| Site | Residue | pLDDT | pLDDT confidence | pLDDT10 | pLDDT10 confidence | SASA | SASA [Ų] | SASA10 | SASA10 [Ų] | RSA | RSA unformatted | RSA10 | RSA10 unformatted | Surface | Surface10 (not used) | Disorder (not used) | Disorder | Sec. str. | Secondary structure | Isomer | Phi (φ) | Psi (ψ) | Omega (ω) | Chi 1 (χ1) | Chi 2 (χ2) | Chi 3 (χ3) | Chi 4 (χ4) | Chi 5 (χ5) | Tau (τ) | Contacts (colored by PAE) | Contact details |
|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|
| 1 | M | 50.5 | Low | 58.1 | Low | 207 Ų | 207 | 140.4 Ų | 140.4 | 100% | 1.02 | 69% | 0.689 | S | S | * | * | 0 | 87.5 | 0 | -74.4 | 179.1 | 82.6 | 0 | 0 | 110.8 | |||||
| 2 | S | 46.5 | Very low | 59.5 | Low | 83 Ų | 83 | 143.3 Ų | 143.3 | 58% | 0.58 | 69% | 0.687 | S | S | * | * | trans | -151.9 | 58.7 | 165 | 63.7 | 0 | 0 | 0 | 0 | 109.6 | Q4 | S2-Q4 PolarHBondContact O-N 3.24Š| ||
| 3 | Y | 47.1 | Very low | 60.8 | Low | 233 Ų | 233 | 145.9 Ų | 145.9 | 91% | 0.914 | 69% | 0.685 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -72.2 | 6.6 | -175.1 | -72.9 | -82.1 | 0 | 0 | 0 | 114.3 | ||
| 4 | Q | 54.5 | Low | 61.3 | Low | 188 Ų | 188 | 140.2 Ų | 140.2 | 88% | 0.879 | 66% | 0.66 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -135 | -1.3 | -176.4 | -72.4 | 179 | -9.8 | 0 | 0 | 115.5 | S2 K6 | S2-Q4 PolarHBondContact O-N 3.24Å; Q4-K6 PolarHBondContact O-N 2.98Å |
| 5 | I | 54.8 | Low | 62 | Low | 120 Ų | 120 | 138.8 Ų | 138.8 | 62% | 0.615 | 65% | 0.651 | S | S | * | * | trans | -90.3 | 94.4 | 169 | -52.9 | 176.7 | 0 | 0 | 0 | 106 | S7 | I5-S7 PolarHBondContact O-N 3.33Š| ||
| 6 | K | 58.7 | Low | 62.9 | Low | 196 Ų | 196 | 135 Ų | 135 | 85% | 0.852 | 64% | 0.636 | S | S | * | * | trans | -49.3 | 111.2 | 165.2 | -69 | -178.6 | 179.9 | 179.7 | 0 | 106.1 | Q4 T8 | Q4-K6 PolarHBondContact O-N 2.98Å; K6-T8 PolarHBondContact O-N 3.15Å | ||
| 7 | S | 54.5 | Low | 63.4 | Low | 77 Ų | 77 | 133.9 Ų | 133.9 | 54% | 0.538 | 63% | 0.63 | S | S | . | * | trans | -50.7 | 111.4 | -174.5 | 58.3 | 0 | 0 | 0 | 0 | 108.2 | I5 | I5-S7 PolarHBondContact O-N 3.33Š| ||
| 8 | T | 64.1 | Low | 63.5 | Low | 65 Ų | 65 | 127.8 Ų | 127.8 | 40% | 0.399 | 61% | 0.605 | S | S | . | * | trans | -61.3 | 147 | 177.1 | 54.3 | 0 | 0 | 0 | 0 | 107.8 | K6 Y10 F11 R12 | K6-T8 PolarHBondContact O-N 3.15Å; T8-Y10 PolarHBondContact O-N 3.15Å; T8-F11 PolarHBondContact O-N 2.81Å; T8-F11 WeakPolarHBondContact OG1-CD2 3.42Å; T8-R12 PolarHBondContact O-N 3.07Å | ||
| 9 | P | 70.7 | Confident | 63.9 | Low | 99 Ų | 99 | 129 Ų | 129 | 64% | 0.643 | 61% | 0.607 | S | S | * | * | H | α-helix | trans | -50.7 | -27.3 | 179.4 | -26.8 | 33.2 | 0 | 0 | 0 | 113 | R13 | P9-R13 WeakPolarHBondContact O-CG 3.23Å; P9-R13 PolarHBondContact O-N 3.37Å; P9-R13 VanDerWaalsContact O-N 3.14Å |
| 10 | Y | 69.4 | Low | 64.4 | Low | 154 Ų | 154 | 131.6 Ų | 131.6 | 60% | 0.604 | 62% | 0.616 | S | S | * | * | H | α-helix | trans | -61.1 | -50.2 | 172.5 | -173.7 | -105.5 | 0 | 0 | 0 | 113.7 | T8 R12 R13 M14 | T8-Y10 PolarHBondContact O-N 3.15Å; Y10-R12 VanDerWaalsContact C-N 3.28Å; Y10-R12 PolarHBondContact O-N 2.99Å; Y10-R13 PolarHBondContact O-N 3.47Å; Y10-M14 HydrophobicContact CD1-CE 3.58Å; Y10-M14 HydrophobicContact CD1-CG 4.48Å; Y10-M14 HydrophobicContact CD1-SD 4.08Å; Y10-M14 HydrophobicContact CE1-CE 3.3Å; Y10-M14 HydