153.6 | 44.4 | 0 | 0 | 0 | 0 | 104.6 | K43 E47 | K43-T45 PolarHBondContact O-N 3.23Å; T45-E47 PolarHBondContact O-N 3.33Å | ||
| 46 | P | 46.1 | Very low | 67.3 | Low | 94 Ų | 94 | 121.3 Ų | 121.3 | 61% | 0.61 | 61% | 0.607 | S | S | * | * | trans | -51.3 | 144.3 | 174.3 | 24.8 | -34.1 | 0 | 0 | 0 | 107.4 | K48 | P46-K48 HydrophobicContact CB-CG 4.32Å; P46-K48 HydrophobicContact CG-CD 4.42Å; P46-K48 PolarHBondContact O-N 3.45Å | ||
| 47 | E | 53.4 | Low | 66.6 | Low | 190 Ų | 190 | 125.7 Ų | 125.7 | 89% | 0.888 | 64% | 0.639 | S | S | * | * | S | Bend | trans | -71.2 | 41.4 | -173.8 | -60.9 | 169.8 | 148.2 | 0 | 0 | 111.9 | T45 | T45-E47 PolarHBondContact O-N 3.33Š|
| 48 | K | 52.6 | Low | 66.6 | Low | 166 Ų | 166 | 131.3 Ų | 131.3 | 72% | 0.722 | 66% | 0.662 | S | S | * | * | trans | -85.3 | 125.6 | 175.4 | -70.8 | -174.4 | 170.9 | -170.6 | 0 | 108 | P46 | P46-K48 HydrophobicContact CB-CG 4.32Å; P46-K48 HydrophobicContact CG-CD 4.42Å; P46-K48 PolarHBondContact O-N 3.45Å | ||
| 49 | E | 53.9 | Low | 66.9 | Low | 169 Ų | 169 | 129.3 Ų | 129.3 | 79% | 0.79 | 66% | 0.658 | S | S | * | * | S | Bend | trans | 74.2 | 18.3 | 170.5 | -57.2 | 171 | -147.7 | 0 | 0 | 116.9 | Y51 | E49-Y51 PolarHBondContact O-N 2.98Š|
| 50 | T | 68.1 | Low | 67.3 | Low | 109 Ų | 109 | 124.4 Ų | 124.4 | 67% | 0.669 | 64% | 0.638 | S | S | * | * | trans | -77.4 | 94.9 | 148.8 | 49.4 | 0 | 0 | 0 | 0 | 109.2 | L52 | T50-L52 PolarHBondContact O-N 2.72Š| ||
| 51 | Y | 74.8 | Confident | 68.3 | Low | 214 Ų | 214 | 128.1 Ų | 128.1 | 84% | 0.839 | 64% | 0.638 | S | S | * | * | trans | -52.3 | 133.5 | 170.7 | -70.3 | -91.9 | 0 | 0 | 0 | 110.6 | E49 D53 | E49-Y51 PolarHBondContact O-N 2.98Å; Y51-D53 PolarHBondContact O-N 3.32Å | ||
| 52 | L | 79 | Confident | 69.8 | Low | 93 Ų | 93 | 123.4 Ų | 123.4 | 49% | 0.487 | 62% | 0.617 | S | S | . | * | trans | -77.5 | 104.5 | 175.4 | -70.3 | 172.8 | 0 | 0 | 0 | 109 | T50 L54 M60 I143 | T50-L52 PolarHBondContact O-N 2.72Å; L52-L54 PolarHBondContact O-N 3.06Å; L52-M60 HydrophobicContact CD2-SD 4.32Å; L52-I143 HydrophobicContact CB-CD1 4.33Å; L52-I143 HydrophobicContact CD1-CG2 4.16Å; L52-I143 HydrophobicContact CD2-CD1 4.17Å | ||
| 53 | D | 83.1 | Confident | 71.7 | Confident | 89 Ų | 89 | 123.8 Ų | 123.8 | 48% | 0.476 | 61% | 0.61 | S | S | . | * | trans | -70.7 | 108.4 | 170.8 | -177.4 | -5.7 | 0 | 0 | 0 | 109.7 | Y51 F55 A56 I143 | Y51-D53 PolarHBondContact O-N 3.32Å; D53-F55 WeakPolarHBondContact OD1-CA 3.31Å; D53-F55 PolarHBondContact OD1-N 3.29Å; D53-A56 HydrophobicContact CB-CB 4.22Å; D53-A56 PolarHBondContact OD1-N 3.11Å; D53-A56 VanDerWaalsContact OD2-CB 3.26Å; D53-A56 WeakPolarHBondContact OD2-CB 3.47Å; D53-I143 VanDerWaalsContact O-CD1 3.31Å; D53-I143 WeakPolarHBondContact O-CD1 3.46Å | ||
| 54 | L | 81 | Confident | 73.6 | Confident | 118 Ų | 118 | 123.2 Ų | 123.2 | 62% | 0.618 | 61% | 0.609 | S | S | * | * | S | Bend | trans | -86.1 | -12.1 | 178.2 | -60.2 | 179 | 0 | 0 | 0 | 113.2 | L52 I143 | L52-L54 PolarHBondContact O-N 3.06Å; L54-I143 HydrophobicContact CD2-CB 4.08Å; L54-I143 HydrophobicContact CD2-CD1 4.27Å; L54-I143 HydrophobicContact CD2-CG2 3.82Å |
| 55 | F | 78.4 | Confident | 76 | Confident | 195 Ų | 195 | 120.6 Ų | 120.6 | 86% | 0.855 | 59% | 0.593 | S | S | * | * | S | Bend | trans | -88.8 | -34.5 | 178.5 | -64.3 | -78.9 | 0 | 0 | 0 | 111.4 | D53 T57 | D53-F55 WeakPolarHBondContact OD1-CA 3.31Å; D53-F55 PolarHBondContact OD1-N 3.29Å; F55-T57 PolarHBondContact O-N 2.71Å |
| 56 | A | 75.7 | Confident | 78.6 | Confident | 40 Ų | 40 | 117 Ų | 117 | 33% | 0.331 | 57% | 0.571 | S | S | . | * | S | Bend | trans | -62.1 | 121.5 | 163.6 | 0 | 0 | 0 | 0 | 0 | 109.7 | D53 K58 | D53-A56 HydrophobicContact CB-CB 4.22Å; D53-A56 PolarHBondContact OD1-N 3.11Å; D53-A56 VanDerWaalsContact OD2-CB 3.26Å; D53-A56 WeakPolarHBondContact OD2-CB 3.47Å; A56-K58 HydrophobicContact CB-CB 4.21Å; A56-K58 PolarHBondContact O-N 3.1Å |
| 57 | T | 72.3 | Confident | 81 | Confident | 138 Ų | 138 | 118 Ų | 118 | 85% | 0.847 | 57% | 0.571 | S | S | * | * | trans | -70.6 | 31.4 | 171.7 | 51.2 | 0 | 0 | 0 | 0 | 112.8 | F55 T59 | F55-T57 PolarHBondContact O-N 2.71Å; T57-T59 PolarHBondContact O-N 2.95Å | ||
| 58 | K | 85.5 | Confident | 83 | Confident | 160 Ų | 160 | 109.3 Ų | 109.3 | 70% | 0.696 | 53% | 0.53 | S | S | * | . | P | Polyproline II helix | trans | -69.2 | 118.7 | -179.5 | -174.3 | 178.6 | -179.2 | -175.5 | 0 | 109.2 | A56 | A56-K58 HydrophobicContact CB-CB 4.21Å; A56-K58 PolarHBondContact O-N 3.1Å |
| 59 | T | 88.5 | Confident | 85 | Confident | 84 Ų | 84 | 102.9 Ų | 102.9 | 52% | 0.515 | 51% | 0.505 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -70.9 | 133.2 | 171.2 | 51.7 | 0 | 0 | 0 | 0 | 109.9 | T57 | T57-T59 PolarHBondContact O-N 2.95Å |
| 60 | M | 89.8 | Confident | 86.8 | Confident | 39 Ų | 39 | 97.4 Ų | 97.4 | 19% | 0.192 | 48% | 0.484 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -96.3 | 163.3 | 173.9 | -173.8 | 162.6 | 61 | 0 | 0 | 109.7 | L52 L62 T140 A141 I143 N146 Y147 | L52-M60 HydrophobicContact CD2-SD 4.32Å; M60-L62 HydrophobicContact CE-CD1 4.11Å; M60-L62 HydrophobicContact CE-CD2 3.79Å; M60-L62 HydrophobicContact CE-CG 3.94Å; M60-L62 HydrophobicContact CG-CD2 4.35Å; M60-L62 HydrophobicContact SD-CD2 4.11Å; M60-T140 WeakPolarHBondContact O-CA 3.4Å; M60-A141 PolarHBondContact N-O 3.47Å; M60-A141 PolarHBondContact O-N 2.61Å; M60-I143 HydrophobicContact CB-CG1 4.27Å; M60-I143 HydrophobicContact CE-CB 4.39Å; M60-I143 HydrophobicContact CE-CG1 4.27Å; M60-I143 HydrophobicContact CE-CG2 4.05Å; M60-I143 HydrophobicContact SD-CG1 4.49Å; M60-N146 VanDerWaalsContact C-ND2 3.3Å; M60-N146 HydrophobicContact CE-CB 4.3Å; M60-N146 PolarHBondContact O-ND2 3.36Å; M60-Y147 HydrophobicContact CE-CD2 4.23Å; M60-Y147 HydrophobicContact CE-CE2 3.56Å |
| 61 | K | 93 | Very high | 87.8 | Confident | 135 Ų | 135 | 99.4 Ų | 99.4 | 59% | 0.587 | 48% | 0.483 | S | S | * | . | E | Extended strand (participates in β ladder) | trans | -124.5 | 102 | 170.6 | -65.7 | -165.9 | 174.5 | -177.8 | 0 | 110.2 | V139 T140 | K61-V139 WeakPolarHBondContact CA-O 3.19Å; K61-T140 HydrophobicContact CG-CG2 4.03Å |
| 62 | L | 93.3 | Very high | 88.6 | Confident | 30 Ų | 30 | 96 Ų | 96 | 16% | 0.157 | 48% | 0.475 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -88.1 | 143.9 | 171.9 | -63.4 | -179.3 | 0 | 0 | 0 | 109.9 | M60 E138 V139 N146 Y147 M150 | M60-L62 HydrophobicContact CE-CD1 4.11Å; M60-L62 HydrophobicContact CE-CD2 3.79Å; M60-L62 HydrophobicContact CE-CG 3.94Å; M60-L62 HydrophobicContact CG-CD2 4.35Å; M60-L62 HydrophobicContact SD-CD2 4.11Å; L62-E138 WeakPolarHBondContact O-CA 3.26Å; L62-V139 PolarHBondContact N-O 3.36Å; L62-V139 PolarHBondContact O-N 3.34Å; L62-N146 WeakPolarHBondContact CB-OD1 3.09Å; L62-N146 HydrophobicContact CD1-CB 4.17Å; L62-N146 VanDerWaalsContact CD1-OD1 3.31Å; L62-N146 WeakPolarHBondContact CD1-OD1 3.28Å; L62-N146 VanDerWaalsContact CG-OD1 3.23Å; L62-N146 WeakPolarHBondContact CG-OD1 3.34Å; L62-Y147 HydrophobicContact CD1-CD1 3.53Å; L62-Y147 HydrophobicContact CD1-CE1 3.6Å; L62-Y147 HydrophobicContact CD1-CG 4.05Å; L62-Y147 HydrophobicContact CD2-CE1 4.26Å; L62-M150 HydrophobicContact CB-CE 3.62Å; L62-M150 HydrophobicContact CD1-CB 4.49Å |
| 63 | K | 95.5 | Very high | 89.2 | Confident | 115 Ų | 115 | 96.7 Ų | 96.7 | 50% | 0.5 | 47% | 0.472 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -142.9 | 104.3 | -172.3 | -74.3 | -179.2 | 173 | -169.8 | 0 | 110.2 | F136 I137 E138 | K63-F136 HydrophobicContact CB-CE2 4.03Å; K63-F136 HydrophobicContact CB-CZ 4.06Å; K63-F136 HydrophobicContact CD-CZ 4Å; K63-F136 HydrophobicContact CG-CE2 4.4Å; K63-F136 HydrophobicContact CG-CZ 3.92Å; K63-I137 CarbonylContact C-O 3.58Å; K63-I137 WeakPolarHBondContact CA-O 3.33Å; K63-E138 WeakPolarHBondContact CE-OE1 3.2Å; K63-E138 HydrophobicContact CG-CB 4.49Å; K63-E138 HydrophobicContact CG-CG 4.23Å; K63-E138 IonicContact NZ-OE1 2.74Å; K63-E138 PolarHBondContact NZ-OE1 2.84Å; K63-E138 VanDerWaalsContact NZ-OE1 3.1Å |
| 64 | E | 96.2 | Very high | 89.5 | Confident | 96 Ų | 96 | 97.5 Ų | 97.5 | 45% | 0.449 | 48% | 0.481 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -114.7 | 154.3 | -178.1 | -74.2 | -57.7 | 156.7 | 0 | 0 | 113.4 | F136 I137 M150 | E64-F136 WeakPolarHBondContact O-CA 3.48Å; E64-F136 WeakPolarHBondContact O-CD2 3.25Å; E64-I137 PolarHBondContact N-O 3.33Å; E64-I137 PolarHBondContact O-N 3.36Å; E64-M150 HydrophobicContact CB-CE 4.2Å; E64-M150 HydrophobicContact CB-SD 3.94Å; E64-M150 HydrophobicContact CG-CE 4.08Å; E64-M150 HydrophobicContact CG-CG 4.32Å; E64-M150 HydrophobicContact CG-SD 3.97Å |
| 65 | R | 95.6 | Very high | 89.8 | Confident | 151 Ų | 151 | 102.6 Ų | 102.6 | 57% | 0.57 | 49% | 0.493 | S | S | * | . | E | Extended strand (participates in β ladder) | trans | -127.9 | 106.2 | -178 | -70 | 175.6 | 178.3 | 150.9 | -2.6 | 110.3 | V135 F136 | R65-V135 WeakPolarHBondContact CA-O 3.32Å; R65-F136 HydrophobicContact CG-CD2 3.85Å; R65-F136 HydrophobicContact CG-CE2 4.44Å |
| 66 | V | 95.8 | Very high | 90.4 | Very high | 33 Ų | 33 | 94.5 Ų | 94.5 | 20% | 0.2 | 46% | 0.459 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -99 | 116.5 | -179.8 | -174.1 | 0 | 0 | 0 | 0 | 109.5 | H134 V135 I137 L161 | V66-H134 CarbonylContact O-C 3.59Å; V66-H134 WeakPolarHBondContact O-CA 3.44Å; V66-H134 VanDerWaalsContact O-CB 3.32Å; V66-H134 WeakPolarHBondContact O-CB 3.48Å; V66-V135 HydrophobicContact CB-CB 4.43Å; V66-V135 PolarHBondContact N-O 2.88Å; V66-V135 PolarHBondContact O-N 3.48Å; V66-I137 HydrophobicContact CG2-CD1 4.18Å; V66-L161 HydrophobicContact CG1-CD1 3.65Å |
| 67 | L | 95.8 | Very high | 91.1 | Very high | 114 Ų | 114 | 97.5 Ų | 97.5 | 60% | 0.597 | 47% | 0.47 | S | S | * | . | E | Extended strand (participates in β ladder) | trans | -67.4 | 139.1 | 178.6 | -72.6 | 168.2 | 0 | 0 | 0 | 111.8 | E132 H134 | L67-E132 HydrophobicContact CD2-CB 4.07Å; L67-H134 HydrophobicContact CD2-CB 4.49Å |
| 68 | I | 95.1 | Very high | 92.1 | Very high | 8 Ų | 8 | 91.1 Ų | 91.1 | 4% | 0.041 | 43% | 0.43 | C | S | . | . | P | Polyproline II helix | trans | -91.6 | 127.2 | 175 | -57.2 | -166.3 | 0 | 0 | 0 | 109.6 | T70 F78 L82 V103 L133 V135 L161 | I68-T70 HydrophobicContact CG2-CG2 3.93Å; I68-T70 PolarHBondContact O-N 3.27Å; I68-T70 PolarHBondContact O-OG1 2.76Å; I68-F78 HydrophobicContact CG2-CB 3.46Å; I68-F78 VanDerWaalsContact CG2-CB 3.46Å; I68-F78 HydrophobicContact CG2-CD1 4.43Å; I68-F78 HydrophobicContact CG2-CD2 3.58Å; I68-F78 HydrophobicContact CG2-CE2 4.42Å; I68-F78 HydrophobicContact CG2-CG 3.57Å; I68-L82 HydrophobicContact CD1-CD1 4.04Å; I68-V103 HydrophobicContact CD1-CG1 4.35Å; I68-L133 HydrophobicContact CB-CD2 4.05Å; I68-L133 HydrophobicContact CB-CG 4.21Å; I68-L133 HydrophobicContact CD1-CD2 4.03Å; I68-L133 HydrophobicContact CD1-CG 3.99Å; I68-L133 HydrophobicContact CG1-CD2 4.46Å; I68-L133 HydrophobicContact CG1-CG 4.3Å; I68-L133 HydrophobicContact CG2-CD2 4.11Å; I68-L133 PolarHBondContact N-O 3.28Å; I68-V135 HydrophobicContact CD1-CG2 3.83Å; I68-V135 HydrophobicContact CG1-CG2 4.04Å; I68-L161 HydrophobicContact CB-CD2 4.29Å; I68-L161 HydrophobicContact CD1-CD2 4.31Å; I68-L161 HydrophobicContact CG1-CD2 3.91Å; I68-L161 HydrophobicContact CG2-CD2 4Å |
| 69 | P | 93.9 | Very high | 92.5 | Very high | 30 Ų | 30 | 84.6 Ų | 84.6 | 20% | 0.195 | 40% | 0.403 | C | S | . | . | trans | -76.8 | 43.6 | -170.9 | 32.6 | -37 | 0 | 0 | 0 | 114.7 | K71 Q72 Y73 F78 | P69-K71 PolarHBondContact O-N 3.26Å; P69-Q72 HydrophobicContact CB-CB 4.41Å; P69-Q72 PolarHBondContact O-N 2.7Å; P69-Y73 HydrophobicContact CB-CD2 4.26Å; P69-Y73 HydrophobicContact CG-CD2 4.29Å; P69-Y73 PolarHBondContact O-N 2.64Å; P69-F78 HydrophobicContact CG-CE1 4.32Å; P69-F78 HydrophobicContact CG-CE2 4.28Å; P69-F78 HydrophobicContact CG-CZ 3.9Å | ||
| 70 | T | 91.9 | Very high | 92.8 | Very high | 55 Ų | 55 | 82.1 Ų | 82.1 | 34% | 0.337 | 40% | 0.395 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -57.6 | -27.8 | 177 | 52.8 | 0 | 0 | 0 | 0 | 114.3 | I68 Y73 P74 F78 L133 | I68-T70 HydrophobicContact CG2-CG2 3.93Å; I68-T70 PolarHBondContact O-N 3.27Å; I68-T70 PolarHBondContact O-OG1 2.76Å; T70-Y73 CarbonylContact O-C 3.6Å; T70-P74 WeakPolarHBondContact O-CA 3.48Å; T70-P74 WeakPolarHBondContact O-CB 3.28Å; T70-F78 HydrophobicContact CG2-CD2 4.27Å; T70-L133 HydrophobicContact CG2-CD2 3.63Å |
| 71 | K | 90.4 | Very high | 92.9 | Very high | 151 Ų | 151 | 83.6 Ų | 83.6 | 66% | 0.657 | 40% | 0.4 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -68.9 | -34 | 174.1 | -69.9 | 170.3 | 177.1 | 161.8 | 0 | 112.7 | P69 E132 | P69-K71 PolarHBondContact O-N 3.26Å; K71-E132 WeakPolarHBondContact CE-OE1 3.34Å; K71-E132 IonicContact NZ-OE1 2.72Å; K71-E132 PolarHBondContact NZ-OE1 3.49Å; K71-E132 IonicContact NZ-OE2 3.79Å; K71-E132 PolarHBondContact NZ-OE2 2.62Å |
| 72 | Q | 91.3 | Very high | 93 | Very high | 142 Ų | 142 | 77.2 Ų | 77.2 | 66% | 0.664 | 37% | 0.373 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -84.8 | -39.8 | -179.7 | -64 | 173.9 | -4.5 | 0 | 0 | 110.9 | P69 P74 | P69-Q72 HydrophobicContact CB-CB 4.41Å; P69-Q72 PolarHBondContact O-N 2.7Å; Q72-P74 VanDerWaalsContact C-CD 3.43Å; Q72-P74 WeakPolarHBondContact O-CD 3.36Å |
| 73 | Y | 90.4 | Very high | 93.1 | Very high | 108 Ų | 108 | 79.1 Ų | 79.1 | 42% | 0.424 | 38% | 0.382 | S | S | . | . | trans | -124.3 | 66.2 | -176.1 | -54.8 | -74.7 | 0 | 0 | 0 | 111.7 | P69 T70 R75 V76 F78 P163 | P69-Y73 HydrophobicContact CB-CD2 4.26Å; P69-Y73 HydrophobicContact CG-CD2 4.29Å; P69-Y73 PolarHBondContact O-N 2.64Å; T70-Y73 CarbonylContact O-C 3.6Å; Y73-R75 PolarHBondContact O-N 3.44Å; Y73-R75 VanDerWaalsContact O-N 3.11Å; Y73-V76 PolarHBondContact O-N 2.92Å; Y73-V76 VanDerWaalsContact O-N 3.13Å; Y73-F78 HydrophobicContact CD2-CZ 4.06Å; Y73-F78 HydrophobicContact CG-CZ 4.25Å; Y73-P163 HydrophobicContact CD1-CG 3.85Å; Y73-P163 HydrophobicContact CD2-CG 3.9Å; Y73-P163 HydrophobicContact CE1-CG 4.11Å; Y73-P163 HydrophobicContact CE2-CG 4.17Å; Y73-P163 HydrophobicContact CG-CG 3.73Å | ||
| 74 | P | 89.6 | Confident | 93 | Very high | 105 Ų | 105 | 74.6 Ų | 74.6 | 68% | 0.682 | 37% | 0.369 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -68.2 | -12.6 | -172.3 | 27.7 | -36.8 | 0 | 0 | 0 | 114.7 | T70 Q72 | T70-P74 WeakPolarHBondContact O-CA 3.48Å; T70-P74 WeakPolarHBondContact O-CB 3.28Å; Q72-P74 VanDerWaalsContact C-CD 3.43Å; Q72-P74 WeakPolarHBondContact O-CD 3.36Å |
| 75 | R | 88 | Confident | 92.9 | Very high | 226 Ų | 226 | 74.8 Ų | 74.8 | 85% | 0.853 | 38% | 0.378 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -88 | -13 | 176.7 | -61.7 | -176.2 | -176.6 | 178.7 | 1.4 | 113.3 | Y73 | Y73-R75 PolarHBondContact O-N 3.44Å; Y73-R75 VanDerWaalsContact O-N 3.11Å |
| 76 | V | 89.9 | Confident | 92.7 | Very high | 24 Ų | 24 | 76.9 Ų | 76.9 | 15% | 0.145 | 39% | 0.394 | C | S | . | . | trans | -93 | 126.4 | -173.5 | -178 | 0 | 0 | 0 | 0 | 110.5 | Y73 F78 P163 | Y73-V76 PolarHBondContact O-N 2.92Å; Y73-V76 VanDerWaalsContact O-N 3.13Å; V76-F78 HydrophobicContact CB-CD2 4.23Å; V76-F78 HydrophobicContact CB-CE1 4.32Å; V76-F78 HydrophobicContact CB-CE2 3.78Å; V76-F78 HydrophobicContact CB-CZ 3.83Å; V76-F78 HydrophobicContact CG1-CD1 3.95Å; V76-F78 HydrophobicContact CG1-CD2 4.21Å; V76-F78 HydrophobicContact CG1-CE1 3.73Å; V76-F78 HydrophobicContact CG1-CE2 4.01Å; V76-F78 HydrophobicContact CG1-CG 4.19Å; V76-F78 HydrophobicContact CG1-CZ 3.77Å; V76-F78 HydrophobicContact CG2-CZ 4.46Å; V76-F78 WeakPolarHBondContact O-CD2 3.31Å; V76-F78 PolarHBondContact O-N 3.36Å; V76-F78 VanDerWaalsContact O-N 3.11Å; V76-P163 HydrophobicContact CG2-CB 4.41Å; V76-P163 HydrophobicContact CG2-CG 4.16Å | ||
| 77 | N | 91.6 | Very high | 92.6 | Very high | 104 Ų | 104 | 75.8 Ų | 75.8 | 56% | 0.556 | 39% | 0.39 | S | S | * | . | trans | -86.1 | 73.3 | 175.6 | -173.7 | 5.8 | 0 | 0 | 0 | 111.8 | V79 G80 K81 | N77-V79 VanDerWaalsContact C-N 3.27Å; N77-V79 PolarHBondContact O-N 3.42Å; N77-G80 PolarHBondContact O-N 2.93Å; N77-G80 PolarHBondContact OD1-N 3.33Å; N77-K81 PolarHBondContact O-N 3.23Å | ||
| 78 | F | 93.9 | Very high | 92.6 | Very high | 3 Ų | 3 | 73.1 Ų | 73.1 | 1% | 0.013 | 38% | 0.381 | C | S | . | . | H | α-helix | trans | -55.1 | -39.4 | 177.7 | -64.9 | -73 | 0 | 0 | 0 | 113.6 | I68 P69 T70 Y73 V76 K81 L82 F160 L161 P163 | I68-F78 HydrophobicContact CG2-CB 3.46Å; I68-F78 VanDerWaalsContact CG2-CB 3.46Å; I68-F78 HydrophobicContact CG2-CD1 4.43Å; I68-F78 HydrophobicContact CG2-CD2 3.58Å; I68-F78 HydrophobicContact CG2-CE2 4.42Å; I68-F78 HydrophobicContact CG2-CG 3.57Å; P69-F78 HydrophobicContact CG-CE1 4.32Å; P69-F78 HydrophobicContact CG-CE2 4.28Å; P69-F78 HydrophobicContact CG-CZ 3.9Å; T70-F78 HydrophobicContact CG2-CD2 4.27Å; Y73-F78 HydrophobicContact CD2-CZ 4.06Å; Y73-F78 HydrophobicContact CG-CZ 4.25Å; V76-F78 HydrophobicContact CB-CD2 4.23Å; V76-F78 HydrophobicContact CB-CE1 4.32Å; V76-F78 HydrophobicContact CB-CE2 3.78Å; V76-F78 HydrophobicContact CB-CZ 3.83Å; V76-F78 HydrophobicContact CG1-CD1 3.95Å; V76-F78 HydrophobicContact CG1-CD2 4.21Å; V76-F78 HydrophobicContact CG1-CE1 3.73Å; V76-F78 HydrophobicContact CG1-CE2 4.01Å; V76-F78 HydrophobicContact CG1-CG 4.19Å; V76-F78 HydrophobicContact CG1-CZ 3.77Å; V76-F78 HydrophobicContact CG2-CZ 4.46Å; V76-F78 WeakPolarHBondContact O-CD2 3.31Å; V76-F78 PolarHBondContact O-N 3.36Å; V76-F78 VanDerWaalsContact O-N 3.11Å; F78-K81 PolarHBondContact O-N 3.46Å; F78-L82 WeakPolarHBondContact O-CB 3.3Å; F78-L82 PolarHBondContact O-N 3.4Å; F78-F160 WeakPolarHBondContact CD1-O 3.31Å; F78-L161 HydrophobicContact CD1-CD2 4.42Å; F78-L161 VanDerWaalsContact CE1-O 3.25Å; F78-L161 WeakPolarHBondContact CE1-O 3.49Å; F78-P163 HydrophobicContact CE1-CG 4.19Å; F78-P163 HydrophobicContact CZ-CG 4.08Å |
| 79 | V | 93.9 | Very high | 92.7 | Very high | 23 Ų | 23 | 74.7 Ų | 74.7 | 14% | 0.139 | 39% | 0.391 | C | S | . | . | H | α-helix | trans | -64 | -43.3 | -179.8 | -178.9 | 0 | 0 | 0 | 0 | 110.4 | N77 L83 V103 L133 | N77-V79 VanDerWaalsContact C-N 3.27Å; N77-V79 PolarHBondContact O-N 3.42Å; V79-L83 HydrophobicContact CG1-CD1 3.76Å; V79-L83 WeakPolarHBondContact O-CB 3.36Å; V79-L83 PolarHBondContact O-N 3.35Å; V79-V103 HydrophobicContact CG1-CG1 4.26Å; V79-V103 HydrophobicContact CG2-CG1 4.1Å; V79-L133 HydrophobicContact CG2-CD1 4.2Å; V79-L133 HydrophobicContact CG2-CD2 3.76Å; V79-L133 HydrophobicContact CG2-CG 4.48Å |
| 80 | G | 93.5 | Very high | 92.7 | Very high | 32 Ų | 32 | 74 Ų | 74 | 33% | 0.33 | 39% | 0.386 | S | S | . | . | H | α-helix | trans | -62.8 | -44.3 | 172.5 | 0 | 0 | 0 | 0 | 0 | 113.3 | N77 G84 | N77-G80 PolarHBondContact O-N 2.93Å; N77-G80 PolarHBondContact OD1-N 3.33Å; G80-G84 PolarHBondContact O-N 3.49Å |
| 81 | K | 92.8 | Very high | 92.9 | Very high | 70 Ų | 70 | 77.1 Ų | 77.1 | 30% | 0.304 | 39% | 0.394 | S | S | . | . | H | α-helix | trans | -64.1 | -39.4 | 179.1 | -162.8 | 174.3 | 177.3 | 161.7 | 0 | 112 | N77 F78 F160 E167 | N77-K81 PolarHBondContact O-N 3.23Å; F78-K81 PolarHBondContact O-N 3.46Å; K81-F160 HydrophobicContact CG-CD1 4.26Å; K81-E167 IonicContact NZ-OE2 2.68Å; K81-E167 PolarHBondContact NZ-OE2 3.15Å |
| 82 | L | 94.6 | Very high | 93.2 | Very high | 2 Ų | 2 | 77.3 Ų | 77.3 | 1% | 0.01 | 39% | 0.391 | C | S | . | . | H | α-helix | trans | -70 | -45.8 | 176.1 | -82.3 | 164.4 | 0 | 0 | 0 | 113.3 | I68 F78 I90 V135 F160 L161 | I68-L82 HydrophobicContact CD1-CD1 4.04Å; F78-L82 WeakPolarHBondContact O-CB 3.3Å; F78-L82 PolarHBondContact O-N 3.4Å; L82-I90 WeakPolarHBondContact O-CB 3.3Å; L82-I90 PolarHBondContact O-N 3Å; L82-V135 HydrophobicContact CD1-CG2 3.7Å; L82-F160 HydrophobicContact CD2-CB 3.5Å; L82-F160 VanDerWaalsContact CD2-CB 3.5Å; L82-F160 HydrophobicContact CD2-CD1 4.49Å; L82-F160 HydrophobicContact CD2-CD2 3.92Å; L82-F160 HydrophobicContact CD2-CG 3.72Å; L82-F160 HydrophobicContact CG-CB 3.83Å; L82-F160 HydrophobicContact CG-CG 4.35Å; L82-L161 HydrophobicContact CD1-CD2 4.15Å |
| 83 | L | 94.8 | Very high | 93.4 | Very high | 69 Ų | 69 | 70.8 Ų | 70.8 | 36% | 0.361 | 36% | 0.36 | S | S | . | . | H | α-helix | trans | -67.5 | -47.8 | 179.4 | -84.6 | 156.3 | 0 | 0 | 0 | 111.7 | V79 G87 S88 T89 I90 | V79-L83 HydrophobicContact CG1-CD1 3.76Å; V79-L83 WeakPolarHBondContact O-CB 3.36Å; V79-L83 PolarHBondContact O-N 3.35Å; L83-G87 CarbonylContact O-C 3.49Å; L83-G87 WeakPolarHBondContact O-CA 3.2Å; L83-S88 PolarHBondContact O-N 2.9Å; L83-T89 WeakPolarHBondContact O-CB 3.23Å; L83-T89 PolarHBondContact O-N 2.98Å; L83-I90 HydrophobicContact CD2-CG2 3.85Å; L83-I90 PolarHBondContact O-N 3.36Å |
| 84 | G | 93.8 | Very high | 93.7 | Very high | 21 Ų | 21 | 68.1 Ų | 68.1 | 22% | 0.216 | 35% | 0.352 | C | S | . | . | trans | 67.4 | -178 | -168.3 | 0 | 0 | 0 | 0 | 0 | 113.6 | G80 Q86 G87 T89 | G80-G84 PolarHBondContact O-N 3.49Å; G84-Q86 PolarHBondContact O-N 3.16Å; G84-G87 PolarHBondContact O-N 3.43Å; G84-T89 WeakPolarHBondContact CA-OG1 3.33Å | ||
| 85 | P | 94.3 | Very high | 94 | Very high | 100 Ų | 100 | 70.6 Ų | 70.6 | 65% | 0.649 | 36% | 0.355 | S | S | * | . | G | 310 helix | trans | -61.7 | 125.8 | -179.8 | 25.7 | -32.9 | 0 | 0 | 0 | 110.6 | G87 S88 | P85-G87 PolarHBondContact O-N 3.41Å; P85-S88 WeakPolarHBondContact O-CB 3.41Å; P85-S88 PolarHBondContact O-N 2.95Å; P85-S88 PolarHBondContact O-OG 2.95Å; P85-S88 VanDerWaalsContact O-OG 3.07Å |
| 86 | Q | 91.4 | Very high | 94.3 | Very high | 194 Ų | 194 | 64.5 Ų | 64.5 | 91% | 0.907 | 34% | 0.336 | S | S | * | . | G | 310 helix | trans | 53.7 | 20.2 | -177.3 | -57.3 | -175.4 | -15 | 0 | 0 | 115.4 | G84 | G84-Q86 PolarHBondContact O-N 3.16Š|
| 87 | G | 93.8 | Very high | 94.5 | Very high | 11 Ų | 11 | 63.6 Ų | 63.6 | 11% | 0.113 | 33% | 0.33 | C | S | . | . | G | 310 helix | trans | 76.3 | 18.1 | -175.3 | 0 | 0 | 0 | 0 | 0 | 114.3 | L83 G84 P85 I90 K91 | L83-G87 CarbonylContact O-C 3.49Å; L83-G87 WeakPolarHBondContact O-CA 3.2Å; G84-G87 PolarHBondContact O-N 3.43Å; P85-G87 PolarHBondContact O-N 3.41Å; G87-I90 WeakPolarHBondContact O-CG2 3.38Å; G87-K91 WeakPolarHBondContact O-CB 3.34Å; G87-K91 WeakPolarHBondContact O-CD 3.38Å; G87-K91 VanDerWaalsContact O-CG 3.24Å; G87-K91 WeakPolarHBondContact O-CG 3.47Å; G87-K91 PolarHBondContact O-N 3.41Å; G87-K91 VanDerWaalsContact O-N 3.1Å |
| 88 | S | 96.3 | Very high | 94.6 | Very high | 58 Ų | 58 | 60.4 Ų | 60.4 | 41% | 0.406 | 32% | 0.322 | S | S | . | . | H | α-helix | trans | -63.7 | -43.7 | -178.6 | 62.4 | 0 | 0 | 0 | 0 | 112.6 | L83 P85 K91 R92 | L83-S88 PolarHBondContact O-N 2.9Å; P85-S88 WeakPolarHBondContact O-CB 3.41Å; P85-S88 PolarHBondContact O-N 2.95Å; P85-S88 PolarHBondContact O-OG 2.95Å; P85-S88 VanDerWaalsContact O-OG 3.07Å; S88-K91 PolarHBondContact O-N 2.84Å; S88-R92 WeakPolarHBondContact O-CB 3.27Å; S88-R92 PolarHBondContact O-N 3.39Å |
| 89 | T | 95.8 | Very high | 94.7 | Very high | 41 Ų | 41 | 60.5 Ų | 60.5 | 25% | 0.252 | 32% | 0.323 | S | S | . | . | H | α-helix | trans | -62.2 | -48.2 | 179.8 | -54.2 | 0 | 0 | 0 | 0 | 111.2 | L83 G84 K91 R92 L93 F160 | L83-T89 WeakPolarHBondContact O-CB 3.23Å; L83-T89 PolarHBondContact O-N 2.98Å; G84-T89 WeakPolarHBondContact CA-OG1 3.33Å; T89-K91 VanDerWaalsContact C-N 3.32Å; T89-K91 PolarHBondContact O-N 3.01Å; T89-R92 PolarHBondContact O-N 3.32Å; T89-L93 VanDerWaalsContact O-CB 3.25Å; T89-L93 WeakPolarHBondContact O-CB 3.2Å; T89-L93 PolarHBondContact O-N 3.35Å; T89-F160 HydrophobicContact CG2-CE1 3.58Å; T89-F160 HydrophobicContact CG2-CZ 3.77Å |
| 90 | I | 95.6 | Very high | 94.8 | Very high | 15 Ų | 15 | 64.6 Ų | 64.6 | 8% | 0.077 | 34% | 0.339 | C | S | . | . | H | α-helix | trans | -68.9 | -28.3 | 178.7 | -162.7 | 168.1 | 0 | 0 | 0 | 112.8 | L82 L83 G87 Q94 I101 V103 | L82-I90 WeakPolarHBondContact O-CB 3.3Å; L82-I90 PolarHBondContact O-N 3Å; L83-I90 HydrophobicContact CD2-CG2 3.85Å; L83-I90 PolarHBondContact O-N 3.36Å; G87-I90 WeakPolarHBondContact O-CG2 3.38Å; I90-Q94 WeakPolarHBondContact O-CG 3.34Å; I90-Q94 PolarHBondContact O-N 3.04Å; I90-Q94 VanDerWaalsContact O-N 3.15Å; I90-Q94 PolarHBondContact O-NE2 3.32Å; I90-I101 HydrophobicContact CD1-CG2 4.17Å; I90-I101 HydrophobicContact CG1-CB 4.44Å; I90-I101 HydrophobicContact CG1-CG2 4.31Å; I90-V103 HydrophobicContact CD1-CG2 4.45Å |
| 91 | K | 96.2 | Very high | 95 | Very high | 121 Ų | 121 | 63.3 Ų | 63.3 | 53% | 0.526 | 33% | 0.325 | S | S | . | . | H | α-helix | trans | -68.5 | -52.3 | 173.6 | -77.3 | 169.5 | -179.4 | 172.8 | 0 | 110.8 | G87 S88 T89 L93 Q94 E95 | G87-K91 WeakPolarHBondContact O-CB 3.34Å; G87-K91 WeakPolarHBondContact O-CD 3.38Å; G87-K91 VanDerWaalsContact O-CG 3.24Å; G87-K91 WeakPolarHBondContact O-CG 3.47Å; G87-K91 PolarHBondContact O-N 3.41Å; G87-K91 VanDerWaalsContact O-N 3.1Å; S88-K91 PolarHBondContact O-N 2.84Å; T89-K91 VanDerWaalsContact C-N 3.32Å; T89-K91 PolarHBondContact O-N 3.01Å; K91-L93 VanDerWaalsContact C-N 3.29Å; K91-L93 PolarHBondContact O-N 3.02Å; K91-Q94 WeakPolarHBondContact O-CB 3.46Å; K91-Q94 PolarHBondContact O-N 2.95Å; K91-E95 WeakPolarHBondContact O-CG 3.25Å; K91-E95 PolarHBondContact O-N 2.67Å |
| 92 | R | 95.8 | Very high | 95.1 | Very high | 155 Ų | 155 | 61.8 Ų | 61.8 | 59% | 0.585 | 32% | 0.323 | S | S | * | . | H | α-helix | trans | -53.8 | -46.9 | 175 | 178.1 | -179.6 | 171.4 | -177.2 | -2.4 | 111.4 | S88 T89 Q94 E95 E96 | S88-R92 WeakPolarHBondContact O-CB 3.27Å; S88-R92 PolarHBondContact O-N 3.39Å; T89-R92 PolarHBondContact O-N 3.32Å; R92-Q94 VanDerWaalsContact C-N 3.3Å; R92-Q94 PolarHBondContact O-N 3.49Å; R92-E95 PolarHBondContact O-N 2.96Å; R92-E95 VanDerWaalsContact O-N 3.14Å; R92-E96 HydrophobicContact CG-CG 4.22Å; R92-E96 IonicContact CZ-OE1 2.64Å; R92-E96 VanDerWaalsContact NE-CD 3.32Å; R92-E96 IonicContact NE-OE1 3.53Å; R92-E96 PolarHBondContact NE-OE1 3.38Å; R92-E96 IonicContact NE-OE2 3.19Å; R92-E96 PolarHBondContact NE-OE2 3.01Å; R92-E96 IonicContact NH2-OE1 2.62Å; R92-E96 PolarHBondContact NH2-OE1 2.87Å; R92-E96 IonicContact NH2-OE2 2.74Å; R92-E96 WeakPolarHBondContact O-CB 3.32Å; R92-E96 WeakPolarHBondContact O-CG 3.48Å; R92-E96 PolarHBondContact O-N 2.86Å |
| 93 | L | 95.7 | Very high | 95.2 | Very high | 4 Ų | 4 | 62.6 Ų | 62.6 | 2% | 0.021 | 33% | 0.328 | C | S | . | . | H | α-helix | trans | -60 | -37.3 | 177.8 | -178.7 | 63.4 | 0 | 0 | 0 | 112.7 | T89 K91 T97 I101 E156 V157 F160 | T89-L93 VanDerWaalsContact O-CB 3.25Å; T89-L93 WeakPolarHBondContact O-CB 3.2Å; T89-L93 PolarHBondContact O-N 3.35Å; K91-L93 VanDerWaalsContact C-N 3.29Å; K91-L93 PolarHBondContact O-N 3.02Å; L93-T97 HydrophobicContact CD1-CG2 4.02Å; L93-T97 VanDerWaalsContact O-CB 3.32Å; L93-T97 WeakPolarHBondContact O-CB 3.21Å; L93-T97 WeakPolarHBondContact O-CG2 3.43Å; L93-T97 PolarHBondContact O-N 3.18Å; L93-T97 VanDerWaalsContact O-N 3.15Å; L93-T97 PolarHBondContact O-OG1 3.15Å; L93-I101 HydrophobicContact CD2-CD1 3.81Å; L93-I101 HydrophobicContact CG-CD1 3.63Å; L93-E156 HydrophobicContact CD1-CB 3.42Å; L93-E156 VanDerWaalsContact CD1-CB 3.42Å; L93-E156 HydrophobicContact CD1-CG 4.2Å; L93-V157 HydrophobicContact CD2-CG2 3.98Å; L93-F160 HydrophobicContact CD1-CE2 4.33Å; L93-F160 HydrophobicContact CD2-CE2 4.16Å |
| 94 | Q | 96.6 | Very high | 95.2 | Very high | 53 Ų | 53 | 61.2 Ų | 61.2 | 25% | 0.248 | 32% | 0.321 | C | S | . | . | H | α-helix | trans | -72.3 | -36.3 | 175 | -72.4 | 172.4 | 100.4 | 0 | 0 | 112.5 | I90 K91 R92 G98 A99 I101 | I90-Q94 WeakPolarHBondContact O-CG 3.34Å; I90-Q94 PolarHBondContact O-N 3.04Å; I90-Q94 VanDerWaalsContact O-N 3.15Å; I90-Q94 PolarHBondContact O-NE2 3.32Å; K91-Q94 WeakPolarHBondContact O-CB 3.46Å; K91-Q94 PolarHBondContact O-N 2.95Å; R92-Q94 VanDerWaalsContact C-N 3.3Å; R92-Q94 PolarHBondContact O-N 3.49Å; Q94-G98 WeakPolarHBondContact O-CA 3.43Å; Q94-G98 PolarHBondContact O-N 2.98Å; Q94-A99 WeakPolarHBondContact CA-O 3.21Å; Q94-A99 VanDerWaalsContact CB-O 3.26Å; Q94-A99 WeakPolarHBondContact CB-O 3.33Å; Q94-A99 VanDerWaalsContact CG-O 3.26Å; Q94-A99 WeakPolarHBondContact CG-O 3.48Å; Q94-A99 PolarHBondContact O-N 2.99Å; Q94-I101 HydrophobicContact CG-CB 3.72Å; Q94-I101 HydrophobicContact CG-CD1 4.08Å; Q94-I101 HydrophobicContact CG-CG1 3.9Å; Q94-I101 PolarHBondContact OE1-O 2.78Å |
| 95 | E | 95.8 | Very high | 95.3 | Very high | 157 Ų | 157 | 60.2 Ų | 60.2 | 73% | 0.734 | 31% | 0.31 | S | S | * | . | H | α-helix | trans | -67.6 | -46.4 | 175.9 | -71.6 | 166.8 | -169.1 | 0 | 0 | 111.6 | K91 R92 | K91-E95 WeakPolarHBondContact O-CG 3.25Å; K91-E95 PolarHBondContact O-N 2.67Å; R92-E95 PolarHBondContact O-N 2.96Å; R92-E95 VanDerWaalsContact O-N 3.14Å |
| 96 | E | 94.7 | Very high | 95.2 | Very high | 97 Ų | 97 | 62.3 Ų | 62.3 | 45% | 0.453 | 31% | 0.309 | S | S | . | . | H | α-helix | trans | -68.6 | -33.8 | 179.6 | -72 | 175.3 | 153.1 | 0 | 0 | 113.1 | R92 | R92-E96 HydrophobicContact CG-CG 4.22Å; R92-E96 IonicContact CZ-OE1 2.64Å; R92-E96 VanDerWaalsContact NE-CD 3.32Å; R92-E96 IonicContact NE-OE1 3.53Å; R92-E96 PolarHBondContact NE-OE1 3.38Å; R92-E96 IonicContact NE-OE2 3.19Å; R92-E96 PolarHBondContact NE-OE2 3.01Å; R92-E96 IonicContact NH2-OE1 2.62Å; R92-E96 PolarHBondContact NH2-OE1 2.87Å; R92-E96 IonicContact NH2-OE2 2.74Å; R92-E96 WeakPolarHBondContact O-CB 3.32Å; R92-E96 WeakPolarHBondContact O-CG 3.48Å; R92-E96 PolarHBondContact O-N 2.86Å |
| 97 | T | 94.4 | Very high | 95.2 | Very high | 5 Ų | 5 | 54.7 Ų | 54.7 | 3% | 0.031 | 28% | 0.283 | C | S | . | . | H | α-helix | trans | -91.7 | -17.5 | -179.3 | 61.6 | 0 | 0 | 0 | 0 | 113.5 | L93 A99 A153 E156 | L93-T97 HydrophobicContact CD1-CG2 4.02Å; L93-T97 VanDerWaalsContact O-CB 3.32Å; L93-T97 WeakPolarHBondContact O-CB 3.21Å; L93-T97 WeakPolarHBondContact O-CG2 3.43Å; L93-T97 PolarHBondContact O-N 3.18Å; L93-T97 VanDerWaalsContact O-N 3.15Å; L93-T97 PolarHBondContact O-OG1 3.15Å; T97-A99 PolarHBondContact O-N 3.19Å; T97-A99 WeakPolarHBondContact OG1-CB 3.5Å; T97-A99 PolarHBondContact OG1-N 3.5Å; T97-A153 HydrophobicContact CG2-CB 4.05Å; T97-E156 HydrophobicContact CG2-CB 4.4Å; T97-E156 HydrophobicContact CG2-CG 4.24Å |
| 98 | G | 93.4 | Very high | 95.1 | Very high | 37 Ų | 37 | 55.5 Ų | 55.5 | 38% | 0.381 | 29% | 0.287 | S | S | . | . | trans | 61.8 | 19 | -170 | 0 | 0 | 0 | 0 | 0 | 113.5 | Q94 | Q94-G98 WeakPolarHBondContact O-CA 3.43Å; Q94-G98 PolarHBondContact O-N 2.98Å | ||
| 99 | A | 96.2 | Very high | 95 | Very high | 5 Ų | 5 | 55.9 Ų | 55.9 | 4% | 0.041 | 28% | 0.283 | C | S | . | . | trans | -107.7 | 149.6 | 179.4 | 0 | 0 | 0 | 0 | 0 | 110.5 | Q94 T97 I101 I137 V139 A153 | Q94-A99 WeakPolarHBondContact CA-O 3.21Å; Q94-A99 VanDerWaalsContact CB-O 3.26Å; Q94-A99 WeakPolarHBondContact CB-O 3.33Å; Q94-A99 VanDerWaalsContact CG-O 3.26Å; Q94-A99 WeakPolarHBondContact CG-O 3.48Å; Q94-A99 PolarHBondContact O-N 2.99Å; T97-A99 PolarHBondContact O-N 3.19Å; T97-A99 WeakPolarHBondContact OG1-CB 3.5Å; T97-A99 PolarHBondContact OG1-N 3.5Å; A99-I101 HydrophobicContact CB-CG1 4.32Å; A99-I137 HydrophobicContact CB-CG2 3.94Å; A99-V139 HydrophobicContact CB-CG2 3.62Å; A99-A153 HydrophobicContact CB-CB 3.79Å | ||
| 100 | K | 96.3 | Very high | 94.7 | Very high | 109 Ų | 109 | 65.5 Ų | 65.5 | 47% | 0.474 | 32% | 0.315 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -91.6 | 118.8 | 171.4 | 176.6 | -178.4 | 162.4 | -155.3 | 0 | 108.9 | I137 E138 | K100-I137 WeakPolarHBondContact O-CA 3.26Å; K100-E138 HydrophobicContact CB-CB 4.34Å; K100-E138 WeakPolarHBondContact CB-O 3.35Å; K100-E138 PolarHBondContact N-O 3.15Å; K100-E138 IonicContact NZ-OE2 3.65Å; K100-E138 PolarHBondContact NZ-OE2 3.14Å; K100-E138 PolarHBondContact O-N 2.63Å |
| 101 | I | 96.5 | Very high | 94.6 | Very high | 5 Ų | 5 | 68 Ų | 68 | 3% | 0.026 | 33% | 0.328 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -118.3 | 129.3 | -171.5 | -58.4 | 170.4 | 0 | 0 | 0 | 108.4 | I90 L93 Q94 A99 V135 F136 I137 V157 | I90-I101 HydrophobicContact CD1-CG2 4.17Å; I90-I101 HydrophobicContact CG1-CB 4.44Å; I90-I101 HydrophobicContact CG1-CG2 4.31Å; L93-I101 HydrophobicContact CD2-CD1 3.81Å; L93-I101 HydrophobicContact CG-CD1 3.63Å; Q94-I101 HydrophobicContact CG-CB 3.72Å; Q94-I101 HydrophobicContact CG-CD1 4.08Å; Q94-I101 HydrophobicContact CG-CG1 3.9Å; Q94-I101 PolarHBondContact OE1-O 2.78Å; A99-I101 HydrophobicContact CB-CG1 4.32Å; I101-V135 HydrophobicContact CG2-CG1 3.47Å; I101-V135 VanDerWaalsContact CG2-CG1 3.47Å; I101-F136 WeakPolarHBondContact CA-O 3.47Å; I101-I137 HydrophobicContact CG1-CG2 4.4Å; I101-V157 HydrophobicContact CD1-CG2 4.31Å |
| 102 | S | 95.6 | Very high | 94.4 | Very high | 38 Ų | 38 | 69.7 Ų | 69.7 | 27% | 0.266 | 34% | 0.335 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -140.6 | 127.1 | -178.2 | -63.9 | 0 | 0 | 0 | 0 | 110.2 | F136 | S102-F136 PolarHBondContact N-O 2.79Å; S102-F136 WeakPolarHBondContact O-CB 3.4Å; S102-F136 PolarHBondContact O-N 3.26Å |
| 103 | V | 96 | Very high | 94.2 | Very high | 20 Ų | 20 | 68.6 Ų | 68.6 | 12% | 0.121 | 34% | 0.341 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -76.7 | 130.1 | 169 | -172.3 | 0 | 0 | 0 | 0 | 107.8 | I68 V79 I90 S108 L133 | I68-V103 HydrophobicContact CD1-CG1 4.35Å; V79-V103 HydrophobicContact CG1-CG1 4.26Å; V79-V103 HydrophobicContact CG2-CG1 4.1Å; I90-V103 HydrophobicContact CD1-CG2 4.45Å; V103-S108 VanDerWaalsContact C-OG 3.3Å; V103-S108 PolarHBondContact O-OG 2.8Å; V103-S108 VanDerWaalsContact O-OG 3.07Å; V103-L133 HydrophobicContact CG1-CD1 4.02Å |
| 104 | L | 95.3 | Very high | 94.1 | Very high | 40 Ų | 40 | 73.7 Ų | 73.7 | 21% | 0.209 | 36% | 0.363 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -140.8 | 171.1 | -179 | -63.3 | 178.3 | 0 | 0 | 0 | 109.9 | H128 H134 F136 | L104-H128 HydrophobicContact CB-CB 4.36Å; L104-H134 PolarHBondContact N-O 2.91Å; L104-H134 PolarHBondContact O-N 2.9Å; L104-F136 HydrophobicContact CD1-CB 3.74Å; L104-F136 HydrophobicContact CD1-CD1 4.21Å; L104-F136 HydrophobicContact CD1-CG 4.05Å; L104-F136 HydrophobicContact CG-CB 4.32Å |
| 105 | G | 95.1 | Very high | 93.9 | Very high | 0 Ų | 0 | 71.7 Ų | 71.7 | 0% | 0 | 35% | 0.354 | C | S | . | . | S | Bend | trans | 99.5 | 179.4 | 179.8 | 0 | 0 | 0 | 0 | 0 | 114 | G107 S108 H128 | G105-G107 PolarHBondContact O-N 2.81Å; G105-S108 WeakPolarHBondContact O-CB 3.43Å; G105-S108 PolarHBondContact O-N 3.03Å; G105-S108 VanDerWaalsContact O-N 3.12Å; G105-H128 WeakPolarHBondContact CA-O 2.86Å |
| 106 | K | 93.3 | Very high | 93.6 | Very high | 143 Ų | 143 | 68.3 Ų | 68.3 | 62% | 0.622 | 34% | 0.338 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -62.6 | 125.5 | 177.9 | -178.1 | -176.6 | 177.7 | -176.5 | 0 | 111.5 | E115 M131 L133 | K106-E115 WeakPolarHBondContact CA-OE1 3.21Å; K106-M131 WeakPolarHBondContact CB-O 3.09Å; K106-M131 PolarHBondContact N-O 3.24Å; K106-L133 WeakPolarHBondContact O-CB 3.3Å |
| 107 | G | 90.9 | Very high | 93.5 | Very high | 34 Ų | 34 | 70.1 Ų | 70.1 | 35% | 0.351 | 35% | 0.347 | S | S | . | . | T | Hydrogen-bonded Turn | trans | 84.8 | 9.1 | -174.3 | 0 | 0 | 0 | 0 | 0 | 114.3 | G105 M109 E115 | G105-G107 PolarHBondContact O-N 2.81Å; G107-M109 VanDerWaalsContact C-N 3.35Å; G107-E115 VanDerWaalsContact CA-OE2 3.24Å; G107-E115 WeakPolarHBondContact CA-OE2 3.46Å; G107-E115 PolarHBondContact N-OE1 3.24Å; G107-E115 PolarHBondContact N-OE2 2.89Å |
| 108 | S | 92.7 | Very high | 93.3 | Very high | 29 Ų | 29 | 72.1 Ų | 72.1 | 20% | 0.203 | 36% | 0.357 | C | S | . | . | trans | -78.1 | -19.6 | 175.7 | -173.3 | 0 | 0 | 0 | 0 | 112.8 | V103 G105 E115 | V103-S108 VanDerWaalsContact C-OG 3.3Å; V103-S108 PolarHBondContact O-OG 2.8Å; V103-S108 VanDerWaalsContact O-OG 3.07Å; G105-S108 WeakPolarHBondContact O-CB 3.43Å; G105-S108 PolarHBondContact O-N 3.03Å; G105-S108 VanDerWaalsContact O-N 3.12Å; S108-E115 PolarHBondContact N-OE2 3.05Å | ||
| 109 | M | 92.6 | Very high | 93.1 | Very high | 66 Ų | 66 | 75.8 Ų | 75.8 | 33% | 0.325 | 36% | 0.359 | S | S | . | . | S | Bend | trans | -91.1 | 146.1 | 175.8 | -64.6 | -172.9 | 65.8 | 0 | 0 | 111.2 | G107 D111 E115 L118 L129 | G107-M109 VanDerWaalsContact C-N 3.35Å; M109-D111 VanDerWaalsContact C-N 3.29Å; M109-D111 PolarHBondContact O-N 2.78Å; M109-E115 HydrophobicContact CB-CB 4.07Å; M109-E115 HydrophobicContact CB-CG 4.11Å; M109-E115 HydrophobicContact CG-CB 4.37Å; M109-E115 HydrophobicContact CG-CG 4.07Å; M109-E115 PolarHBondContact N-OE2 3.29Å; M109-E115 HydrophobicContact SD-CB 4.06Å; M109-E115 HydrophobicContact SD-CG 4Å; M109-L118 HydrophobicContact CE-CD1 3.88Å; M109-L118 HydrophobicContact SD-CD1 3.94Å; M109-L129 HydrophobicContact CG-CD2 4.5Å; M109-L129 HydrophobicContact SD-CD1 4.29Å |
| 110 | R | 90.2 | Very high | 92.8 | Very high | 242 Ų | 242 | 82.4 Ų | 82.4 | 91% | 0.913 | 39% | 0.387 | S | S | * | . | S | Bend | trans | -59.3 | -40.7 | 174.4 | -174.7 | 178.3 | -177.3 | 172.1 | 1.9 | 112.2 | ||
| 111 | D | 93.3 | Very high | 92.4 | Very high | 68 Ų | 68 | 79.9 Ų | 79.9 | 36% | 0.364 | 39% | 0.392 | S | S | . | . | trans | -101.8 | 93.9 | -174.2 | -63.9 | -15.7 | 0 | 0 | 0 | 110.8 | M109 N113 K114 E115 | M109-D111 VanDerWaalsContact C-N 3.29Å; M109-D111 PolarHBondContact O-N 2.78Å; D111-N113 VanDerWaalsContact C-N 3.26Å; D111-N113 PolarHBondContact O-N 2.84Å; D111-K114 HydrophobicContact CB-CB 4.15Å; D111-K114 HydrophobicContact CB-CD 3.84Å; D111-K114 HydrophobicContact CB-CG 4.05Å; D111-K114 PolarHBondContact O-N 3.13Å; D111-K114 WeakPolarHBondContact OD2-CD 3.42Å; D111-K114 WeakPolarHBondContact OD2-CE 3.36Å; D111-K114 IonicContact OD2-NZ 2.67Å; D111-K114 PolarHBondContact OD2-NZ 3.33Å; D111-E115 PolarHBondContact O-N 3.35Å | ||
| 112 | K | 91.7 | Very high | 91.8 | Very high | 156 Ų | 156 | 82.9 Ų | 82.9 | 68% | 0.678 | 42% | 0.424 | S | S | * | . | H | α-helix | trans | -56.4 | -34.8 | -175.9 | -63.2 | 179.1 | -178.7 | 176.8 | 0 | 114.2 | E115 E116 | K112-E115 WeakPolarHBondContact O-CB 3.42Å; K112-E115 PolarHBondContact O-N 2.84Å; K112-E116 PolarHBondContact O-N 3.49Å; K112-E116 VanDerWaalsContact O-N 3.11Å |
| 113 | N | 92.6 | Very high | 91.4 | Very high | 133 Ų | 133 | 85.8 Ų | 85.8 | 71% | 0.711 | 43% | 0.434 | S | S | * | . | H | α-helix | trans | -67.5 | -45.6 | -179.8 | -61.9 | 7.3 | 0 | 0 | 0 | 111.2 | D111 E115 E116 E117 | D111-N113 VanDerWaalsContact C-N 3.26Å; D111-N113 PolarHBondContact O-N 2.84Å; N113-E115 VanDerWaalsContact C-N 3.3Å; N113-E115 PolarHBondContact O-N 3.48Å; N113-E116 PolarHBondContact O-N 2.94Å; N113-E117 PolarHBondContact O-N 3.28Å; N113-E117 VanDerWaalsContact O-N 3.11Å |
| 114 | K | 92.6 | Very high | 91 | Very high | 110 Ų | 110 | 90.2 Ų | 90.2 | 48% | 0.478 | 47% | 0.465 | S | S | . | . | H | α-helix | trans | -64.2 | -37.3 | 175.6 | -62.4 | 179.5 | -172.7 | 159.8 | 0 | 111.2 | D111 E116 E117 L118 | D111-K114 HydrophobicContact CB-CB 4.15Å; D111-K114 HydrophobicContact CB-CD 3.84Å; D111-K114 HydrophobicContact CB-CG 4.05Å; D111-K114 PolarHBondContact O-N 3.13Å; D111-K114 WeakPolarHBondContact OD2-CD 3.42Å; D111-K114 WeakPolarHBondContact OD2-CE 3.36Å; D111-K114 IonicContact OD2-NZ 2.67Å; D111-K114 PolarHBondContact OD2-NZ 3.33Å; K114-E116 VanDerWaalsContact C-N 3.32Å; K114-E116 PolarHBondContact O-N 3.25Å; K114-E117 PolarHBondContact O-N 2.94Å; K114-L118 WeakPolarHBondContact O-CB 3.32Å; K114-L118 VanDerWaalsContact O-CG 3.28Å; K114-L118 WeakPolarHBondContact O-CG 3.37Å; K114-L118 PolarHBondContact O-N 2.84Å |
| 115 | E | 92.3 | Very high | 90.7 | Very high | 12 Ų | 12 | 94.9 Ų | 94.9 | 6% | 0.056 | 48% | 0.484 | C | S | . | . | H | α-helix | trans | -57.9 | -44.6 | 174.3 | -163 | -171.9 | 101.2 | 0 | 0 | 111.6 | K106 G107 S108 M109 D111 K112 N113 L118 R119 L129 | K106-E115 WeakPolarHBondContact CA-OE1 3.21Å; G107-E115 VanDerWaalsContact CA-OE2 3.24Å; G107-E115 WeakPolarHBondContact CA-OE2 3.46Å; G107-E115 PolarHBondContact N-OE1 3.24Å; G107-E115 PolarHBondContact N-OE2 2.89Å; S108-E115 PolarHBondContact N-OE2 3.05Å; M109-E115 HydrophobicContact CB-CB 4.07Å; M109-E115 HydrophobicContact CB-CG 4.11Å; M109-E115 HydrophobicContact CG-CB 4.37Å; M109-E115 HydrophobicContact CG-CG 4.07Å; M109-E115 PolarHBondContact N-OE2 3.29Å; M109-E115 HydrophobicContact SD-CB 4.06Å; M109-E115 HydrophobicContact SD-CG 4Å; D111-E115 PolarHBondContact O-N 3.35Å; K112-E115 WeakPolarHBondContact O-CB 3.42Å; K112-E115 PolarHBondContact O-N 2.84Å; N113-E115 VanDerWaalsContact C-N 3.3Å; N113-E115 PolarHBondContact O-N 3.48Å; E115-L118 PolarHBondContact O-N 3.1Å; E115-R119 VanDerWaalsContact O-CB 3.28Å; E115-R119 WeakPolarHBondContact O-CB 3.47Å; E115-R119 PolarHBondContact O-N 3.17Å; E115-L129 HydrophobicContact CG-CD1 3.8Å; E115-L129 HydrophobicContact CG-CD2 3.7Å; E115-L129 HydrophobicContact CG-CG 4.24Å |
| 116 | E | 91.2 | Very high | 90.5 | Very high | 86 Ų | 86 | 97 Ų | 97 | 40% | 0.402 | 49% | 0.492 | S | S | . | . | H | α-helix | trans | -70.3 | -35.5 | 179.6 | -164 | 179.7 | 164.9 | 0 | 0 | 113 | K112 N113 K114 R119 K120 | K112-E116 PolarHBondContact O-N 3.49Å; K112-E116 VanDerWaalsContact O-N 3.11Å; N113-E116 PolarHBondContact O-N 2.94Å; K114-E116 VanDerWaalsContact C-N 3.32Å; K114-E116 PolarHBondContact O-N 3.25Å; E116-R119 IonicContact OE1-NH2 2.69Å; E116-K120 HydrophobicContact CG-CD 4.42Å; E116-K120 WeakPolarHBondContact O-CG 3.37Å; E116-K120 PolarHBondContact O-N 3.04Å; E116-K120 WeakPolarHBondContact OE1-CE 3.18Å; E116-K120 IonicContact OE1-NZ 2.7Å; E116-K120 PolarHBondContact OE1-NZ 2.97Å |
| 117 | E | 92.2 | Very high | 90.4 | Very high | 135 Ų | 135 | 93.2 Ų | 93.2 | 63% | 0.631 | 49% | 0.487 | S | S | * | . | H | α-helix | trans | -61.7 | -50.1 | 172 | -71.2 | 169.9 | -179.2 | 0 | 0 | 111.4 | N113 K114 R119 K120 G121 | N113-E117 PolarHBondContact O-N 3.28Å; N113-E117 VanDerWaalsContact O-N 3.11Å; K114-E117 PolarHBondContact O-N 2.94Å; E117-R119 VanDerWaalsContact C-N 3.32Å; E117-R119 PolarHBondContact O-N 3.01Å; E117-K120 CarbonylContact O-C 3.58Å; E117-K120 PolarHBondContact O-N 2.91Å; E117-K120 VanDerWaalsContact O-N 3.08Å; E117-G121 PolarHBondContact O-N 2.88Å |
| 118 | L | 90.1 | Very high | 90.5 | Very high | 46 Ų | 46 | 93.8 Ų | 93.8 | 24% | 0.241 | 48% | 0.481 | C | S | . | . | H | α-helix | trans | -64.2 | -35.3 | 178.5 | -67.6 | 176.9 | 0 | 0 | 0 | 112.5 | M109 K114 E115 K120 G121 Y126 L129 | M109-L118 HydrophobicContact CE-CD1 3.88Å; M109-L118 HydrophobicContact SD-CD1 3.94Å; K114-L118 WeakPolarHBondContact O-CB 3.32Å; K114-L118 VanDerWaalsContact O-CG 3.28Å; K114-L118 WeakPolarHBondContact O-CG 3.37Å; K114-L118 PolarHBondContact O-N 2.84Å; E115-L118 PolarHBondContact O-N 3.1Å; L118-K120 VanDerWaalsContact C-N 3.33Å; L118-G121 PolarHBondContact O-N 3.33Å; L118-Y126 HydrophobicContact CB-CD2 3.91Å; L118-Y126 HydrophobicContact CB-CE2 4.36Å; L118-Y126 HydrophobicContact CB-CG 4.03Å; L118-Y126 HydrophobicContact CD1-CD1 4.3Å; L118-Y126 HydrophobicContact CD1-CD2 4.34Å; L118-Y126 HydrophobicContact CD1-CE1 4Å; L118-Y126 HydrophobicContact CD1-CE2 4.06Å; L118-Y126 HydrophobicContact CD1-CG 4.48Å; L118-Y126 HydrophobicContact CD2-CD2 3.97Å; L118-Y126 HydrophobicContact CD2-CE2 3.66Å; L118-Y126 HydrophobicContact CG-CD2 4.29Å; L118-Y126 HydrophobicContact CG-CE2 4.24Å; L118-L129 HydrophobicContact CB-CD1 4Å |
| 119 | R | 89.8 | Confident | 90.5 | Very high | 115 Ų | 115 | 92.4 Ų | 92.4 | 43% | 0.434 | 47% | 0.471 | S | S | . | . | H | α-helix | trans | -64.7 | -35 | 172.5 | -171.5 | -176.4 | 69.1 | 97.6 | 0.1 | 112.3 | E115 E116 E117 L129 | E115-R119 VanDerWaalsContact O-CB 3.28Å; E115-R119 WeakPolarHBondContact O-CB 3.47Å; E115-R119 PolarHBondContact O-N 3.17Å; E116-R119 IonicContact OE1-NH2 2.69Å; E117-R119 VanDerWaalsContact C-N 3.32Å; E117-R119 PolarHBondContact O-N 3.01Å; R119-L129 HydrophobicContact CB-CB 4.05Å; R119-L129 HydrophobicContact CB-CD1 4.4Å; R119-L129 WeakPolarHBondContact CD-O 3.37Å; R119-L129 HydrophobicContact CG-CB 4.13Å |
| 120 | K | 89.6 | Confident | 90.4 | Very high | 144 Ų | 144 | 93.1 Ų | 93.1 | 63% | 0.626 | 49% | 0.487 | S | S | * | . | H | α-helix | trans | -78.9 | -27 | 175.5 | -73.4 | 169.7 | -175.7 | 164.1 | 0 | 112.9 | E116 E117 L118 G122 | E116-K120 HydrophobicContact CG-CD 4.42Å; E116-K120 WeakPolarHBondContact O-CG 3.37Å; E116-K120 PolarHBondContact O-N 3.04Å; E116-K120 WeakPolarHBondContact OE1-CE 3.18Å; E116-K120 IonicContact OE1-NZ 2.7Å; E116-K120 PolarHBondContact OE1-NZ 2.97Å; E117-K120 CarbonylContact O-C 3.58Å; E117-K120 PolarHBondContact O-N 2.91Å; E117-K120 VanDerWaalsContact O-N 3.08Å; L118-K120 VanDerWaalsContact C-N 3.33Å; K120-G122 PolarHBondContact O-N 2.6Å |
| 121 | G | 86.9 | Confident | 90.6 | Very high | 56 Ų | 56 | 84.9 Ų | 84.9 | 58% | 0.577 | 46% | 0.46 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -65.2 | -15.2 | 177.7 | 0 | 0 | 0 | 0 | 0 | 114.9 | E117 L118 E123 | E117-G121 PolarHBondContact O-N 2.88Å; L118-G121 PolarHBondContact O-N 3.33Å; G121-E123 PolarHBondContact O-N 2.71Å |
| 122 | G | 83.9 | Confident | 90.6 | Very high | 68 Ų | 68 | 86.5 Ų | 86.5 | 70% | 0.701 | 47% | 0.465 | S | S | * | . | T | Hydrogen-bonded Turn | trans | 72.2 | 7.3 | 171.3 | 0 | 0 | 0 | 0 | 0 | 115.6 | K120 S124 | K120-G122 PolarHBondContact O-N 2.6Å; G122-S124 PolarHBondContact O-N 3.26Å |
| 123 | E | 87.9 | Confident | 90.8 | Very high | 99 Ų | 99 | 79.8 Ų | 79.8 | 46% | 0.463 | 44% | 0.437 | S | S | . | . | trans | -63.6 | 130.4 | 177.8 | -64 | -179 | -152 | 0 | 0 | 111.5 | G121 K125 Y126 A127 | G121-E123 PolarHBondContact O-N 2.71Å; E123-K125 PolarHBondContact O-N 3.23Å; E123-K125 VanDerWaalsContact O-N 3.09Å; E123-Y126 HydrophobicContact CB-CD2 3.92Å; E123-Y126 HydrophobicContact CG-CD2 4.4Å; E123-Y126 CarbonylContact O-C 3.18Å; E123-Y126 PolarHBondContact O-N 2.84Å; E123-Y126 WeakPolarHBondContact OE2-CE2 3.32Å; E123-A127 PolarHBondContact O-N 2.89Å | ||
| 124 | S | 87.8 | Confident | 90.9 | Very high | 112 Ų | 112 | 73.7 Ų | 73.7 | 78% | 0.783 | 40% | 0.404 | S | S | * | . | G | 310 helix | trans | -53.8 | -33.7 | 177.6 | -178.1 | 0 | 0 | 0 | 0 | 113 | G122 Y126 A127 | G122-S124 PolarHBondContact O-N 3.26Å; S124-Y126 PolarHBondContact O-N 3.2Å; S124-A127 VanDerWaalsContact O-CB 3.32Å; S124-A127 WeakPolarHBondContact O-CB 3.36Å; S124-A127 PolarHBondContact O-N 3.06Å |
| 125 | K | 88.9 | Confident | 91.1 | Very high | 139 Ų | 139 | 68.5 Ų | 68.5 | 60% | 0.604 | 38% | 0.381 | S | S | * | . | G | 310 helix | trans | -54.9 | -37.4 | 173.7 | -174.4 | -173.5 | 175.2 | -161.7 | 0 | 112.8 | E123 H128 | E123-K125 PolarHBondContact O-N 3.23Å; E123-K125 VanDerWaalsContact O-N 3.09Å; K125-H128 PolarHBondContact O-CE1 3.2Å; K125-H128 PolarHBondContact O-ND1 3.24Å |
| 126 | Y | 90.4 | Very high | 91.4 | Very high | 45 Ų | 45 | 69.3 Ų | 69.3 | 18% | 0.176 | 39% | 0.385 | C | S | . | . | G | 310 helix | trans | -103.2 | 8.4 | -177 | -57.8 | -57.9 | 0 | 0 | 0 | 113.4 | L118 E123 S124 H128 L129 | L118-Y126 HydrophobicContact CB-CD2 3.91Å; L118-Y126 HydrophobicContact CB-CE2 4.36Å; L118-Y126 HydrophobicContact CB-CG 4.03Å; L118-Y126 HydrophobicContact CD1-CD1 4.3Å; L118-Y126 HydrophobicContact CD1-CD2 4.34Å; L118-Y126 HydrophobicContact CD1-CE1 4Å; L118-Y126 HydrophobicContact CD1-CE2 4.06Å; L118-Y126 HydrophobicContact CD1-CG 4.48Å; L118-Y126 HydrophobicContact CD2-CD2 3.97Å; L118-Y126 HydrophobicContact CD2-CE2 3.66Å; L118-Y126 HydrophobicContact CG-CD2 4.29Å; L118-Y126 HydrophobicContact CG-CE2 4.24Å; E123-Y126 HydrophobicContact CB-CD2 3.92Å; E123-Y126 HydrophobicContact CG-CD2 4.4Å; E123-Y126 CarbonylContact O-C 3.18Å; E123-Y126 PolarHBondContact O-N 2.84Å; E123-Y126 WeakPolarHBondContact OE2-CE2 3.32Å; S124-Y126 PolarHBondContact O-N 3.2Å; Y126-H128 PolarHBondContact O-N 3.29Å; Y126-L129 HydrophobicContact CD1-CD1 4.27Å; Y126-L129 HydrophobicContact CG-CD1 4.29Å; Y126-L129 VanDerWaalsContact O-CB 3.3Å; Y126-L129 WeakPolarHBondContact O-CB 3.39Å; Y126-L129 WeakPolarHBondContact O-CG 3.3Å; Y126-L129 PolarHBondContact O-N 3.11Å |
| 127 | A | 91.4 | Very high | 91.6 | Very high | 62 Ų | 62 | 65.2 Ų | 65.2 | 51% | 0.512 | 37% | 0.366 | S | S | . | . | G | 310 helix | trans | -55.2 | -28.3 | 176.7 | 0 | 0 | 0 | 0 | 0 | 113.2 | E123 S124 L129 A130 | E123-A127 PolarHBondContact O-N 2.89Å; S124-A127 VanDerWaalsContact O-CB 3.32Å; S124-A127 WeakPolarHBondContact O-CB 3.36Å; S124-A127 PolarHBondContact O-N 3.06Å; A127-L129 PolarHBondContact O-N 3.13Å; A127-A130 PolarHBondContact O-N 3.11Å |
| 128 | H | 91.9 | Very high | 91.8 | Very high | 46 Ų | 46 | 60 Ų | 60 | 21% | 0.213 | 34% | 0.342 | C | S | . | . | G | 310 helix | trans | -62.1 | -25.2 | 174.4 | 63.4 | -95.7 | 0 | 0 | 0 | 113.6 | L104 G105 K125 Y126 A130 M131 | L104-H128 HydrophobicContact CB-CB 4.36Å; G105-H128 WeakPolarHBondContact CA-O 2.86Å; K125-H128 PolarHBondContact O-CE1 3.2Å; K125-H128 PolarHBondContact O-ND1 3.24Å; Y126-H128 PolarHBondContact O-N 3.29Å; H128-A130 PolarHBondContact O-N 3.12Å; H128-M131 WeakPolarHBondContact O-CB 3.45Å; H128-M131 PolarHBondContact O-N 2.94Å |
| 129 | L | 92.8 | Very high | 92.2 | Very high | 1 Ų | 1 | 57.9 Ų | 57.9 | 1% | 0.005 | 33% | 0.33 | C | S | . | . | G | 310 helix | trans | -67.2 | -13.6 | 178.1 | -59.4 | -178.6 | 0 | 0 | 0 | 113.5 | M109 E115 L118 R119 Y126 A127 M131 | M109-L129 HydrophobicContact CG-CD2 4.5Å; M109-L129 HydrophobicContact SD-CD1 4.29Å; E115-L129 HydrophobicContact CG-CD1 3.8Å; E115-L129 HydrophobicContact CG-CD2 3.7Å; E115-L129 HydrophobicContact CG-CG 4.24Å; L118-L129 HydrophobicContact CB-CD1 4Å; R119-L129 HydrophobicContact CB-CB 4.05Å; R119-L129 HydrophobicContact CB-CD1 4.4Å; R119-L129 WeakPolarHBondContact CD-O 3.37Å; R119-L129 HydrophobicContact CG-CB 4.13Å; Y126-L129 HydrophobicContact CD1-CD1 4.27Å; Y126-L129 HydrophobicContact CG-CD1 4.29Å; Y126-L129 VanDerWaalsContact O-CB 3.3Å; Y126-L129 WeakPolarHBondContact O-CB 3.39Å; Y126-L129 WeakPolarHBondContact O-CG 3.3Å; Y126-L129 PolarHBondContact O-N 3.11Å; A127-L129 PolarHBondContact O-N 3.13Å; L129-M131 VanDerWaalsContact C-N 3.33Å |
| 130 | A | 91.4 | Very high | 92.4 | Very high | 80 Ų | 80 | 55.5 Ų | 55.5 | 66% | 0.661 | 33% | 0.329 | S | S | * | . | G | 310 helix | trans | -78 | -18.2 | 170.4 | 0 | 0 | 0 | 0 | 0 | 113.1 | A127 H128 | A127-A130 PolarHBondContact O-N 3.11Å; H128-A130 PolarHBondContact O-N 3.12Å |
| 131 | M | 93 | Very high | 92.6 | Very high | 69 Ų | 69 | 48.8 Ų | 48.8 | 34% | 0.34 | 30% | 0.3 | S | S | . | . | S | Bend | trans | -85.7 | 161.2 | -180 | -55.5 | -177.8 | 61.9 | 0 | 0 | 111.6 | K106 H128 L129 | K106-M131 WeakPolarHBondContact CB-O 3.09Å; K106-M131 PolarHBondContact N-O 3.24Å; H128-M131 WeakPolarHBondContact O-CB 3.45Å; H128-M131 PolarHBondContact O-N 2.94Å; L129-M131 VanDerWaalsContact C-N 3.33Å |
| 132 | E | 94.1 | Very high | 92.8 | Very high | 102 Ų | 102 | 48.5 Ų | 48.5 | 48% | 0.477 | 29% | 0.288 | S | S | . | . | P | Polyproline II helix | trans | -65.6 | 160 | 170.5 | -56.9 | -155.2 | 155.4 | 0 | 0 | 111.7 | L67 K71 H134 | L67-E132 HydrophobicContact CD2-CB 4.07Å; K71-E132 WeakPolarHBondContact CE-OE1 3.34Å; K71-E132 IonicContact NZ-OE1 2.72Å; K71-E132 PolarHBondContact NZ-OE1 3.49Å; K71-E132 IonicContact NZ-OE2 3.79Å; K71-E132 PolarHBondContact NZ-OE2 2.62Å; E132-H134 PolarHBondContact O-N 3.27Å; E132-H134 PolarHBondContact O-ND1 3Å |
| 133 | L | 95.5 | Very high | 93.1 | Very high | 16 Ų | 16 | 46.1 Ų | 46.1 | 8% | 0.084 | 26% | 0.259 | C | S | . | . | S | Bend | trans | -60.5 | 120.6 | 179.2 | -170.3 | 70.7 | 0 | 0 | 0 | 110.9 | I68 T70 V79 V103 K106 | I68-L133 HydrophobicContact CB-CD2 4.05Å; I68-L133 HydrophobicContact CB-CG 4.21Å; I68-L133 HydrophobicContact CD1-CD2 4.03Å; I68-L133 HydrophobicContact CD1-CG 3.99Å; I68-L133 HydrophobicContact CG1-CD2 4.46Å; I68-L133 HydrophobicContact CG1-CG 4.3Å; I68-L133 HydrophobicContact CG2-CD2 4.11Å; I68-L133 PolarHBondContact N-O 3.28Å; T70-L133 HydrophobicContact CG2-CD2 3.63Å; V79-L133 HydrophobicContact CG2-CD1 4.2Å; V79-L133 HydrophobicContact CG2-CD2 3.76Å; V79-L133 HydrophobicContact CG2-CG 4.48Å; V103-L133 HydrophobicContact CG1-CD1 4.02Å; K106-L133 WeakPolarHBondContact O-CB 3.3Å |
| 134 | H | 95.9 | Very high | 93.3 | Very high | 5 Ų | 5 | 45.6 Ų | 45.6 | 2% | 0.023 | 26% | 0.264 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -143.8 | 153.9 | -177.6 | 63 | -81 | 0 | 0 | 0 | 112.1 | V66 L67 L104 E132 | V66-H134 CarbonylContact O-C 3.59Å; V66-H134 WeakPolarHBondContact O-CA 3.44Å; V66-H134 VanDerWaalsContact O-CB 3.32Å; V66-H134 WeakPolarHBondContact O-CB 3.48Å; L67-H134 HydrophobicContact CD2-CB 4.49Å; L104-H134 PolarHBondContact N-O 2.91Å; L104-H134 PolarHBondContact O-N 2.9Å; E132-H134 PolarHBondContact O-N 3.27Å; E132-H134 PolarHBondContact O-ND1 3Å |
| 135 | V | 96.7 | Very high | 93.5 | Very high | 0 Ų | 0 | 44.4 Ų | 44.4 | 0% | 0 | 25% | 0.246 | C | C | . | . | E | Extended strand (participates in β ladder) | trans | -87 | 126.6 | 162.7 | -173.7 | 0 | 0 | 0 | 0 | 107.6 | R65 V66 I68 L82 I101 I137 V157 | R65-V135 WeakPolarHBondContact CA-O 3.32Å; V66-V135 HydrophobicContact CB-CB 4.43Å; V66-V135 PolarHBondContact N-O 2.88Å; V66-V135 PolarHBondContact O-N 3.48Å; I68-V135 HydrophobicContact CD1-CG2 3.83Å; I68-V135 HydrophobicContact CG1-CG2 4.04Å; L82-V135 HydrophobicContact CD1-CG2 3.7Å; I101-V135 HydrophobicContact CG2-CG1 3.47Å; I101-V135 VanDerWaalsContact CG2-CG1 3.47Å; V135-I137 HydrophobicContact CG1-CG1 4.11Å; V135-V157 HydrophobicContact CB-CG1 4.32Å; V135-V157 HydrophobicContact CG1-CG1 4.27Å; V135-V157 HydrophobicContact CG1-CG2 4.37Å; V135-V157 HydrophobicContact CG2-CG1 4.1Å |
| 136 | F | 97 | Very high | 93.8 | Very high | 29 Ų | 29 | 37.8 Ų | 37.8 | 13% | 0.127 | 22% | 0.218 | C | C | . | . | E | Extended strand (participates in β ladder) | trans | -101.4 | 123.1 | 173 | -179.6 | -109.5 | 0 | 0 | 0 | 109.3 | K63 E64 R65 I101 S102 L104 E138 | K63-F136 HydrophobicContact CB-CE2 4.03Å; K63-F136 HydrophobicContact CB-CZ 4.06Å; K63-F136 HydrophobicContact CD-CZ 4Å; K63-F136 HydrophobicContact CG-CE2 4.4Å; K63-F136 HydrophobicContact CG-CZ 3.92Å; E64-F136 WeakPolarHBondContact O-CA 3.48Å; E64-F136 WeakPolarHBondContact O-CD2 3.25Å; R65-F136 HydrophobicContact CG-CD2 3.85Å; R65-F136 HydrophobicContact CG-CE2 4.44Å; I101-F136 WeakPolarHBondContact CA-O 3.47Å; S102-F136 PolarHBondContact N-O 2.79Å; S102-F136 WeakPolarHBondContact O-CB 3.4Å; S102-F136 PolarHBondContact O-N 3.26Å; L104-F136 HydrophobicContact CD1-CB 3.74Å; L104-F136 HydrophobicContact CD1-CD1 4.21Å; L104-F136 HydrophobicContact CD1-CG 4.05Å; L104-F136 HydrophobicContact CG-CB 4.32Å; F136-E138 HydrophobicContact CE1-CB 3.99Å; F136-E138 HydrophobicContact CZ-CB 4.43Å |
| 137 | I | 97.1 | Very high | 93.9 | Very high | 0 Ų | 0 | 41.4 Ų | 41.4 | 0% | 0 | 23% | 0.232 | C | C | . | . | E | Extended strand (participates in β ladder) | trans | -114.8 | 120.7 | -178.6 | -51.5 | 178.8 | 0 | 0 | 0 | 108 | K63 E64 V66 A99 K100 I101 V135 V139 M150 A153 M154 V157 | K63-I137 CarbonylContact C-O 3.58Å; K63-I137 WeakPolarHBondContact CA-O 3.33Å; E64-I137 PolarHBondContact N-O 3.33Å; E64-I137 PolarHBondContact O-N 3.36Å; V66-I137 HydrophobicContact CG2-CD1 4.18Å; A99-I137 HydrophobicContact CB-CG2 3.94Å; K100-I137 WeakPolarHBondContact O-CA 3.26Å; I101-I137 HydrophobicContact CG1-CG2 4.4Å; V135-I137 HydrophobicContact CG1-CG1 4.11Å; I137-V139 HydrophobicContact CG2-CG2 4.25Å; I137-M150 HydrophobicContact CB-CE 4.47Å; I137-M150 HydrophobicContact CB-SD 3.99Å; I137-M150 HydrophobicContact CG2-CE 4.14Å; I137-M150 HydrophobicContact CG2-SD 3.61Å; I137-A153 HydrophobicContact CD1-CB 4.38Å; I137-A153 HydrophobicContact CG2-CB 3.97Å; I137-M154 HydrophobicContact CD1-CG 4.01Å; I137-V157 HydrophobicContact CD1-CG2 4.17Å |
| 138 | E | 96.7 | Very high | 94.1 | Very high | 27 Ų | 27 | 44.5 Ų | 44.5 | 13% | 0.126 | 24% | 0.239 | C | C | . | . | E | Extended strand (participates in β ladder) | trans | -118.3 | 119.3 | 177.4 | 178.1 | 173.6 | -142.8 | 0 | 0 | 109.3 | L62 K63 K100 F136 | L62-E138 WeakPolarHBondContact O-CA 3.26Å; K63-E138 WeakPolarHBondContact CE-OE1 3.2Å; K63-E138 HydrophobicContact CG-CB 4.49Å; K63-E138 HydrophobicContact CG-CG 4.23Å; K63-E138 IonicContact NZ-OE1 2.74Å; K63-E138 PolarHBondContact NZ-OE1 2.84Å; K63-E138 VanDerWaalsContact NZ-OE1 3.1Å; K100-E138 HydrophobicContact CB-CB 4.34Å; K100-E138 WeakPolarHBondContact CB-O 3.35Å; K100-E138 PolarHBondContact N-O 3.15Å; K100-E138 IonicContact NZ-OE2 3.65Å; K100-E138 PolarHBondContact NZ-OE2 3.14Å; K100-E138 PolarHBondContact O-N 2.63Å; F136-E138 HydrophobicContact CE1-CB 3.99Å; F136-E138 HydrophobicContact CZ-CB 4.43Å |
| 139 | V | 96.6 | Very high | 94.3 | Very high | 0 Ų | 0 | 46.2 Ų | 46.2 | 0% | 0 | 24% | 0.244 | C | C | . | . | E | Extended strand (participates in β ladder) | trans | -117.5 | 127.6 | 179.4 | -179.4 | 0 | 0 | 0 | 0 | 109.5 | K61 L62 A99 I137 A141 N146 R149 M150 | K61-V139 WeakPolarHBondContact CA-O 3.19Å; L62-V139 PolarHBondContact N-O 3.36Å; L62-V139 PolarHBondContact O-N 3.34Å; A99-V139 HydrophobicContact CB-CG2 3.62Å; I137-V139 HydrophobicContact CG2-CG2 4.25Å; V139-A141 HydrophobicContact CG1-CB 4.25Å; V139-N146 VanDerWaalsContact CB-OD1 3.3Å; V139-N146 WeakPolarHBondContact CB-OD1 3.24Å; V139-N146 WeakPolarHBondContact CG1-OD1 3.38Å; V139-N146 PolarHBondContact O-ND2 3.34Å; V139-N146 PolarHBondContact O-OD1 2.93Å; V139-R149 HydrophobicContact CG1-CB 3.9Å; V139-M150 HydrophobicContact CB-CE 4.15Å; V139-M150 HydrophobicContact CG2-CB 4.32Å; V139-M150 HydrophobicContact CG2-CE 3.74Å; V139-M150 HydrophobicContact CG2-SD 4.24Å |
| 140 | T | 94.6 | Very high | 94.5 | Very high | 66 Ų | 66 | 46.7 Ų | 46.7 | 41% | 0.405 | 25% | 0.246 | S | C | . | . | E | Extended strand (participates in β ladder) | trans | -120.2 | 101.6 | 175.1 | -56.1 | 0 | 0 | 0 | 0 | 109.4 | M60 K61 | M60-T140 WeakPolarHBondContact O-CA 3.4Å; K61-T140 HydrophobicContact CG-CG2 4.03Å |
| 141 | A | 93.1 | Very high | 94.7 | Very high | 3 Ų | 3 | 45.2 Ų | 45.2 | 3% | 0.025 | 23% | 0.234 | C | C | . | . | E | Extended strand (participates in β ladder) | trans | -155.1 | 166.7 | -175.3 | 0 | 0 | 0 | 0 | 0 | 110.5 | M60 V139 E145 N146 | M60-A141 PolarHBondContact N-O 3.47Å; M60-A141 PolarHBondContact O-N 2.61Å; V139-A141 HydrophobicContact CG1-CB 4.25Å; A141-E145 HydrophobicContact CB-CB 4.21Å; A141-N146 HydrophobicContact CB-CB 4.1Å; A141-N146 PolarHBondContact N-ND2 3.08Å; A141-N146 VanDerWaalsContact N-ND2 3.18Å; A141-N146 PolarHBondContact O-ND2 3.4Å |
| 142 | P | 92.4 | Very high | 94.9 | Very high | 50 Ų | 50 | 45.8 Ų | 45.8 | 33% | 0.325 | 24% | 0.235 | S | C | . | . | E | Extended strand (participates in β ladder) | trans | -54.8 | 148.8 | 167.5 | -22.5 | 34.4 | 0 | 0 | 0 | 111.3 | E145 N146 | P142-E145 PolarHBondContact O-N 2.97Å; P142-E145 VanDerWaalsContact O-N 3.15Å; P142-N146 WeakPolarHBondContact O-CB 3.37Å; P142-N146 PolarHBondContact O-N 2.68Å |
| 143 | I | 90.2 | Very high | 95 | Very high | 17 Ų | 17 | 40.9 Ų | 40.9 | 9% | 0.087 | 21% | 0.213 | C | C | . | . | H | α-helix | trans | -45.1 | -55.3 | -169.5 | -63.3 | 164.4 | 0 | 0 | 0 | 114.5 | L52 D53 L54 M60 N146 Y147 | L52-I143 HydrophobicContact CB-CD1 4.33Å; L52-I143 HydrophobicContact CD1-CG2 4.16Å; L52-I143 HydrophobicContact CD2-CD1 4.17Å; D53-I143 VanDerWaalsContact O-CD1 3.31Å; D53-I143 WeakPolarHBondContact O-CD1 3.46Å; L54-I143 HydrophobicContact CD2-CB 4.08Å; L54-I143 HydrophobicContact CD2-CD1 4.27Å; L54-I143 HydrophobicContact CD2-CG2 3.82Å; M60-I143 HydrophobicContact CB-CG1 4.27Å; M60-I143 HydrophobicContact CE-CB 4.39Å; M60-I143 HydrophobicContact CE-CG1 4.27Å; M60-I143 HydrophobicContact CE-CG2 4.05Å; M60-I143 HydrophobicContact SD-CG1 4.49Å; I143-N146 WeakPolarHBondContact O-CB 3.48Å; I143-N146 PolarHBondContact O-N 2.94Å; I143-Y147 HydrophobicContact CG2-CD2 4.39Å; I143-Y147 HydrophobicContact CG2-CE2 4.04Å; I143-Y147 VanDerWaalsContact O-CD2 3.31Å; I143-Y147 WeakPolarHBondContact O-CD2 3.35Å; I143-Y147 PolarHBondContact O-N 3.05Å |
| 144 | P | 91.5 | Very high | 95 | Very high | 89 Ų | 89 | 43.9 Ų | 43.9 | 58% | 0.578 | 23% | 0.227 | S | C | * | . | H | α-helix | trans | -65.6 | -43.1 | -177.6 | 24.9 | -34.3 | 0 | 0 | 0 | 112.9 | N146 L148 | P144-N146 VanDerWaalsContact C-N 3.26Å; P144-N146 PolarHBondContact O-N 3.05Å; P144-L148 PolarHBondContact O-N 3.35Å |
| 145 | E | 92.6 | Very high | 95 | Very high | 87 Ų | 87 | 48 Ų | 48 | 41% | 0.407 | 25% | 0.249 | S | C | . | . | H | α-helix | trans | -65.8 | -30.1 | 176.5 | -66.8 | -174.1 | -164.7 | 0 | 0 | 112.6 | A141 P142 L148 R149 | A141-E145 HydrophobicContact CB-CB 4.21Å; P142-E145 PolarHBondContact O-N 2.97Å; P142-E145 VanDerWaalsContact O-N 3.15Å; E145-L148 PolarHBondContact O-N 2.88Å; E145-R149 WeakPolarHBondContact O-CB 3.12Å; E145-R149 VanDerWaalsContact O-CG 3.27Å; E145-R149 WeakPolarHBondContact O-CG 3.42Å; E145-R149 PolarHBondContact O-N 3.2Å; E145-R149 IonicContact OE2-CZ 2.79Å; E145-R149 IonicContact OE2-NE 3.99Å; E145-R149 IonicContact OE2-NH2 3.36Å; E145-R149 PolarHBondContact OE2-NH2 2.74Å |
| 146 | N | 94 | Very high | 94.9 | Very high | 0 Ų | 0 | 50.1 Ų | 50.1 | 0% | 0 | 26% | 0.259 | C | S | . | . | H | α-helix | trans | -64.4 | -47.2 | -177.2 | -152.4 | -44.8 | 0 | 0 | 0 | 111.3 | M60 L62 V139 A141 P142 I143 P144 M150 | M60-N146 VanDerWaalsContact C-ND2 3.3Å; M60-N146 HydrophobicContact CE-CB 4.3Å; M60-N146 PolarHBondContact O-ND2 3.36Å; L62-N146 WeakPolarHBondContact CB-OD1 3.09Å; L62-N146 HydrophobicContact CD1-CB 4.17Å; L62-N146 VanDerWaalsContact CD1-OD1 3.31Å; L62-N146 WeakPolarHBondContact CD1-OD1 3.28Å; L62-N146 VanDerWaalsContact CG-OD1 3.23Å; L62-N146 WeakPolarHBondContact CG-OD1 3.34Å; V139-N146 VanDerWaalsContact CB-OD1 3.3Å; V139-N146 WeakPolarHBondContact CB-OD1 3.24Å; V139-N146 WeakPolarHBondContact CG1-OD1 3.38Å; V139-N146 PolarHBondContact O-ND2 3.34Å; V139-N146 PolarHBondContact O-OD1 2.93Å; A141-N146 HydrophobicContact CB-CB 4.1Å; A141-N146 PolarHBondContact N-ND2 3.08Å; A141-N146 VanDerWaalsContact N-ND2 3.18Å; A141-N146 PolarHBondContact O-ND2 3.4Å; P142-N146 WeakPolarHBondContact O-CB 3.37Å; P142-N146 PolarHBondContact O-N 2.68Å; I143-N146 WeakPolarHBondContact O-CB 3.48Å; I143-N146 PolarHBondContact O-N 2.94Å; P144-N146 VanDerWaalsContact C-N 3.26Å; P144-N146 PolarHBondContact O-N 3.05Å; N146-M150 VanDerWaalsContact O-CB 3.3Å; N146-M150 WeakPolarHBondContact O-CB 3.49Å; N146-M150 PolarHBondContact O-N 3.45Å |
| 147 | Y | 94.4 | Very high | 94.8 | Very high | 121 Ų | 121 | 48.8 Ų | 48.8 | 48% | 0.475 | 25% | 0.253 | S | S | . | . | H | α-helix | trans | -64.3 | -41.8 | 174.4 | -70.9 | -68.8 | 0 | 0 | 0 | 112.1 | M60 L62 I143 M150 A151 | M60-Y147 HydrophobicContact CE-CD2 4.23Å; M60-Y147 HydrophobicContact CE-CE2 3.56Å; L62-Y147 HydrophobicContact CD1-CD1 3.53Å; L62-Y147 HydrophobicContact CD1-CE1 3.6Å; L62-Y147 HydrophobicContact CD1-CG 4.05Å; L62-Y147 HydrophobicContact CD2-CE1 4.26Å; I143-Y147 HydrophobicContact CG2-CD2 4.39Å; I143-Y147 HydrophobicContact CG2-CE2 4.04Å; I143-Y147 VanDerWaalsContact O-CD2 3.31Å; I143-Y147 WeakPolarHBondContact O-CD2 3.35Å; I143-Y147 PolarHBondContact O-N 3.05Å; Y147-M150 PolarHBondContact O-N 3.23Å; Y147-A151 WeakPolarHBondContact O-CB 3.5Å; Y147-A151 PolarHBondContact O-N 3Å |
| 148 | L | 95.3 | Very high | 94.7 | Very high | 126 Ų | 126 | 54.3 Ų | 54.3 | 66% | 0.66 | 28% | 0.277 | S | S | * | . | H | α-helix | trans | -62.1 | -48.4 | 178 | -179 | 63.1 | 0 | 0 | 0 | 112.2 | P144 E145 M150 A151 H152 | P144-L148 PolarHBondContact O-N 3.35Å; E145-L148 PolarHBondContact O-N 2.88Å; L148-M150 VanDerWaalsContact C-N 3.35Å; L148-M150 PolarHBondContact O-N 2.98Å; L148-A151 PolarHBondContact O-N 3.17Å; L148-H152 WeakPolarHBondContact O-CB 3.43Å; L148-H152 PolarHBondContact O-N 3.09Å |
| 149 | R | 96 | Very high | 94.5 | Very high | 83 Ų | 83 | 58.8 Ų | 58.8 | 31% | 0.313 | 30% | 0.296 | S | S | . | . | H | α-helix | trans | -65.1 | -36.9 | 176.9 | -69.2 | 179.2 | -159.3 | -158.6 | 5.9 | 112.1 | V139 E145 A153 | V139-R149 HydrophobicContact CG1-CB 3.9Å; E145-R149 WeakPolarHBondContact O-CB 3.12Å; E145-R149 VanDerWaalsContact O-CG 3.27Å; E145-R149 WeakPolarHBondContact O-CG 3.42Å; E145-R149 PolarHBondContact O-N 3.2Å; E145-R149 IonicContact OE2-CZ 2.79Å; E145-R149 IonicContact OE2-NE 3.99Å; E145-R149 IonicContact OE2-NH2 3.36Å; E145-R149 PolarHBondContact OE2-NH2 2.74Å; R149-A153 VanDerWaalsContact O-CB 3.3Å; R149-A153 WeakPolarHBondContact O-CB 3.46Å; R149-A153 PolarHBondContact O-N 3.41Å |
| 150 | M | 96.3 | Very high | 94.3 | Very high | 10 Ų | 10 | 60.7 Ų | 60.7 | 5% | 0.049 | 31% | 0.305 | C | S | . | . | H | α-helix | trans | -63.8 | -47.1 | 175.3 | -175.5 | 61.4 | 77.6 | 0 | 0 | 111.3 | L62 E64 I137 V139 N146 Y147 L148 A153 M154 | L62-M150 HydrophobicContact CB-CE 3.62Å; L62-M150 HydrophobicContact CD1-CB 4.49Å; E64-M150 HydrophobicContact CB-CE 4.2Å; E64-M150 HydrophobicContact CB-SD 3.94Å; E64-M150 HydrophobicContact CG-CE 4.08Å; E64-M150 HydrophobicContact CG-CG 4.32Å; E64-M150 HydrophobicContact CG-SD 3.97Å; I137-M150 HydrophobicContact CB-CE 4.47Å; I137-M150 HydrophobicContact CB-SD 3.99Å; I137-M150 HydrophobicContact CG2-CE 4.14Å; I137-M150 HydrophobicContact CG2-SD 3.61Å; V139-M150 HydrophobicContact CB-CE 4.15Å; V139-M150 HydrophobicContact CG2-CB 4.32Å; V139-M150 HydrophobicContact CG2-CE 3.74Å; V139-M150 HydrophobicContact CG2-SD 4.24Å; N146-M150 VanDerWaalsContact O-CB 3.3Å; N146-M150 WeakPolarHBondContact O-CB 3.49Å; N146-M150 PolarHBondContact O-N 3.45Å; Y147-M150 PolarHBondContact O-N 3.23Å; L148-M150 VanDerWaalsContact C-N 3.35Å; L148-M150 PolarHBondContact O-N 2.98Å; M150-A153 PolarHBondContact O-N 2.77Å; M150-M154 HydrophobicContact CG-SD 4.13Å; M150-M154 VanDerWaalsContact O-CG 3.31Å; M150-M154 WeakPolarHBondContact O-CG 3.47Å; M150-M154 PolarHBondContact O-N 3.15Å; M150-M154 HydrophobicContact SD-CG 4.45Å; M150-M154 HydrophobicContact SD-SD 4.45Å |
| 151 | A | 96.3 | Very high | 94.2 | Very high | 49 Ų | 49 | 58.3 Ų | 58.3 | 41% | 0.405 | 29% | 0.289 | S | S | . | . | H | α-helix | trans | -59.2 | -49 | 176.4 | 0 | 0 | 0 | 0 | 0 | 111.6 | Y147 L148 A153 M154 D155 | Y147-A151 WeakPolarHBondContact O-CB 3.5Å; Y147-A151 PolarHBondContact O-N 3Å; L148-A151 PolarHBondContact O-N 3.17Å; A151-A153 PolarHBondContact O-N 2.87Å; A151-M154 PolarHBondContact O-N 2.92Å; A151-M154 VanDerWaalsContact O-N 3.16Å; A151-D155 PolarHBondContact O-N 3.11Å |
| 152 | H | 96.6 | Very high | 93.9 | Very high | 81 Ų | 81 | 62.8 Ų | 62.8 | 38% | 0.375 | 31% | 0.312 | S | S | . | . | H | α-helix | trans | -58.1 | -45.1 | 176.5 | -177.6 | -129.7 | 0 | 0 | 0 | 112.3 | L148 M154 D155 E156 | L148-H152 WeakPolarHBondContact O-CB 3.43Å; L148-H152 PolarHBondContact O-N 3.09Å; H152-M154 VanDerWaalsContact C-N 3.34Å; H152-M154 PolarHBondContact O-N 3.07Å; H152-D155 PolarHBondContact O-N 2.98Å; H152-E156 PolarHBondContact O-N 3.2Å |
| 153 | A | 96.5 | Very high | 93.4 | Very high | 0 Ų | 0 | 61.7 Ų | 61.7 | 0% | 0 | 31% | 0.305 | C | S | . | . | H | α-helix | trans | -62.6 | -38.3 | 176.2 | 0 | 0 | 0 | 0 | 0 | 113.1 | T97 A99 I137 R149 M150 A151 V157 | T97-A153 HydrophobicContact CG2-CB 4.05Å; A99-A153 HydrophobicContact CB-CB 3.79Å; I137-A153 HydrophobicContact CD1-CB 4.38Å; I137-A153 HydrophobicContact CG2-CB 3.97Å; R149-A153 VanDerWaalsContact O-CB 3.3Å; R149-A153 WeakPolarHBondContact O-CB 3.46Å; R149-A153 PolarHBondContact O-N 3.41Å; M150-A153 PolarHBondContact O-N 2.77Å; A151-A153 PolarHBondContact O-N 2.87Å; A153-V157 WeakPolarHBondContact O-CB 3.39Å; A153-V157 WeakPolarHBondContact O-CG2 3.28Å; A153-V157 PolarHBondContact O-N 3.01Å |
| 154 | M | 95.8 | Very high | 92.7 | Very high | 79 Ų | 79 | 66.5 Ų | 66.5 | 39% | 0.389 | 33% | 0.327 | S | S | . | . | H | α-helix | trans | -67.4 | -42.2 | 176.9 | -72.1 | 176.9 | 69.4 | 0 | 0 | 112.1 | I137 M150 A151 H152 V157 K158 | I137-M154 HydrophobicContact CD1-CG 4.01Å; M150-M154 HydrophobicContact CG-SD 4.13Å; M150-M154 VanDerWaalsContact O-CG 3.31Å; M150-M154 WeakPolarHBondContact O-CG 3.47Å; M150-M154 PolarHBondContact O-N 3.15Å; M150-M154 HydrophobicContact SD-CG 4.45Å; M150-M154 HydrophobicContact SD-SD 4.45Å; A151-M154 PolarHBondContact O-N 2.92Å; A151-M154 VanDerWaalsContact O-N 3.16Å; H152-M154 VanDerWaalsContact C-N 3.34Å; H152-M154 PolarHBondContact O-N 3.07Å; M154-V157 PolarHBondContact O-N 3.04Å; M154-K158 VanDerWaalsContact O-CB 3.28Å; M154-K158 WeakPolarHBondContact O-CB 3.47Å; M154-K158 PolarHBondContact O-N 2.99Å |
| 155 | D | 95.9 | Very high | 91.2 | Very high | 92 Ų | 92 | 69 Ų | 69 | 49% | 0.492 | 34% | 0.343 | S | S | . | . | H | α-helix | trans | -67.7 | -39.3 | 178.2 | -85.2 | -29.9 | 0 | 0 | 0 | 112.7 | A151 H152 K158 | A151-D155 PolarHBondContact O-N 3.11Å; H152-D155 PolarHBondContact O-N 2.98Å; D155-K158 WeakPolarHBondContact O-CB 3.18Å; D155-K158 PolarHBondContact O-N 2.92Å |
| 156 | E | 95 | Very high | 89.7 | Confident | 44 Ų | 44 | 68 Ų | 68 | 21% | 0.206 | 36% | 0.355 | C | S | . | . | H | α-helix | trans | -66.8 | -46.4 | 173.3 | -67.8 | -54.4 | 137.6 | 0 | 0 | 111.9 | L93 T97 H152 K158 K159 F160 | L93-E156 HydrophobicContact CD1-CB 3.42Å; L93-E156 VanDerWaalsContact CD1-CB 3.42Å; L93-E156 HydrophobicContact CD1-CG 4.2Å; T97-E156 HydrophobicContact CG2-CB 4.4Å; T97-E156 HydrophobicContact CG2-CG 4.24Å; H152-E156 PolarHBondContact O-N 3.2Å; E156-K158 VanDerWaalsContact C-N 3.26Å; E156-K158 PolarHBondContact O-N 3.45Å; E156-K159 WeakPolarHBondContact O-CB 3.48Å; E156-K159 PolarHBondContact O-N 3.31Å; E156-K159 VanDerWaalsContact O-N 3.17Å; E156-K159 IonicContact OE1-NZ 3.11Å; E156-K159 PolarHBondContact OE1-NZ 3.22Å; E156-K159 WeakPolarHBondContact OE2-CE 3.39Å; E156-K159 IonicContact OE2-NZ 3.31Å; E156-K159 PolarHBondContact OE2-NZ 3.26Å; E156-F160 WeakPolarHBondContact O-CD2 3.28Å |
| 157 | V | 94.9 | Very high | 87.8 | Confident | 0 Ų | 0 | 73.6 Ų | 73.6 | 0% | 0 | 38% | 0.382 | C | S | . | . | H | α-helix | trans | -57.7 | -39.8 | 176.2 | 166.3 | 0 | 0 | 0 | 0 | 111.4 | L93 I101 V135 I137 A153 M154 K159 F160 L161 | L93-V157 HydrophobicContact CD2-CG2 3.98Å; I101-V157 HydrophobicContact CD1-CG2 4.31Å; V135-V157 HydrophobicContact CB-CG1 4.32Å; V135-V157 HydrophobicContact CG1-CG1 4.27Å; V135-V157 HydrophobicContact CG1-CG2 4.37Å; V135-V157 HydrophobicContact CG2-CG1 4.1Å; I137-V157 HydrophobicContact CD1-CG2 4.17Å; A153-V157 WeakPolarHBondContact O-CB 3.39Å; A153-V157 WeakPolarHBondContact O-CG2 3.28Å; A153-V157 PolarHBondContact O-N 3.01Å; M154-V157 PolarHBondContact O-N 3.04Å; V157-K159 VanDerWaalsContact C-N 3.26Å; V157-K159 PolarHBondContact O-N 3.3Å; V157-F160 PolarHBondContact O-N 3.4Å; V157-L161 HydrophobicContact CG1-CD1 3.9Å; V157-L161 HydrophobicContact CG1-CG 4.22Å; V157-L161 PolarHBondContact O-N 3.1Å |
| 158 | K | 94.2 | Very high | 86 | Confident | 117 Ų | 117 | 72.8 Ų | 72.8 | 51% | 0.509 | 38% | 0.382 | S | S | . | . | H | α-helix | trans | -56.9 | -35.2 | 179 | -179.9 | -179.2 | 175 | -173 | 0 | 113 | M154 D155 E156 F160 L161 I162 | M154-K158 VanDerWaalsContact O-CB 3.28Å; M154-K158 WeakPolarHBondContact O-CB 3.47Å; M154-K158 PolarHBondContact O-N 2.99Å; D155-K158 WeakPolarHBondContact O-CB 3.18Å; D155-K158 PolarHBondContact O-N 2.92Å; E156-K158 VanDerWaalsContact C-N 3.26Å; E156-K158 PolarHBondContact O-N 3.45Å; K158-F160 VanDerWaalsContact C-N 3.27Å; K158-F160 PolarHBondContact O-N 3.28Å; K158-L161 PolarHBondContact O-N 2.9Å; K158-L161 VanDerWaalsContact O-N 3.13Å; K158-I162 HydrophobicContact CG-CD1 4.05Å; K158-I162 PolarHBondContact O-N 3.43Å |
| 159 | K | 92.9 | Very high | 83.8 | Confident | 120 Ų | 120 | 70.8 Ų | 70.8 | 52% | 0.522 | 37% | 0.372 | S | S | . | . | H | α-helix | trans | -61.2 | -34.8 | 176.5 | -59.6 | 174.1 | -166.9 | 171.9 | 0 | 112.4 | E156 V157 | E156-K159 WeakPolarHBondContact O-CB 3.48Å; E156-K159 PolarHBondContact O-N 3.31Å; E156-K159 VanDerWaalsContact O-N 3.17Å; E156-K159 IonicContact OE1-NZ 3.11Å; E156-K159 PolarHBondContact OE1-NZ 3.22Å; E156-K159 WeakPolarHBondContact OE2-CE 3.39Å; E156-K159 IonicContact OE2-NZ 3.31Å; E156-K159 PolarHBondContact OE2-NZ 3.26Å; V157-K159 VanDerWaalsContact C-N 3.26Å; V157-K159 PolarHBondContact O-N 3.3Å |
| 160 | F | 91.8 | Very high | 81.9 | Confident | 41 Ų | 41 | 72.4 Ų | 72.4 | 18% | 0.18 | 39% | 0.393 | C | S | . | . | H | α-helix | trans | -79.5 | -21.5 | 177.2 | -60 | -86.7 | 0 | 0 | 0 | 113.4 | F78 K81 L82 T89 L93 E156 V157 K158 | F78-F160 WeakPolarHBondContact CD1-O 3.31Å; K81-F160 HydrophobicContact CG-CD1 4.26Å; L82-F160 HydrophobicContact CD2-CB 3.5Å; L82-F160 VanDerWaalsContact CD2-CB 3.5Å; L82-F160 HydrophobicContact CD2-CD1 4.49Å; L82-F160 HydrophobicContact CD2-CD2 3.92Å; L82-F160 HydrophobicContact CD2-CG 3.72Å; L82-F160 HydrophobicContact CG-CB 3.83Å; L82-F160 HydrophobicContact CG-CG 4.35Å; T89-F160 HydrophobicContact CG2-CE1 3.58Å; T89-F160 HydrophobicContact CG2-CZ 3.77Å; L93-F160 HydrophobicContact CD1-CE2 4.33Å; L93-F160 HydrophobicContact CD2-CE2 4.16Å; E156-F160 WeakPolarHBondContact O-CD2 3.28Å; V157-F160 PolarHBondContact O-N 3.4Å; K158-F160 VanDerWaalsContact C-N 3.27Å; K158-F160 PolarHBondContact O-N 3.28Å |
| 161 | L | 92 | Very high | 80 | Confident | 16 Ų | 16 | 81.9 Ų | 81.9 | 8% | 0.084 | 43% | 0.43 | C | S | . | . | H | α-helix | trans | -87.5 | -12.3 | -179.3 | -62 | -178.2 | 0 | 0 | 0 | 113.7 | V66 I68 F78 L82 V157 K158 | V66-L161 HydrophobicContact CG1-CD1 3.65Å; I68-L161 HydrophobicContact CB-CD2 4.29Å; I68-L161 HydrophobicContact CD1-CD2 4.31Å; I68-L161 HydrophobicContact CG1-CD2 3.91Å; I68-L161 HydrophobicContact CG2-CD2 4Å; F78-L161 HydrophobicContact CD1-CD2 4.42Å; F78-L161 VanDerWaalsContact CE1-O 3.25Å; F78-L161 WeakPolarHBondContact CE1-O 3.49Å; L82-L161 HydrophobicContact CD1-CD2 4.15Å; V157-L161 HydrophobicContact CG1-CD1 3.9Å; V157-L161 HydrophobicContact CG1-CG 4.22Å; V157-L161 PolarHBondContact O-N 3.1Å; K158-L161 PolarHBondContact O-N 2.9Å; K158-L161 VanDerWaalsContact O-N 3.13Å |
| 162 | I | 88.1 | Confident | 78.2 | Confident | 97 Ų | 97 | 86 Ų | 86 | 50% | 0.497 | 44% | 0.443 | S | S | . | . | S | Bend | trans | -98.3 | 118.5 | 174.3 | -62.3 | 171.1 | 0 | 0 | 0 | 108.1 | K158 E164 | K158-I162 HydrophobicContact CG-CD1 4.05Å; K158-I162 PolarHBondContact O-N 3.43Å; I162-E164 PolarHBondContact O-N 2.95Å |
| 163 | P | 80.8 | Confident | 76.1 | Confident | 27 Ų | 27 | 85.9 Ų | 85.9 | 18% | 0.175 | 45% | 0.445 | C | S | . | . | P | Polyproline II helix | trans | -65.9 | 131.3 | 170.2 | -17.3 | 31.3 | 0 | 0 | 0 | 110.1 | Y73 V76 F78 | Y73-P163 HydrophobicContact CD1-CG 3.85Å; Y73-P163 HydrophobicContact CD2-CG 3.9Å; Y73-P163 HydrophobicContact CE1-CG 4.11Å; Y73-P163 HydrophobicContact CE2-CG 4.17Å; Y73-P163 HydrophobicContact CG-CG 3.73Å; V76-P163 HydrophobicContact CG2-CB 4.41Å; V76-P163 HydrophobicContact CG2-CG 4.16Å; F78-P163 HydrophobicContact CE1-CG 4.19Å; F78-P163 HydrophobicContact CZ-CG 4.08Å |
| 164 | E | 75.8 | Confident | 74.3 | Confident | 117 Ų | 117 | 91 Ų | 91 | 55% | 0.547 | 48% | 0.478 | S | S | . | . | P | Polyproline II helix | trans | -72.2 | 133.3 | 174.4 | -71.5 | -174.7 | -162.9 | 0 | 0 | 110.5 | I162 G166 | I162-E164 PolarHBondContact O-N 2.95Å; E164-G166 PolarHBondContact O-N 2.89Å |
| 165 | P | 60.4 | Low | 72.3 | Confident | 143 Ų | 143 | 93.5 Ų | 93.5 | 93% | 0.929 | 49% | 0.488 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -74.2 | 78.4 | 177.5 | 31.5 | -34.8 | 0 | 0 | 0 | 110.5 | ||
| 166 | G | 60.1 | Low | 70.5 | Confident | 64 Ų | 64 | 98 Ų | 98 | 66% | 0.66 | 50% | 0.504 | S | S | * | . | T | Hydrogen-bonded Turn | trans | 169.9 | -35.7 | 176.8 | 0 | 0 | 0 | 0 | 0 | 114.4 | E164 H168 | E164-G166 PolarHBondContact O-N 2.89Å; G166-H168 PolarHBondContact O-N 2.74Å |
| 167 | E | 54.3 | Low | 68.8 | Low | 118 Ų | 118 | 103.5 Ų | 103.5 | 55% | 0.551 | 53% | 0.534 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -69.5 | -18.7 | 180 | -69.5 | -166 | 119.3 | 0 | 0 | 113.7 | K81 | K81-E167 IonicContact NZ-OE2 2.68Å; K81-E167 PolarHBondContact NZ-OE2 3.15Å |
| 168 | H | 56.7 | Low | 67.1 | Low | 104 Ų | 104 | 110 Ų | 110 | 48% | 0.481 | 57% | 0.569 | S | S | . | * | trans | -106.6 | 59.9 | -178.7 | -71.2 | 71.3 | 0 | 0 | 0 | 111.4 | G166 P170 | G166-H168 PolarHBondContact O-N 2.74Å; H168-P170 WeakPolarHBondContact O-CD 3.24Å | ||
| 169 | D | 49.9 | Very low | 65.1 | Low | 84 Ų | 84 | 107.7 Ų | 107.7 | 45% | 0.449 | 58% | 0.579 | S | S | . | * | trans | -59.5 | 122.3 | 160.6 | -169.8 | -22.8 | 0 | 0 | 0 | 108.4 | Y171 M172 | D169-Y171 PolarHBondContact O-N 3.34Å; D169-Y171 PolarHBondContact OD1-N 3.39Å; D169-Y171 VanDerWaalsContact OD1-N 3.15Å; D169-M172 HydrophobicContact CB-CG 4.33Å; D169-M172 PolarHBondContact O-N 3.11Å; D169-M172 VanDerWaalsContact O-N 3.11Å | ||
| 170 | P | 55.8 | Low | 62.8 | Low | 117 Ų | 117 | 105.8 Ų | 105.8 | 76% | 0.76 | 58% | 0.58 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -57.6 | -10.8 | 179.2 | -26.1 | 36 | 0 | 0 | 0 | 115.1 | H168 | H168-P170 WeakPolarHBondContact O-CD 3.24Š|
| 171 | Y | 57.3 | Low | 60.8 | Low | 210 Ų | 210 | 112.8 Ų | 112.8 | 82% | 0.824 | 61% | 0.613 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -96.5 | -1.5 | 179.2 | -72 | -85.5 | 0 | 0 | 0 | 115.5 | D169 D173 | D169-Y171 PolarHBondContact O-N 3.34Å; D169-Y171 PolarHBondContact OD1-N 3.39Å; D169-Y171 VanDerWaalsContact OD1-N 3.15Å; Y171-D173 PolarHBondContact O-N 3.21Å; Y171-D173 VanDerWaalsContact O-N 3.15Å |
| 172 | M | 57.1 | Low | 58.5 | Low | 135 Ų | 135 | 119.6 Ų | 119.6 | 67% | 0.665 | 65% | 0.65 | S | S | * | * | trans | -68.1 | 114.3 | 177.5 | -83.3 | -66.9 | 169.9 | 0 | 0 | 111.9 | D169 | D169-M172 HydrophobicContact CB-CG 4.33Å; D169-M172 PolarHBondContact O-N 3.11Å; D169-M172 VanDerWaalsContact O-N 3.11Å | ||
| 173 | D | 52.4 | Low | 56.2 | Low | 79 Ų | 79 | 118.3 Ų | 118.3 | 42% | 0.422 | 66% | 0.661 | S | S | . | * | trans | -62.5 | 125 | -175.4 | -166.9 | -32.4 | 0 | 0 | 0 | 110.8 | Y171 Q175 F176 | Y171-D173 PolarHBondContact O-N 3.21Å; Y171-D173 VanDerWaalsContact O-N 3.15Å; D173-Q175 PolarHBondContact O-N 3.45Å; D173-Q175 VanDerWaalsContact OD1-CG 3.31Å; D173-Q175 WeakPolarHBondContact OD1-CG 3.34Å; D173-Q175 PolarHBondContact OD1-N 3.11Å; D173-F176 PolarHBondContact O-N 3.45Å | ||
| 174 | P | 59.1 | Low | 54.7 | Low | 106 Ų | 106 | 123.6 Ų | 123.6 | 69% | 0.688 | 70% | 0.698 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -58 | -11.2 | -178.4 | 22.5 | -34.8 | 0 | 0 | 0 | 114.8 | F176 | P174-F176 VanDerWaalsContact C-N 3.33Å; P174-F176 PolarHBondContact O-N 3.19Å |
| 175 | Q | 54.4 | Low | 53 | Low | 132 Ų | 132 | 121 Ų | 121 | 62% | 0.617 | 70% | 0.703 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -62.9 | -33.3 | 172.4 | -65.5 | -179.2 | 20.6 | 0 | 0 | 113.4 | D173 L177 N178 | D173-Q175 PolarHBondContact O-N 3.45Å; D173-Q175 VanDerWaalsContact OD1-CG 3.31Å; D173-Q175 WeakPolarHBondContact OD1-CG 3.34Å; D173-Q175 PolarHBondContact OD1-N 3.11Å; Q175-L177 PolarHBondContact O-N 3.2Å; Q175-N178 PolarHBondContact O-N 3.39Å |
| 176 | F | 57 | Low | 52.1 | Low | 186 Ų | 186 | 126.2 Ų | 126.2 | 82% | 0.816 | 70% | 0.704 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -70.8 | -28 | -178.3 | -86.9 | -90.1 | 0 | 0 | 0 | 113.9 | D173 P174 | D173-F176 PolarHBondContact O-N 3.45Å; P174-F176 VanDerWaalsContact C-N 3.33Å; P174-F176 PolarHBondContact O-N 3.19Å |
| 177 | L | 60.8 | Low | 50.9 | Low | 161 Ų | 161 | 127 Ų | 127 | 84% | 0.843 | 71% | 0.712 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -87.8 | -11.7 | -178.2 | -163.1 | 64.4 | 0 | 0 | 0 | 113.2 | Q175 | Q175-L177 PolarHBondContact O-N 3.2Š|
| 178 | N | 57.7 | Low | 50.1 | Low | 135 Ų | 135 | 133.7 Ų | 133.7 | 72% | 0.722 | 73% | 0.732 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -103.7 | 14.2 | -173.3 | -160.1 | 37.5 | 0 | 0 | 0 | 114.6 | Q175 S180 | Q175-N178 PolarHBondContact O-N 3.39Å; N178-S180 VanDerWaalsContact C-N 3.31Å; N178-S180 PolarHBondContact O-N 2.95Å; N178-S180 VanDerWaalsContact O-N 3.13Å |
| 179 | G | 52 | Low | 49 | Very low | 70 Ų | 70 | 132.7 Ų | 132.7 | 72% | 0.722 | 75% | 0.75 | S | S | * | * | T | Hydrogen-bonded Turn | trans | 64.4 | 21.7 | 162 | 0 | 0 | 0 | 0 | 0 | 117.1 | Q181 | G179-Q181 PolarHBondContact O-N 3.36Š|
| 180 | S | 45.6 | Very low | 48.7 | Very low | 79 Ų | 79 | 132.1 Ų | 132.1 | 55% | 0.552 | 76% | 0.764 | S | S | * | * | trans | -79.1 | 77.7 | 179 | 57.2 | 0 | 0 | 0 | 0 | 112.2 | N178 D182 | N178-S180 VanDerWaalsContact C-N 3.31Å; N178-S180 PolarHBondContact O-N 2.95Å; N178-S180 VanDerWaalsContact O-N 3.13Å; S180-D182 PolarHBondContact O-N 3.47Å | ||
| 181 | Q | 49.1 | Very low | 47.8 | Very low | 188 Ų | 188 | 135.2 Ų | 135.2 | 88% | 0.879 | 77% | 0.773 | S | S | * | * | trans | -79.7 | 56.8 | 168.3 | -166 | 171.3 | 13.7 | 0 | 0 | 111.6 | G179 | G179-Q181 PolarHBondContact O-N 3.36Š| ||
| 182 | D | 43.9 | Very low | 46.9 | Very low | 160 Ų | 160 | 129 Ų | 129 | 86% | 0.856 | 77% | 0.773 | S | S | * | * | trans | -137 | 82.4 | 176.8 | -78.5 | -55.8 | 0 | 0 | 0 | 109.3 | S180 | S180-D182 PolarHBondContact O-N 3.47Š| ||
| 183 | G | 40.6 | Very low | 45.9 | Very low | 70 Ų | 70 | 134.5 Ų | 134.5 | 72% | 0.722 | 79% | 0.786 | S | S | * | * | trans | -177.7 | 31.8 | -168.9 | 0 | 0 | 0 | 0 | 0 | 117.2 | G185 | G183-G185 PolarHBondContact O-N 3.4Š| ||
| 184 | S | 48.2 | Very low | 45.1 | Very low | 137 Ų | 137 | 134.7 Ų | 134.7 | 96% | 0.958 | 81% | 0.806 | S | S | * | * | trans | -72.8 | 60.4 | 172.1 | 42.4 | 0 | 0 | 0 | 0 | 112 | ||||
| 185 | G | 41.2 | Very low | 43.8 | Very low | 62 Ų | 62 | 141.9 Ų | 141.9 | 64% | 0.639 | 82% | 0.82 | S | S | * | * | trans | -127.3 | 70.6 | -168.3 | 0 | 0 | 0 | 0 | 0 | 114.4 | G183 | G183-G185 PolarHBondContact O-N 3.4Š| ||
| 186 | R | 41.1 | Very low | 42.7 | Very low | 253 Ų | 253 | 139.4 Ų | 139.4 | 96% | 0.955 | 83% | 0.83 | S | S | * | * | trans | 47.7 | 111.5 | 154.4 | -58.3 | 178.4 | -179.9 | -179.3 | -0.2 | 118.6 | ||||
| 187 | G | 35.4 | Very low | 41.5 | Very low | 80 Ų | 80 | 134 Ų | 134 | 83% | 0.825 | 83% | 0.826 | S | S | * | * | trans | -167.7 | 93.8 | 164.1 | 0 | 0 | 0 | 0 | 0 | 118.2 | ||||
| 188 | R | 36.5 | Very low | 41.1 | Very low | 260 Ų | 260 | 132.3 Ų | 132.3 | 98% | 0.981 | 83% | 0.825 | S | S | * | * | trans | 73.7 | 95.8 | 144.8 | -153.5 | 178.4 | -158.9 | 177 | 4.6 | 119.5 | ||||
| 189 | G | 33.8 | Very low | 40.4 | Very low | 83 Ų | 83 | 132 Ų | 132 | 86% | 0.856 | 83% | 0.83 | S | S | * | * | trans | -147.2 | 77 | 159.5 | 0 | 0 | 0 | 0 | 0 | 110.4 | ||||
| 190 | G | 43 | Very low | 39.5 | Very low | 72 Ų | 72 | 132.2 Ų | 132.2 | 74% | 0.742 | 83% | 0.833 | S | S | * | * | trans | -98.4 | 119.2 | -174.3 | 0 | 0 | 0 | 0 | 0 | 112.8 | ||||
| 191 | L | 38.1 | Very low | 39.2 | Very low | 182 Ų | 182 | 133.9 Ų | 133.9 | 95% | 0.953 | 85% | 0.851 | S | S | * | * | trans | -135.5 | 107.5 | 163.8 | -74.8 | 177.1 | 0 | 0 | 0 | 109.7 | ||||
| 192 | G | 37.1 | Very low | 38.4 | Very low | 79 Ų | 79 | 128.9 Ų | 128.9 | 81% | 0.814 | 85% | 0.85 | S | S | * | * | trans | -93.8 | 120.8 | 170.5 | 0 | 0 | 0 | 0 | 0 | 111 | ||||
| 193 | R | 37.3 | Very low | 37.9 | Very low | 251 Ų | 251 | 125 Ų | 125 | 95% | 0.947 | 85% | 0.848 | S | S | * | * | trans | -142.2 | 106.5 | 155.4 | -82.7 | -166.7 | 173.8 | -161.8 | -0.8 | 108.7 | ||||
| 194 | G | 34.4 | Very low | 38.3 | Very low | 82 Ų | 82 | 126.7 Ų | 126.7 | 85% | 0.845 | 85% | 0.846 | S | S | * | * | trans | -90 | 143.8 | 165 | 0 | 0 | 0 | 0 | 0 | 110.5 | ||||
| 195 | R | 32.9 | Very low | 37.8 | Very low | 258 Ų | 258 | 131.4 Ų | 131.4 | 97% | 0.974 | 84% | 0.843 | S | S | * | * | trans | 179 | 121.9 | 147 | -171.8 | 169 | -173.9 | 174.2 | 0.5 | 109.8 | ||||
| 196 | G | 31.1 | Very low | 37.6 | Very low | 80 Ų | 80 | 137.4 Ų | 137.4 | 83% | 0.825 | 85% | 0.852 | S | S | * | * | trans | 119.3 | 110.7 | 161.3 | 0 | 0 | 0 | 0 | 0 | 117.1 | ||||
| 197 | G | 31.2 | Very low | 38.1 | Very low | 72 Ų | 72 | 129.8 Ų | 129.8 | 74% | 0.742 | 84% | 0.835 | S | S | * | * | trans | -135.5 | -164.9 | 139.7 | 0 | 0 | 0 | 0 | 0 | 106.6 | ||||
| 198 | P | 52.9 | Low | 37.9 | Very low | 126 Ų | 126 | 135.7 Ų | 135.7 | 82% | 0.818 | 84% | 0.838 | S | S | * | * | cis | -118.4 | -141.5 | -11.3 | 42.6 | -25 | 0 | 0 | 0 | 108 | ||||
| 199 | P | 43.4 | Very low | 38.6 | Very low | 128 Ų | 128 | 128.3 Ų | 128.3 | 83% | 0.831 | 82% | 0.824 | S | S | * | * | cis | -121 | -175.2 | -16.2 | 40.6 | -23.1 | 0 | 0 | 0 | 112.6 | ||||
| 200 | G | 32.4 | Very low | 38.6 | Very low | 75 Ų | 75 | 136.5 Ų | 136.5 | 77% | 0.773 | 83% | 0.829 | S | S | * | * | cis | 157.5 | 121.9 | -8.7 | 0 | 0 | 0 | 0 | 0 | 111.8 | ||||
| 201 | A | 38.9 | Very low | 37.9 | Very low | 113 Ų | 113 | 136.5 Ų | 136.5 | 93% | 0.934 | 83% | 0.829 | S | S | * | * | trans | -173.6 | 147.1 | 167.8 | 0 | 0 | 0 | 0 | 0 | 107.6 | ||||
| 202 | G | 32.9 | Very low | 37.7 | Very low | 84 Ų | 84 | 140.2 Ų | 140.2 | 87% | 0.866 | 83% | 0.831 | S | S | * | * | cis | 164.1 | 115.3 | -5.8 | 0 | 0 | 0 | 0 | 0 | 108.7 | ||||
| 203 | G | 33.7 | Very low | 37.4 | Very low | 78 Ų | 78 | 140.1 Ų | 140.1 | 80% | 0.804 | 83% | 0.83 | S | S | * | * | trans | 150.5 | 110.7 | 179.9 | 0 | 0 | 0 | 0 | 0 | 115.3 | ||||
| 204 | P | 49.5 | Very low | 37.5 | Very low | 106 Ų | 106 | 137 Ų | 137 | 69% | 0.688 | 83% | 0.828 | S | S | * | * | trans | -102.3 | 162.7 | 179.4 | 38 | -33 | 0 | 0 | 0 | 113.4 | ||||
| 205 | R | 36.2 | Very low | 38.6 | Very low | 236 Ų | 236 | 137.8 Ų | 137.8 | 89% | 0.891 | 82% | 0.818 | S | S | * | * | 175.9 | 99.1 | 124.9 | -68.6 | -133.9 | -175.5 | -138 | -5.7 | 112.6 | |||||
| 206 | F | 37.6 | Very low | 38.7 | Very low | 188 Ų | 188 | 137.4 Ų | 137.4 | 83% | 0.825 | 82% | 0.817 | S | S | * | * | 29.7 | 163.2 | 126.7 | -64 | -70.2 | 0 | 0 | 0 | 123.3 | |||||
| 207 | P | 51.1 | Low | 38.7 | Very low | 93 Ų | 93 | 136.5 Ų | 136.5 | 60% | 0.604 | 81% | 0.808 | S | S | * | * | -148.8 | 130.9 | -64.9 | 38.7 | -16.8 | 0 | 0 | 0 | 117.9 | |||||
| 208 | F | 32 | Very low | 39 | Very low | 204 Ų | 204 | 140.4 Ų | 140.4 | 90% | 0.895 | 81% | 0.812 | S | S | * | * | trans | 57.1 | -176.6 | 150.2 | -56.7 | -58.3 | 0 | 0 | 0 | 120 | ||||
| 209 | P | 50.4 | Low | 38.2 | Very low | 105 Ų | 105 | 141.5 Ų | 141.5 | 68% | 0.682 | 81% | 0.81 | S | S | * | * | cis | -132.3 | 172.4 | -23.8 | 23 | 0.4 | 0 | 0 | 0 | 116.8 | ||||
| 210 | R | 33.7 | Very low | 37.8 | Very low | 254 Ų | 254 | 147.4 Ų | 147.4 | 96% | 0.958 | 82% | 0.815 | S | S | * | * | trans | 66 | 142 | 141.6 | -88.2 | -179.8 | 162.5 | 126.3 | -4.3 | 123.8 | ||||
| 211 | G | 30 | Very low | 37.8 | Very low | 72 Ų | 72 | 147 Ų | 147 | 74% | 0.742 | 81% | 0.812 | S | S | * | * | trans | 115.7 | 109 | 147.2 | 0 | 0 | 0 | 0 | 0 | 114 | ||||
| 212 | R | 33.6 | Very low | 37.7 | Very low | 261 Ų | 261 | 146.2 Ų | 146.2 | 99% | 0.985 | 81% | 0.805 | S | S | * | * | 74.8 | 108.8 | 62.4 | -173.9 | 175.9 | -177.5 | 153.5 | 1.1 | 113.6 | |||||
| 213 | G | 31.1 | Very low | 38 | Very low | 77 Ų | 77 | 150 Ų | 150 | 79% | 0.794 | 80% | 0.802 | S | S | * | * | trans | 149.3 | 101.5 | 159.2 | 0 | 0 | 0 | 0 | 0 | 117.6 | ||||
| 214 | M | 39.3 | Very low | 38 | Very low | 185 Ų | 185 | 157.7 Ų | 157.7 | 91% | 0.911 | 81% | 0.807 | S | S | * | * | trans | -89.5 | 170.9 | 141.4 | -140.3 | 86 | 165.5 | 0 | 0 | 106.6 | ||||
| 215 | P | 56.3 | Low | 37 | Very low | 98 Ų | 98 | 156.4 Ų | 156.4 | 64% | 0.636 | 81% | 0.812 | S | S | * | * | cis | -136.4 | -177.9 | -8.9 | 42.8 | -26.2 | 0 | 0 | 0 | 115.2 | ||||
| 216 | R | 35 | Very low | 36.9 | Very low | 250 Ų | 250 | 149 Ų | 149 | 94% | 0.943 | 81% | 0.81 | S | S | * | * | trans | 67.3 | 146.5 | 166.3 | -54.8 | -178.9 | -179.9 | -163.9 | -1 | 115.6 | ||||
| 217 | G | 31.2 | Very low | 36.9 | Very low | 62 Ų | 62 | 146.6 Ų | 146.6 | 64% | 0.639 | 81% | 0.81 | S | S | * | * | cis | 156.9 | 154.6 | -5.4 | 0 | 0 | 0 | 0 | 0 | 110 | ||||
| 218 | N | 36.8 | Very low | 36.8 | Very low | 154 Ų | 154 | 147.5 Ų | 147.5 | 82% | 0.824 | 82% | 0.817 | S | S | * | * | trans | 171.8 | 131.7 | 139.1 | -91.6 | -1.4 | 0 | 0 | 0 | 116.9 | ||||
| 219 | L | 36.2 | Very low | 37 | Very low | 149 Ų | 149 | 149.6 Ų | 149.6 | 78% | 0.78 | 82% | 0.818 | S | S | * | * | trans | 48.9 | 116.6 | 144.8 | -73.1 | 87.2 | 0 | 0 | 0 | 122.8 | ||||
| 220 | R | 35.3 | Very low | 36.1 | Very low | 251 Ų | 251 | 148.4 Ų | 148.4 | 95% | 0.947 | 83% | 0.826 | S | S | * | * | -152.4 | 127.1 | 104.3 | -121.8 | 179.6 | -176 | -179.1 | 1.6 | 113 | |||||
| 221 | G | 33.6 | Very low | 36.1 | Very low | 68 Ų | 68 | 139.8 Ų | 139.8 | 70% | 0.701 | 82% | 0.815 | S | S | * | * | trans | 71.2 | 109.7 | 154.4 | 0 | 0 | 0 | 0 | 0 | 117.5 | ||||
| 222 | A | 36.4 | Very low | 36.3 | Very low | 95 Ų | 95 | 145 Ų | 145 | 79% | 0.785 | 82% | 0.823 | S | S | * | * | 59 | 120.5 | 65.9 | 0 | 0 | 0 | 0 | 0 | 112.2 | |||||
| 223 | M | 39.5 | Very low | 36.3 | Very low | 163 Ų | 163 | 137.5 Ų | 137.5 | 80% | 0.803 | 81% | 0.81 | S | S | * | * | cis | -140.1 | 144.5 | 7.9 | -83.2 | -65.7 | -175.9 | 0 | 0 | 109.1 | ||||
| 224 | R | 32.4 | Very low | 36.5 | Very low | 241 Ų | 241 | 145.4 Ų | 145.4 | 91% | 0.909 | 82% | 0.816 | S | S | * | * | 44 | 119.5 | 98 | -150.9 | -171.2 | -153 | -168.5 | 7.4 | 113.2 | |||||
| 225 | G | 30.2 | Very low | 36.1 | Very low | 78 Ų | 78 | 139.7 Ų | 139.7 | 80% | 0.804 | 81% | 0.805 | S | S | * | * | cis | 149.9 | 156.5 | 3.5 | 0 | 0 | 0 | 0 | 0 | 109.4 | ||||
| 226 | G | 33.6 | Very low | 35.1 | Very low | 81 Ų | 81 | 143.1 Ų | 143.1 | 84% | 0.835 | 82% | 0.818 | S | S | * | * | trans | 145.3 | 87.3 | 172.8 | 0 | 0 | 0 | 0 | 0 | 116.8 | ||||
| 227 | T | 37.6 | Very low | 35.3 | Very low | 137 Ų | 137 | 135.5 Ų | 135.5 | 84% | 0.84 | 81% | 0.808 | S | S | * | * | trans | -78.3 | 172.9 | 145.4 | 55.4 | 0 | 0 | 0 | 0 | 108.4 | ||||
| 228 | P | 49 | Very low | 36.4 | Very low | 113 Ų | 113 | 137.6 Ų | 137.6 | 73% | 0.734 | 81% | 0.811 | S | S | * | * | cis | -146.1 | 172.5 | 15.1 | 44.8 | -25.6 | 0 | 0 | 0 | 118.4 | ||||
| 229 | R | 36.1 | Very low | 36.4 | Very low | 247 Ų | 247 | 142 Ų | 142 | 93% | 0.932 | 82% | 0.816 | S | S | * | * | trans | 33.1 | 122 | 132.7 | -164.1 | 177.6 | -169.9 | 155.4 | 2 | 121.6 | ||||
| 230 | G | 31.8 | Very low | 36.2 | Very low | 81 Ų | 81 | 139 Ų | 139 | 84% | 0.835 | 82% | 0.82 | S | S | * | * | trans | 131.3 | 150.1 | 161.8 | 0 | 0 | 0 | 0 | 0 | 111.9 | ||||
| 231 | G | 32.6 | Very low | 36.4 | Very low | 72 Ų | 72 | 131.7 Ų | 131.7 | 74% | 0.742 | 81% | 0.814 | S | S | * | * | cis | 165.4 | 129.2 | -6.6 | 0 | 0 | 0 | 0 | 0 | 111.3 | ||||
| 232 | M | 35.2 | Very low | 37.3 | Very low | 183 Ų | 183 | 134.2 Ų | 134.2 | 90% | 0.901 | 82% | 0.818 | S | S | * | * | trans | 52.1 | 118.2 | 162.6 | -95.8 | 71.5 | 92.1 | 0 | 0 | 123.3 | ||||
| 233 | S | 33.2 | Very low | 37.4 | Very low | 103 Ų | 103 | 134.6 Ų | 134.6 | 72% | 0.72 | 82% | 0.821 | S | S | * | * | 98.7 | 148.1 | 118.3 | -155 | 0 | 0 | 0 | 0 | 122.3 | |||||
| 234 | R | 35.4 | Very low | 37.2 | Very low | 242 Ų | 242 | 130.4 Ų | 130.4 | 91% | 0.913 | 82% | 0.82 | S | S | * | * | trans | 74 | 136.1 | 171.2 | -49.2 | -178.8 | -173.8 | 177 | 1.9 | 116.4 | ||||
| 235 | G | 31.8 | Very low | 37.3 | Very low | 66 Ų | 66 | 131.5 Ų | 131.5 | 68% | 0.68 | 82% | 0.824 | S | S | * | * | cis | 176.8 | -177.4 | -4.8 | 0 | 0 | 0 | 0 | 0 | 113.8 | ||||
| 236 | N | 33.8 | Very low | 37.5 | Very low | 169 Ų | 169 | 131.7 Ų | 131.7 | 90% | 0.904 | 83% | 0.826 | S | S | * | * | trans | 63.7 | 117.8 | 162.6 | -67.5 | 18.3 | 0 | 0 | 0 | 121.5 | ||||
| 237 | A | 39.8 | Very low | 37.8 | Very low | 90 Ų | 90 | 131.4 Ų | 131.4 | 74% | 0.744 | 82% | 0.823 | S | S | * | * | trans | -83.3 | -168.2 | 145.5 | 0 | 0 | 0 | 0 | 0 | 109.2 | ||||
| 238 | P | 54.1 | Low | 38.8 | Very low | 106 Ų | 106 | 131 Ų | 131 | 69% | 0.688 | 82% | 0.823 | S | S | * | * | cis | -146.1 | -173.1 | 2.7 | 44.4 | -24.7 | 0 | 0 | 0 | 117.4 | ||||
| 239 | R | 37.5 | Very low | 39 | Very low | 248 Ų | 248 | 131.6 Ų | 131.6 | 94% | 0.936 | 83% | 0.826 | S | S | * | * | trans | 66.3 | 135.5 | 146.9 | -81.1 | 171.4 | 179.8 | 167.7 | -0 | 121.7 | ||||
| 240 | G | 32.3 | Very low | 39.1 | Very low | 84 Ų | 84 | 125.5 Ų | 125.5 | 87% | 0.866 | 82% | 0.821 | S | S | * | * | trans | 173.7 | 96.7 | 158.4 | 0 | 0 | 0 | 0 | 0 | 115.1 | ||||
| 241 | A | 37.5 | Very low | 39.6 | Very low | 98 Ų | 98 | 126.3 Ų | 126.3 | 81% | 0.81 | 82% | 0.821 | S | S | * | * | trans | -126.5 | -175.5 | 161.3 | 0 | 0 | 0 | 0 | 0 | 107 | ||||
| 242 | P | 53.3 | Low | 39.9 | Very low | 121 Ų | 121 | 127.5 Ų | 127.5 | 79% | 0.786 | 82% | 0.823 | S | S | * | * | cis | -145.8 | -166.3 | 5.5 | 41.1 | -18.7 | 0 | 0 | 0 | 116.7 | ||||
| 243 | A | 39.2 | Very low | 39.9 | Very low | 104 Ų | 104 | 123 Ų | 123 | 86% | 0.86 | 82% | 0.815 | S | S | * | * | trans | 92.2 | 147.8 | 139.3 | 0 | 0 | 0 | 0 | 0 | 124.1 | ||||
| 244 | G | 34.5 | Very low | 40 | Very low | 75 Ų | 75 | 129.7 Ų | 129.7 | 77% | 0.773 | 83% | 0.825 | S | S | * | * | trans | 110.2 | 102 | 168.3 | 0 | 0 | 0 | 0 | 0 | 114 | ||||
| 245 | R | 35.2 | Very low | 39.8 | Very low | 264 Ų | 264 | 122.2 Ų | 122.2 | 100% | 0.996 | 82% | 0.823 | S | S | * | * | cis | 80.4 | 102.9 | 45.4 | -162.5 | -176.6 | -170.4 | -177.3 | 4 | 114.4 | ||||
| 246 | G | 33.9 | Very low | 39.9 | Very low | 82 Ų | 82 | 123 Ų | 123 | 85% | 0.845 | 83% | 0.831 | S | S | * | * | trans | -177.9 | 138 | 169.9 | 0 | 0 | 0 | 0 | 0 | 112.2 | ||||
| 247 | G | 39.7 | Very low | 40.2 | Very low | 75 Ų | 75 | 120.7 Ų | 120.7 | 77% | 0.773 | 83% | 0.828 | S | S | * | * | trans | -101.6 | -172.8 | -170.1 | 0 | 0 | 0 | 0 | 0 | 116.4 | ||||
| 248 | P | 58.6 | Low | 40 | Very low | 129 Ų | 129 | 122.2 Ų | 122.2 | 84% | 0.838 | 83% | 0.833 | S | S | * | * | trans | -98.8 | 164.7 | -163.5 | 39.2 | -37.2 | 0 | 0 | 0 | 115.4 | ||||
| 249 | P | 52.7 | Low | 39.2 | Very low | 125 Ų | 125 | 120.3 Ų | 120.3 | 81% | 0.812 | 83% | 0.833 | S | S | * | * | -138.6 | 172.5 | 127.1 | 36.5 | -22.7 | 0 | 0 | 0 | 111.1 | |||||
| 250 | S | 37.9 | Very low | 39.1 | Very low | 118 Ų | 118 | 120.2 Ų | 120.2 | 83% | 0.825 | 83% | 0.833 | S | S | * | * | cis | -154.2 | 172.8 | -11.4 | 50.3 | 0 | 0 | 0 | 0 | 108.2 | ||||
| 251 | A | 42.3 | Very low | 39.3 | Very low | 99 Ų | 99 | 121.2 Ų | 121.2 | 82% | 0.818 | 83% | 0.827 | S | S | * | * | trans | -132.7 | 142.3 | 163.2 | 0 | 0 | 0 | 0 | 0 | 109.8 | ||||
| 252 | A | 40.5 | Very low | 39.4 | Very low | 97 Ų | 97 | 127.8 Ų | 127.8 | 80% | 0.802 | 83% | 0.83 | S | S | * | * | trans | 174.1 | 145.6 | 141.1 | 0 | 0 | 0 | 0 | 0 | 113.3 | ||||
| 253 | A | 34.5 | Very low | 39.7 | Very low | 89 Ų | 89 | 127.4 Ų | 127.4 | 74% | 0.736 | 83% | 0.828 | S | S | * | * | trans | 69.2 | 158 | 146.1 | 0 | 0 | 0 | 0 | 0 | 119.1 | ||||
| 254 | R | 34.6 | Very low | 40.5 | Very low | 242 Ų | 242 | 128.6 Ų | 128.6 | 91% | 0.913 | 83% | 0.827 | S | S | * | * | cis | -168.8 | 145 | -21.9 | -110 | 175.3 | 169.3 | 164.4 | -5.1 | 107.6 | ||||
| 255 | G | 32.7 | Very low | 40.7 | Very low | 85 Ų | 85 | 129.7 Ų | 129.7 | 88% | 0.876 | 83% | 0.829 | S | S | * | * | trans | 71 | 167 | 161.8 | 0 | 0 | 0 | 0 | 0 | 115.7 | ||||
| 256 | G | 33.5 | Very low | 40.8 | Very low | 82 Ų | 82 | 123 Ų | 123 | 85% | 0.845 | 82% | 0.822 | S | S | * | * | cis | -162 | 163.9 | -0.7 | 0 | 0 | 0 | 0 | 0 | 111.5 | ||||
| 257 | S | 39.8 | Very low | 40.8 | Very low | 121 Ų | 121 | 122.9 Ų | 122.9 | 85% | 0.846 | 82% | 0.822 | S | S | * | * | trans | -80.1 | 149.4 | -171 | 56 | 0 | 0 | 0 | 0 | 115.5 | ||||
| 258 | S | 36.7 | Very low | 40.6 | Very low | 122 Ų | 122 | 123.6 Ų | 123.6 | 85% | 0.853 | 82% | 0.82 | S | S | * | * | trans | -160.4 | 146.8 | 132.8 | 58.9 | 0 | 0 | 0 | 0 | 110.2 | ||||
| 259 | G | 36.7 | Very low | 39.5 | Very low | 67 Ų | 67 | 125.9 Ų | 125.9 | 69% | 0.691 | 82% | 0.82 | S | S | * | * | cis | 139.4 | 110.3 | -13.9 | 0 | 0 | 0 | 0 | 0 | 113.7 | ||||
| 260 | R | 34.8 | Very low | 38.6 | Very low | 246 Ų | 246 | 130.1 Ų | 130.1 | 93% | 0.928 | 82% | 0.82 | S | S | * | * | trans | 167.1 | 146.4 | 155.1 | -98.9 | 166.7 | -178.8 | -133.1 | -0.8 | 109.6 | ||||
| 261 | S | 36.1 | Very low | 38.4 | Very low | 105 Ų | 105 | 132.8 Ų | 132.8 | 73% | 0.734 | 82% | 0.821 | S | S | * | * | cis | -166 | 141.5 | -20.5 | 34.4 | 0 | 0 | 0 | 0 | 110.4 | ||||
| 262 | R | 39.3 | Very low | 38.4 | Very low | 235 Ų | 235 | 135.6 Ų | 135.6 | 89% | 0.887 | 82% | 0.821 | S | S | * | * | trans | -76.1 | -172.4 | 164.1 | -107.7 | 175.5 | 156.8 | -169.4 | -5.7 | 110.6 | ||||
| 263 | P | 59.9 | Low | 38.8 | Very low | 114 Ų | 114 | 137 Ų | 137 | 74% | 0.74 | 82% | 0.822 | S | S | * | * | cis | -117 | -140.2 | -20.5 | 30.2 | -5.9 | 0 | 0 | 0 | 107.7 | ||||
| 264 | P | 56.4 | Low | 38.9 | Very low | 128 Ų | 128 | 137.3 Ų | 137.3 | 83% | 0.831 | 83% | 0.825 | S | S | * | * | cis | -125.8 | -126.4 | -10.5 | 40.6 | -19.4 | 0 | 0 | 0 | 114.8 | ||||
| 265 | A | 37.8 | Very low | 38.8 | Very low | 99 Ų | 99 | 130.4 Ų | 130.4 | 82% | 0.818 | 82% | 0.819 | S | S | * | * | trans | -155.3 | 160.5 | -156.4 | 0 | 0 | 0 | 0 | 0 | 115 | ||||
| 266 | S | 38.1 | Very low | 38.8 | Very low | 122 Ų | 122 | 130.4 Ų | 130.4 | 85% | 0.853 | 81% | 0.811 | S | S | * | * | trans | -157.1 | 149.9 | 145.1 | 52.5 | 0 | 0 | 0 | 0 | 110.2 | ||||
| 267 | G | 34 | Very low | 39.1 | Very low | 81 Ų | 81 | 134.2 Ų | 134.2 | 84% | 0.835 | 81% | 0.811 | S | S | * | * | trans | -74.5 | -152.8 | -166.2 | 0 | 0 | 0 | 0 | 0 | 116.8 | ||||
| 268 | A | 34.7 | Very low | 38.8 | Very low | 90 Ų | 90 | 134 Ų | 134 | 74% | 0.744 | 81% | 0.81 | S | S | * | * | cis | -162.1 | 149 | -6 | 0 | 0 | 0 | 0 | 0 | 109.7 | ||||
| 269 | Q | 36.1 | Very low | 38.8 | Very low | 176 Ų | 176 | 136.9 Ų | 136.9 | 82% | 0.822 | 81% | 0.81 | S | S | * | * | trans | 56 | 146.6 | 150 | -70.8 | -169.8 | -22.1 | 0 | 0 | 123.7 | ||||
| 270 | R | 34.5 | Very low | 38.7 | Very low | 215 Ų | 215 | 142.8 Ų | 142.8 | 81% | 0.811 | 82% | 0.819 | S | S | * | * | trans | 84.5 | 109.1 | 147.6 | -81.5 | 172.4 | 176.8 | -116.7 | -1.1 | 121.3 | ||||
| 271 | M | 33.9 | Very low | 38.6 | Very low | 173 Ų | 173 | 135.9 Ų | 135.9 | 85% | 0.852 | 82% | 0.815 | S | S | * | * | 72.2 | 126.8 | 121.8 | -66.1 | -72.2 | 144.2 | 0 | 0 | 121.1 | |||||
| 272 | L | 40.9 | Very low | 38.2 | Very low | 159 Ų | 159 | 134.4 Ų | 134.4 | 83% | 0.832 | 82% | 0.816 | S | S | * | * | trans | -49.1 | 163.2 | 151.1 | -64.9 | 172.1 | 0 | 0 | 0 | 111.4 | ||||
| 273 | P | 49.9 | Very low | 38.8 | Very low | 126 Ų | 126 | 129.5 Ų | 129.5 | 82% | 0.818 | 82% | 0.815 | S | S | * | * | cis | -152.7 | -166.4 | 44.8 | 43 | -19.7 | 0 | 0 | 0 | 118.1 | ||||
| 274 | A | 36.3 | Very low | 37.4 | Very low | 95 Ų | 95 | 130.2 Ų | 130.2 | 79% | 0.785 | 82% | 0.823 | S | S | * | * | trans | -63.5 | 163.9 | 178.6 | 0 | 0 | 0 | 0 | 0 | 115.3 | ||||
| 275 | A | 33.7 | Very low | 36.3 | Very low | 97 Ų | 97 | 127 Ų | 127 | 80% | 0.802 | 81% | 0.813 | S | S | * | * | 172.6 | 164.2 | 114.1 | 0 | 0 | 0 | 0 | 0 | 113.8 | |||||
| 276 | A | 32.4 | Very low | 36.2 | Very low | 85 Ų | 85 | 127.9 Ų | 127.9 | 70% | 0.702 | 81% | 0.813 | S | S | * | * | trans | 81.2 | 122.6 | 144.7 | 0 | 0 | 0 | 0 | 0 | 122.2 | ||||
| 277 | L | 38.8 | Very low | 35.9 | Very low | 162 Ų | 162 | 129.6 Ų | 129.6 | 85% | 0.848 | 81% | 0.807 | S | S | * | * | trans | 30.7 | 131.7 | 132.5 | -69.9 | 77 | 0 | 0 | 0 | 119.9 | ||||
| 278 | S | 33.4 | Very low | 36.3 | Very low | 118 Ų | 118 | 131.4 Ų | 131.4 | 83% | 0.825 | 80% | 0.804 | S | S | * | * | 177.5 | 168.8 | 97.2 | 47.5 | 0 | 0 | 0 | 0 | 112.4 | |||||
| 279 | H | 37.4 | Very low | 36.2 | Very low | 182 Ų | 182 | 135.5 Ų | 135.5 | 84% | 0.843 | 81% | 0.805 | S | S | * | * | trans | -92.7 | 154 | -171.8 | -71.1 | -101.5 | 0 | 0 | 0 | 113.6 | ||||
| 280 | Q | 33.6 | Very low | 36.2 | Very low | 191 Ų | 191 | 132.9 Ų | 132.9 | 89% | 0.893 | 80% | 0.803 | S | S | * | * | trans | 71.2 | 107.5 | 134.5 | -176.8 | 179.5 | 75.4 | 0 | 0 | 120.6 | ||||
| 281 | A | 32.7 | Very low | 36 | Very low | 101 Ų | 101 | 130.6 Ų | 130.6 | 84% | 0.835 | 80% | 0.802 | S | S | * | * | trans | -168.5 | 141.2 | 132 | 0 | 0 | 0 | 0 | 0 | 111 | ||||
| 282 | G | 27.8 | Very low | 36.7 | Very low | 74 Ų | 74 | 127.3 Ų | 127.3 | 76% | 0.763 | 79% | 0.794 | S | S | * | * | trans | -99.2 | -144.9 | 173.5 | 0 | 0 | 0 | 0 | 0 | 112.3 | ||||
| 283 | P | 51.9 | Low | 36.2 | Very low | 132 Ų | 132 | 127.3 Ų | 127.3 | 86% | 0.857 | 78% | 0.784 | S | S | * | * | cis | -140.7 | -160.1 | -7 | 42.9 | -23.6 | 0 | 0 | 0 | 114.4 | ||||
| 284 | S | 31.6 | Very low | 35.5 | Very low | 129 Ų | 129 | 128.3 Ų | 128.3 | 90% | 0.902 | 78% | 0.782 | S | S | * | * | trans | 96 | 128.6 | 166 | -157.4 | 0 | 0 | 0 | 0 | 117.4 | ||||
| 285 | G | 33.2 | Very low | 35.4 | Very low | 61 Ų | 61 | 129.9 Ų | 129.9 | 63% | 0.629 | 77% | 0.773 | S | S | * | * | cis | -176.6 | 178.2 | -0.8 | 0 | 0 | 0 | 0 | 0 | 116.8 | ||||
| 286 | S | 34.7 | Very low | 35.4 | Very low | 116 Ų | 116 | 135.6 Ų | 135.6 | 81% | 0.811 | 78% | 0.775 | S | S | * | * | trans | 58.2 | 95.1 | 160 | 56.7 | 0 | 0 | 0 | 0 | 122.9 | ||||
| 287 | Q | 32.3 | Very low | 35.4 | Very low | 159 Ų | 159 | 134.7 Ų | 134.7 | 74% | 0.743 | 78% | 0.775 | S | S | * | * | 37.3 | 154.6 | 112.5 | -73.5 | -81 | -52.5 | 0 | 0 | 121.5 | |||||
| 288 | P | 43.4 | Very low | 35.2 | Very low | 118 Ų | 118 | 132.7 Ų | 132.7 | 77% | 0.766 | 77% | 0.774 | S | S | * | * | cis | -137.3 | -177.7 | 20.2 | 38.6 | -17.3 | 0 | 0 | 0 | 118.9 | ||||
| 289 | K | 32.5 | Very low | 35.3 | Very low | 176 Ų | 176 | 137.1 Ų | 137.1 | 77% | 0.765 | 77% | 0.774 | S | S | * | * | trans | -56.3 | 158.3 | -173.1 | -47.3 | 172.8 | 176.6 | 179.7 | 0 | 119.7 | ||||
| 290 | P | 34.8 | Very low | 35.3 | Very low | 121 Ų | 121 | 137.6 Ų | 137.6 | 79% | 0.786 | 78% | 0.777 | S | S | * | * | trans | -101.7 | 169 | 139.9 | 39.3 | -30.6 | 0 | 0 | 0 | 112.5 | ||||
| 291 | E | 31.7 | Very low | 35.3 | Very low | 167 Ų | 167 | 135.8 Ų | 135.8 | 78% | 0.78 | 77% | 0.769 | S | S | * | * | trans | 153.9 | 156.2 | 164 | -91.9 | -73.3 | 134.2 | 0 | 0 | 108.5 | ||||
| 292 | P | 47.8 | Very low | 35.4 | Very low | 105 Ų | 105 | 136.5 Ų | 136.5 | 68% | 0.682 | 77% | 0.767 | S | S | * | * | cis | -138.3 | 173.5 | 5.8 | 45.2 | -28.7 | 0 | 0 | 0 | 117.9 | ||||
| 293 | Y | 29.8 | Very low | 35.8 | Very low | 159 Ų | 159 | 144.1 Ų | 144.1 | 62% | 0.624 | 78% | 0.775 | S | S | * | * | trans | 68.4 | 116.2 | 140.2 | -117.7 | -110.9 | 0 | 0 | 0 | 125.8 | E295 | Y293-E295 HydrophobicContact CD1-CB 4.37Å; Y293-E295 HydrophobicContact CE1-CB 3.88Å; Y293-E295 VanDerWaalsContact CE1-OE2 3.28Å; Y293-E295 WeakPolarHBondContact CE1-OE2 3.46Å; Y293-E295 PolarHBondContact OH-OE2 3.05Å | ||
| 294 | D | 36.8 | Very low | 35.4 | Very low | 147 Ų | 147 | 142.3 Ų | 142.3 | 79% | 0.786 | 77% | 0.771 | S | S | * | * | -176.1 | 107.7 | 113.8 | -87.5 | -25.6 | 0 | 0 | 0 | 105.7 | |||||
| 295 | E | 33.8 | Very low | 35.7 | Very low | 128 Ų | 128 | 145.3 Ų | 145.3 | 60% | 0.598 | 77% | 0.771 | S | S | * | * | 55.9 | 122.5 | 80.9 | -166.1 | 141.3 | -132.7 | 0 | 0 | 112.7 | Y293 | Y293-E295 HydrophobicContact CD1-CB 4.37Å; Y293-E295 HydrophobicContact CE1-CB 3.88Å; Y293-E295 VanDerWaalsContact CE1-OE2 3.28Å; Y293-E295 WeakPolarHBondContact CE1-OE2 3.46Å; Y293-E295 PolarHBondContact OH-OE2 3.05Å | |||
| 296 | Y | 33.7 | Very low | 36.3 | Very low | 216 Ų | 216 | 148.1 Ų | 148.1 | 85% | 0.847 | 78% | 0.778 | S | S | * | * | cis | -155.3 | 160.7 | 21.2 | -167.1 | -115.1 | 0 | 0 | 0 | 112.2 | ||||
| 297 | G | 32.8 | Very low | 36.5 | Very low | 67 Ų | 67 | 148.2 Ų | 148.2 | 69% | 0.691 | 78% | 0.779 | S | S | * | * | trans | 98.8 | 84.1 | 144.5 | 0 | 0 | 0 | 0 | 0 | 120 | ||||
| 298 | S | 34.3 | Very low | 37 | Very low | 120 Ų | 120 | 150.7 Ų | 150.7 | 84% | 0.839 | 78% | 0.783 | S | S | * | * | trans | -132.1 | 116.8 | 148.7 | -171.6 | 0 | 0 | 0 | 0 | 109 | ||||
| 299 | Y | 34.9 | Very low | 37.1 | Very low | 210 Ų | 210 | 153.4 Ų | 153.4 | 82% | 0.824 | 79% | 0.785 | S | S | * | * | trans | -87.4 | 110.9 | 178.9 | -132.4 | -91.8 | 0 | 0 | 0 | 108.1 | E301 | Y299-E301 WeakPolarHBondContact CE1-OE2 3.31Š| ||
| 300 | E | 37.2 | Very low | 37.5 | Very low | 193 Ų | 193 | 147.8 Ų | 147.8 | 90% | 0.902 | 78% | 0.777 | S | S | * | * | trans | -137.4 | 111.6 | 162.5 | -153.1 | 168.7 | -135.1 | 0 | 0 | 107.9 | ||||
| 301 | E | 33.8 | Very low | 37.8 | Very low | 153 Ų | 153 | 151.5 Ų | 151.5 | 72% | 0.715 | 78% | 0.777 | S | S | * | * | trans | -107.6 | 139.5 | -168.4 | -170.1 | 162.8 | -171.8 | 0 | 0 | 110.4 | Y299 Y303 | Y299-E301 WeakPolarHBondContact CE1-OE2 3.31Å; E301-Y303 PolarHBondContact O-N 3.15Å | ||
| 302 | S | 35.7 | Very low | 38.5 | Very low | 115 Ų | 115 | 150.6 Ų | 150.6 | 80% | 0.804 | 78% | 0.777 | S | S | * | * | trans | -55.4 | 130.3 | -166.9 | -52.2 | 0 | 0 | 0 | 0 | 114.8 | ||||
| 303 | Y | 35.8 | Very low | 38.4 | Very low | 235 Ų | 235 | 152.3 Ų | 152.3 | 92% | 0.922 | 78% | 0.781 | S | S | * | * | trans | -127 | 126.7 | 153 | -108.6 | -96.5 | 0 | 0 | 0 | 110 | E301 | E301-Y303 PolarHBondContact O-N 3.15Š| ||
| 304 | A | 41.9 | Very low | 38.9 | Very low | 94 Ų | 94 | 153.6 Ų | 153.6 | 78% | 0.777 | 79% | 0.786 | S | S | * | * | P | Polyproline II helix | trans | -88.1 | 127.2 | 179.7 | 0 | 0 | 0 | 0 | 0 | 110.5 | ||
| 305 | E | 38.1 | Very low | 39.4 | Very low | 191 Ų | 191 | 157.4 Ų | 157.4 | 89% | 0.893 | 79% | 0.791 | S | S | * | * | P | Polyproline II helix | trans | -75.2 | 136.2 | 167.5 | -79.9 | -156.9 | 141.4 | 0 | 0 | 111.3 | ||
| 306 | P | 45.9 | Very low | 40.6 | Very low | 121 Ų | 121 | 156 Ų | 156 | 79% | 0.786 | 80% | 0.795 | S | S | * | * | P | Polyproline II helix | trans | -83.2 | 143.3 | 167 | 33.1 | -31.8 | 0 | 0 | 0 | 111.9 | ||
| 307 | S | 40.1 | Very low | 41.4 | Very low | 118 Ų | 118 | 154 Ų | 154 | 83% | 0.825 | 79% | 0.794 | S | S | * | * | P | Polyproline II helix | trans | -57.4 | 132.5 | -178.4 | -44.4 | 0 | 0 | 0 | 0 | 113.9 | E309 | S307-E309 PolarHBondContact O-N 3.06Š|
| 308 | Y | 41.2 | Very low | 41.9 | Very low | 210 Ų | 210 | 158.6 Ų | 158.6 | 82% | 0.824 | 80% | 0.797 | S | S | * | * | trans | -74.6 | 106.6 | 175 | -169.3 | -92.5 | 0 | 0 | 0 | 111.2 | ||||
| 309 | E | 47.3 | Very low | 42.5 | Very low | 176 Ų | 176 | 158.8 Ų | 158.8 | 82% | 0.822 | 80% | 0.795 | S | S | * | * | trans | -74.1 | 142.7 | 176.6 | -72.4 | -170.5 | 141 | 0 | 0 | 112.6 | S307 | S307-E309 PolarHBondContact O-N 3.06Š| ||
| 310 | G | 40.1 | Very low | 43 | Very low | 57 Ų | 57 | 153.1 Ų | 153.1 | 59% | 0.588 | 79% | 0.792 | S | S | * | * | trans | -73.2 | 140.1 | -173.8 | 0 | 0 | 0 | 0 | 0 | 114.4 | D312 | G310-D312 PolarHBondContact O-N 3.44Š| ||
| 311 | Y | 41.3 | Very low | 43.3 | Very low | 200 Ų | 200 | 149.1 Ų | 149.1 | 78% | 0.784 | 78% | 0.783 | S | S | * | * | G | 310 helix | trans | -78.1 | 17 | -172.9 | -129.4 | -93.2 | 0 | 0 | 0 | 115.2 | ||
| 312 | D | 47.1 | Very low | 44 | Very low | 147 Ų | 147 | 146.5 Ų | 146.5 | 79% | 0.786 | 79% | 0.787 | S | S | * | * | G | 310 helix | trans | -81.4 | -16.3 | -175.5 | -77.4 | -69.3 | 0 | 0 | 0 | 114.4 | G310 | G310-D312 PolarHBondContact O-N 3.44Š|
| 313 | N | 44.4 | Very low | 44.5 | Very low | 142 Ų | 142 | 148.8 Ų | 148.8 | 76% | 0.759 | 79% | 0.79 | S | S | * | * | G | 310 helix | trans | -83.3 | -8.3 | -174 | -94.9 | -28.5 | 0 | 0 | 0 | 115.4 | ||
| 314 | Y | 41.4 | Very low | 44.9 | Very low | 185 Ų | 185 | 143.6 Ų | 143.6 | 73% | 0.725 | 78% | 0.784 | S | S | * | * | G | 310 helix | trans | -82.4 | -17.2 | -176 | -149.3 | -97.4 | 0 | 0 | 0 | 114.1 | ||
| 315 | Y | 47.3 | Very low | 44.9 | Very low | 228 Ų | 228 | 146.6 Ų | 146.6 | 89% | 0.894 | 78% | 0.781 | S | S | * | * | G | 310 helix | trans | -86.4 | -5.6 | -175.7 | -113 | -84.2 | 0 | 0 | 0 | 115.2 | ||
| 316 | S | 59 | Low | 44.7 | Very low | 99 Ų | 99 | 147 Ų | 147 | 69% | 0.692 | 78% | 0.776 | S | S | * | * | S | Bend | trans | -113.4 | 6.8 | -167.2 | -62.1 | 0 | 0 | 0 | 0 | 115.4 | ||
| 317 | Q | 50.4 | Low | 44.3 | Very low | 174 Ų | 174 | 150 Ų | 150 | 81% | 0.813 | 77% | 0.773 | S | S | * | * | S | Bend | trans | -140.8 | 35.5 | -173 | -74.4 | -163.2 | 39.7 | 0 | 0 | 116.7 | ||
| 318 | Q | 42.6 | Very low | 44.3 | Very low | 162 Ų | 162 | 149.7 Ų | 149.7 | 76% | 0.757 | 76% | 0.762 | S | S | * | * | trans | -134.1 | 124.6 | 160.6 | -72.8 | -164.1 | -13.4 | 0 | 0 | 112.8 | ||||
| 319 | P | 46.4 | Very low | 44.4 | Very low | 124 Ų | 124 | 150.3 Ų | 150.3 | 81% | 0.805 | 77% | 0.765 | S | S | * | * | P | Polyproline II helix | trans | -70.7 | 138.4 | 165.1 | 30.5 | -32.2 | 0 | 0 | 0 | 109.6 | ||
| 320 | A | 45.4 | Very low | 43.8 | Very low | 92 Ų | 92 | 144 Ų | 144 | 76% | 0.76 | 75% | 0.748 | S | S | * | * | P | Polyproline II helix | trans | -62.8 | 132.8 | -175.3 | 0 | 0 | 0 | 0 | 0 | 111.9 | A322 | A320-A322 PolarHBondContact O-N 3.28Š|
| 321 | P | 43.4 | Very low | 43.9 | Very low | 109 Ų | 109 | 150.8 Ų | 150.8 | 71% | 0.708 | 76% | 0.763 | S | S | * | * | P | Polyproline II helix | trans | -66.1 | 132.8 | 166.8 | 28.2 | -32.3 | 0 | 0 | 0 | 109.5 | D323 | P321-D323 VanDerWaalsContact C-N 3.32Å; P321-D323 PolarHBondContact O-N 3.21Å |
| 322 | A | 48.9 | Very low | 43.6 | Very low | 98 Ų | 98 | 144.9 Ų | 144.9 | 81% | 0.81 | 76% | 0.764 | S | S | * | * | S | Bend | trans | -76 | 85 | 174.5 | 0 | 0 | 0 | 0 | 0 | 109.9 | A320 | A320-A322 PolarHBondContact O-N 3.28Š|
| 323 | D | 45.6 | Very low | 43 | Very low | 162 Ų | 162 | 147.1 Ų | 147.1 | 87% | 0.866 | 77% | 0.769 | S | S | * | * | trans | -172.2 | 65.2 | 156.3 | -89.8 | -27.2 | 0 | 0 | 0 | 109.1 | P321 | P321-D323 VanDerWaalsContact C-N 3.32Å; P321-D323 PolarHBondContact O-N 3.21Å | ||
| 324 | T | 44.6 | Very low | 42.8 | Very low | 127 Ų | 127 | 144.9 Ų | 144.9 | 78% | 0.779 | 77% | 0.77 | S | S | * | * | trans | -98.3 | 99.5 | 166.7 | 50.7 | 0 | 0 | 0 | 0 | 109.4 | Y326 | T324-Y326 PolarHBondContact O-N 3.01Š| ||
| 325 | E | 42.1 | Very low | 42.6 | Very low | 156 Ų | 156 | 144.9 Ų | 144.9 | 73% | 0.729 | 78% | 0.777 | S | S | * | * | trans | -62.6 | 103.1 | 170.8 | -68.9 | -172.7 | 167.4 | 0 | 0 | 110 | Y327 | E325-Y327 HydrophobicContact CB-CD2 4.31Å; E325-Y327 HydrophobicContact CB-CE2 4Å; E325-Y327 PolarHBondContact O-N 3.07Å; E325-Y327 VanDerWaalsContact O-N 3.07Å | ||
| 326 | Y | 33.8 | Very low | 42.1 | Very low | 199 Ų | 199 | 141.7 Ų | 141.7 | 78% | 0.78 | 78% | 0.776 | S | S | * | * | trans | -73 | 95.4 | 175.1 | -178.5 | -98.3 | 0 | 0 | 0 | 109.3 | T324 D328 | T324-Y326 PolarHBondContact O-N 3.01Å; Y326-D328 VanDerWaalsContact C-N 3.27Å; Y326-D328 HydrophobicContact CD1-CB 3.9Å; Y326-D328 HydrophobicContact CE1-CB 3.7Å; Y326-D328 PolarHBondContact O-N 2.69Å | ||
| 327 | Y | 38.7 | Very low | 41.3 | Very low | 184 Ų | 184 | 142.2 Ų | 142.2 | 72% | 0.722 | 78% | 0.777 | S | S | * | * | trans | -72.6 | 86.3 | 169.3 | -83.7 | -89.8 | 0 | 0 | 0 | 110 | E325 Y329 | E325-Y327 HydrophobicContact CB-CD2 4.31Å; E325-Y327 HydrophobicContact CB-CE2 4Å; E325-Y327 PolarHBondContact O-N 3.07Å; E325-Y327 VanDerWaalsContact O-N 3.07Å; Y327-Y329 PolarHBondContact O-N 2.97Å; Y327-Y329 VanDerWaalsContact O-N 3.09Å | ||
| 328 | D | 39.6 | Very low | 40.7 | Very low | 113 Ų | 113 | 139.1 Ų | 139.1 | 60% | 0.604 | 77% | 0.774 | S | S | * | * | trans | -60.6 | 102.5 | 168.5 | -174.3 | 17.2 | 0 | 0 | 0 | 109.8 | Y326 G330 | Y326-D328 VanDerWaalsContact C-N 3.27Å; Y326-D328 HydrophobicContact CD1-CB 3.9Å; Y326-D328 HydrophobicContact CE1-CB 3.7Å; Y326-D328 PolarHBondContact O-N 2.69Å; D328-G330 PolarHBondContact O-N 3.21Å; D328-G330 PolarHBondContact OD1-N 2.89Å; D328-G330 VanDerWaalsContact OD1-N 3.14Å | ||
| 329 | Y | 42.5 | Very low | 40.3 | Very low | 222 Ų | 222 | 142.2 Ų | 142.2 | 87% | 0.871 | 78% | 0.781 | S | S | * | * | trans | -79.1 | 52.5 | 165.3 | -104.1 | -93.3 | 0 | 0 | 0 | 110.3 | Y327 | Y327-Y329 PolarHBondContact O-N 2.97Å; Y327-Y329 VanDerWaalsContact O-N 3.09Å | ||
| 330 | G | 35 | Very low | 39.9 | Very low | 45 Ų | 45 | 143.4 Ų | 143.4 | 46% | 0.464 | 78% | 0.775 | S | S | . | * | trans | -69.3 | 135.5 | 172.5 | 0 | 0 | 0 | 0 | 0 | 110.6 | D328 G332 | D328-G330 PolarHBondContact O-N 3.21Å; D328-G330 PolarHBondContact OD1-N 2.89Å; D328-G330 VanDerWaalsContact OD1-N 3.14Å; G330-G332 PolarHBondContact O-N 3.49Å; G330-G332 VanDerWaalsContact O-N 3.11Å | ||
| 331 | H | 42.3 | Very low | 39.4 | Very low | 198 Ų | 198 | 144.8 Ų | 144.8 | 92% | 0.917 | 78% | 0.78 | S | S | * | * | trans | -60.1 | 112.5 | -175.8 | -72.5 | -93.5 | 0 | 0 | 0 | 112.4 | ||||
| 332 | G | 35.3 | Very low | 39 | Very low | 77 Ų | 77 | 149.4 Ų | 149.4 | 79% | 0.794 | 78% | 0.784 | S | S | * | * | P | Polyproline II helix | trans | -78.7 | 127.4 | 171.1 | 0 | 0 | 0 | 0 | 0 | 112.2 | G330 | G330-G332 PolarHBondContact O-N 3.49Å; G330-G332 VanDerWaalsContact O-N 3.11Å |
| 333 | E | 33.9 | Very low | 38.3 | Very low | 193 Ų | 193 | 147.9 Ų | 147.9 | 90% | 0.902 | 78% | 0.778 | S | S | * | * | P | Polyproline II helix | trans | -74.4 | 163.8 | -179.2 | -159.4 | 172 | -160.6 | 0 | 0 | 112.6 | ||
| 334 | A | 41.1 | Very low | 38 | Very low | 95 Ų | 95 | 150.1 Ų | 150.1 | 79% | 0.785 | 78% | 0.784 | S | S | * | * | P | Polyproline II helix | trans | -71.9 | 130.7 | -170.3 | 0 | 0 | 0 | 0 | 0 | 114.3 | ||
| 335 | Q | 36.5 | Very low | 37.5 | Very low | 186 Ų | 186 | 147 Ų | 147 | 87% | 0.869 | 78% | 0.777 | S | S | * | * | trans | -137.7 | 119.2 | 155.3 | -73.1 | -168.6 | -11.9 | 0 | 0 | 110.7 | ||||
| 336 | D | 36.3 | Very low | 37.2 | Very low | 161 Ų | 161 | 148.7 Ų | 148.7 | 86% | 0.861 | 79% | 0.785 | S | S | * | * | trans | -59 | 144.5 | 164.2 | -96.2 | -60.4 | 0 | 0 | 0 | 110.7 | ||||
| 337 | P | 42.2 | Very low | 37.5 | Very low | 110 Ų | 110 | 152 Ų | 152 | 71% | 0.714 | 80% | 0.796 | S | S | * | * | -138.2 | 115.9 | 119.4 | 32.8 | -19.4 | 0 | 0 | 0 | 113.7 | |||||
| 338 | S | 38.4 | Very low | 37.3 | Very low | 109 Ų | 109 | 150 Ų | 150 | 76% | 0.762 | 80% | 0.798 | S | S | * | * | trans | 28.2 | 100.9 | 139.1 | 60.1 | 0 | 0 | 0 | 0 | 117.9 | ||||
| 339 | Y | 35 | Very low | 37 | Very low | 227 Ų | 227 | 152 Ų | 152 | 89% | 0.89 | 81% | 0.808 | S | S | * | * | trans | -117.5 | 134 | 156.9 | -164.1 | -96.6 | 0 | 0 | 0 | 110.2 | ||||
| 340 | E | 37 | Very low | 36.6 | Very low | 149 Ų | 149 | 147.4 Ų | 147.4 | 70% | 0.696 | 81% | 0.809 | S | S | * | * | trans | -73.6 | 143.9 | -165.8 | -66.7 | 179.5 | 131.3 | 0 | 0 | 113.8 | Y342 | E340-Y342 HydrophobicContact CB-CE2 4.4Å; E340-Y342 PolarHBondContact O-N 3.48Å | ||
| 341 | S | 34.5 | Very low | 36.4 | Very low | 121 Ų | 121 | 157 Ų | 157 | 85% | 0.846 | 83% | 0.831 | S | S | * | * | trans | -71 | 115.9 | 172.4 | 179.6 | 0 | 0 | 0 | 0 | 110.9 | ||||
| 342 | Y | 36.3 | Very low | 36.1 | Very low | 205 Ų | 205 | 153.4 Ų | 153.4 | 80% | 0.804 | 83% | 0.828 | S | S | * | * | trans | -110.8 | 100.9 | 165 | -88.1 | -87.8 | 0 | 0 | 0 | 111.2 | E340 | E340-Y342 HydrophobicContact CB-CE2 4.4Å; E340-Y342 PolarHBondContact O-N 3.48Å | ||
| 343 | G | 34.7 | Very low | 35.9 | Very low | 67 Ų | 67 | 153.5 Ų | 153.5 | 69% | 0.691 | 83% | 0.829 | S | S | * | * | trans | 52.3 | 110.8 | 139.7 | 0 | 0 | 0 | 0 | 0 | 119.1 | G345 | G343-G345 PolarHBondContact O-N 3.13Š| ||
| 344 | Q | 37.8 | Very low | 35.8 | Very low | 209 Ų | 209 | 149.5 Ų | 149.5 | 98% | 0.977 | 83% | 0.83 | S | S | * | * | trans | -53.4 | 132.1 | 150.4 | -71.8 | 179.8 | -16.3 | 0 | 0 | 109.8 | ||||
| 345 | G | 34.2 | Very low | 35.3 | Very low | 62 Ų | 62 | 148.6 Ų | 148.6 | 64% | 0.639 | 83% | 0.829 | S | S | * | * | trans | -125.8 | 122.2 | 170.5 | 0 | 0 | 0 | 0 | 0 | 109.4 | G343 | G343-G345 PolarHBondContact O-N 3.13Š| ||
| 346 | E | 37.1 | Very low | 35.2 | Very low | 191 Ų | 191 | 145.2 Ų | 145.2 | 89% | 0.893 | 83% | 0.833 | S | S | * | * | trans | -70.2 | 130.6 | -166.8 | -64.3 | 146.4 | 135.9 | 0 | 0 | 112.5 | D348 | E346-D348 PolarHBondContact O-N 2.99Š| ||
| 347 | W | 38.6 | Very low | 35.1 | Very low | 267 Ų | 267 | 140.9 Ų | 140.9 | 100% | 1.011 | 83% | 0.827 | S | S | * | * | trans | -86.6 | 87.8 | 165.6 | -87.5 | 49.9 | 0 | 0 | 0 | 109 | ||||
| 348 | D | 34.9 | Very low | 34.8 | Very low | 144 Ų | 144 | 139.7 Ų | 139.7 | 77% | 0.77 | 84% | 0.835 | S | S | * | * | trans | -97.2 | 148.5 | 172.7 | -153.8 | -6.5 | 0 | 0 | 0 | 112.7 | E346 | E346-D348 PolarHBondContact O-N 2.99Š| ||
| 349 | N | 34.3 | Very low | 34.7 | Very low | 153 Ų | 153 | 144.2 Ų | 144.2 | 82% | 0.818 | 84% | 0.841 | S | S | * | * | trans | -67.9 | 131 | -177.3 | -75.8 | -68.3 | 0 | 0 | 0 | 112 | ||||
| 350 | S | 32.4 | Very low | 35 | Very low | 126 Ų | 126 | 138.1 Ų | 138.1 | 88% | 0.881 | 84% | 0.837 | S | S | * | * | trans | -124.1 | 75.9 | 161.1 | -169.7 | 0 | 0 | 0 | 0 | 111.2 | ||||
| 351 | W | 32.4 | Very low | 35.5 | Very low | 246 Ų | 246 | 136.4 Ų | 136.4 | 93% | 0.932 | 84% | 0.838 | S | S | * | * | trans | -138.4 | 74.5 | 165.5 | -150.9 | -41.1 | 0 | 0 | 0 | 111.1 | ||||
| 352 | S | 34.4 | Very low | 36 | Very low | 123 Ų | 123 | 136.9 Ų | 136.9 | 86% | 0.86 | 84% | 0.839 | S | S | * | * | trans | -168.2 | 140.1 | 162.8 | -86 | 0 | 0 | 0 | 0 | 112.2 | ||||
| 353 | G | 30.9 | Very low | 36.2 | Very low | 79 Ų | 79 | 133.5 Ų | 133.5 | 81% | 0.814 | 84% | 0.84 | S | S | * | * | trans | 93.9 | 85.6 | 147.8 | 0 | 0 | 0 | 0 | 0 | 119.1 | ||||
| 354 | A | 33.3 | Very low | 36.2 | Very low | 110 Ų | 110 | 141.7 Ų | 141.7 | 91% | 0.909 | 85% | 0.85 | S | S | * | * | trans | 0.5 | 137.6 | 147.9 | 0 | 0 | 0 | 0 | 0 | 121.2 | ||||
| 355 | G | 30.1 | Very low | 36.2 | Very low | 75 Ų | 75 | 140.7 Ų | 140.7 | 77% | 0.773 | 85% | 0.845 | S | S | * | * | trans | 155.4 | 104.9 | 146.2 | 0 | 0 | 0 | 0 | 0 | 118.2 | ||||
| 356 | A | 34.5 | Very low | 36.3 | Very low | 115 Ų | 115 | 142.4 Ų | 142.4 | 95% | 0.95 | 85% | 0.847 | S | S | * | * | trans | 64.2 | 151.2 | 152.6 | 0 | 0 | 0 | 0 | 0 | 121.3 | ||||
| 357 | G | 35 | Very low | 36.3 | Very low | 71 Ų | 71 | 143.4 Ų | 143.4 | 73% | 0.732 | 85% | 0.849 | S | S | * | * | trans | 103.2 | 38.3 | 147.5 | 0 | 0 | 0 | 0 | 0 | 119.3 | K359 | G357-K359 PolarHBondContact O-N 3.02Š| ||
| 358 | G | 34.3 | Very low | 36.2 | Very low | 85 Ų | 85 | 134 Ų | 134 | 88% | 0.876 | 84% | 0.835 | S | S | * | * | trans | -60.3 | 121.7 | 174.5 | 0 | 0 | 0 | 0 | 0 | 113.8 | ||||
| 359 | K | 37.1 | Very low | 36.4 | Very low | 204 Ų | 204 | 133.1 Ų | 133.1 | 89% | 0.887 | 84% | 0.84 | S | S | * | * | trans | -129.8 | 130.8 | 161.1 | -73.4 | -173.1 | 177.1 | -179.8 | 0 | 108.9 | G357 | G357-K359 PolarHBondContact O-N 3.02Š| ||
| 360 | A | 41.6 | Very low | 36.8 | Very low | 98 Ų | 98 | 137.1 Ų | 137.1 | 81% | 0.81 | 85% | 0.845 | S | S | * | * | P | Polyproline II helix | trans | -77 | 145.9 | -175.9 | 0 | 0 | 0 | 0 | 0 | 112.2 | ||
| 361 | P | 47.5 | Very low | 37.6 | Very low | 113 Ų | 113 | 142.4 Ų | 142.4 | 73% | 0.734 | 85% | 0.846 | S | S | * | * | P | Polyproline II helix | trans | -76.8 | 150.9 | 174.4 | 32.2 | -34.5 | 0 | 0 | 0 | 111.9 | ||
| 362 | P | 44.5 | Very low | 38.7 | Very low | 131 Ų | 131 | 139.7 Ų | 139.7 | 85% | 0.851 | 84% | 0.843 | S | S | * | * | P | Polyproline II helix | trans | -75.4 | 158.2 | 177.8 | 31.9 | -35.1 | 0 | 0 | 0 | 112.8 | ||
| 363 | T | 40.2 | Very low | 39.8 | Very low | 134 Ų | 134 | 141.9 Ų | 141.9 | 82% | 0.822 | 84% | 0.84 | S | S | * | * | P | Polyproline II helix | trans | -99.6 | 168.2 | -177.7 | 50.1 | 0 | 0 | 0 | 0 | 113.5 | ||
| 364 | R | 35 | Very low | 40.8 | Very low | 239 Ų | 239 | 143.3 Ų | 143.3 | 90% | 0.902 | 84% | 0.835 | S | S | * | * | trans | 76.3 | 144.8 | -175.9 | -68.3 | -178.9 | 161.9 | -175.7 | -4.6 | 114 | ||||
| 365 | Q | 37.7 | Very low | 41.8 | Very low | 189 Ų | 189 | 148.7 Ų | 148.7 | 88% | 0.883 | 83% | 0.833 | S | S | * | * | cis | -131.9 | -172.8 | 24.5 | -71.5 | -177.7 | 3.7 | 0 | 0 | 114.7 | ||||
| 366 | S | 35.8 | Very low | 42.7 | Very low | 97 Ų | 97 | 151.3 Ų | 151.3 | 68% | 0.678 | 83% | 0.834 | S | S | * | * | trans | -110.1 | 157.2 | -162.9 | 56.9 | 0 | 0 | 0 | 0 | 115.5 | ||||
| 367 | K | 38.1 | Very low | 43.2 | Very low | 213 Ų | 213 | 156.6 Ų | 156.6 | 93% | 0.926 | 83% | 0.829 | S | S | * | * | trans | 70.9 | 132.5 | 160.4 | -64.2 | 178.6 | 176.7 | -178.3 | 0 | 118 | ||||
| 368 | G | 35.8 | Very low | 43.6 | Very low | 70 Ų | 70 | 167.9 Ų | 167.9 | 72% | 0.722 | 85% | 0.852 | S | S | * | * | trans | 160.9 | 112.6 | 158 | 0 | 0 | 0 | 0 | 0 | 115.4 | ||||
| 369 | S | 39.1 | Very low | 44 | Very low | 125 Ų | 125 | 172.1 Ų | 172.1 | 87% | 0.874 | 85% | 0.85 | S | S | * | * | trans | 66.6 | 97.1 | 153.1 | -50 | 0 | 0 | 0 | 0 | 120.1 | ||||
| 370 | Y | 43.2 | Very low | 44.4 | Very low | 237 Ų | 237 | 170.4 Ų | 170.4 | 93% | 0.929 | 85% | 0.849 | S | S | * | * | P | Polyproline II helix | trans | -63.9 | 145.4 | 150.4 | -90.3 | -105.9 | 0 | 0 | 0 | 109.9 | ||
| 371 | R | 48.2 | Very low | 44.5 | Very low | 236 Ų | 236 | 174.4 Ų | 174.4 | 89% | 0.891 | 85% | 0.851 | S | S | * | * | P | Polyproline II helix | trans | -102.3 | 116.7 | 174 | -151.3 | 178.7 | -166.6 | -174.8 | 3.6 | 108 | ||
| 372 | E | 57.4 | Low | 44.4 | Very low | 190 Ų | 190 | 178 Ų | 178 | 89% | 0.888 | 86% | 0.858 | S | S | * | * | P | Polyproline II helix | trans | -72 | 147.9 | 179 | -70.8 | -176.6 | 134.8 | 0 | 0 | 111.7 | ||
| 373 | H | 56.6 | Low | 44.4 | Very low | 168 Ų | 168 | 180.9 Ų | 180.9 | 78% | 0.778 | 86% | 0.858 | S | S | * | * | P | Polyproline II helix | trans | -93.8 | 143.2 | 179.3 | -83.7 | -85.3 | 0 | 0 | 0 | 111.3 | Y375 | H373-Y375 VanDerWaalsContact C-N 3.26Å; H373-Y375 PolarHBondContact O-N 2.78Å |
| 374 | P | 52.5 | Low | 44.6 | Very low | 110 Ų | 110 | 184.1 Ų | 184.1 | 71% | 0.714 | 86% | 0.86 | S | S | * | * | S | Bend | trans | -78.7 | 13.2 | -158 | 31.6 | -38.3 | 0 | 0 | 0 | 116.5 | ||
| 375 | Y | 53.8 | Low | 45.3 | Very low | 223 Ų | 223 | 180.1 Ų | 180.1 | 88% | 0.875 | 86% | 0.857 | S | S | * | * | trans | -135.8 | 86.4 | 179.6 | -69.1 | -73.7 | 0 | 0 | 0 | 111.7 | H373 | H373-Y375 VanDerWaalsContact C-N 3.26Å; H373-Y375 PolarHBondContact O-N 2.78Å | ||
| 376 | V | 48.2 | Very low | 45.9 | Very low | 129 Ų | 129 | 179.5 Ų | 179.5 | 78% | 0.782 | 86% | 0.855 | S | S | * | * | trans | -116 | 104.9 | 163 | 179 | 0 | 0 | 0 | 0 | 108.1 | ||||
| 377 | R | 45.1 | Very low | 46.8 | Very low | 227 Ų | 227 | 186.3 Ų | 186.3 | 86% | 0.857 | 87% | 0.87 | S | S | * | * | trans | 39.7 | 125.9 | 158.5 | -58.3 | -170.7 | -176.8 | -158 | 1.5 | 119.8 | ||||
| 378 | Y | 43.2 | Very low | 47.5 | Very low | 308 Ų | 308 | 183.9 Ų | 183.9 | 100% | 1.208 | 87% | 0.865 | S | S | * | * | -94.6 | 0 | 121 | -82.7 | -88.5 | 0 | 0 | 0 | 108.4 |
Retrieved 378 of 378 residues in 319.3 ms
(Link to these results)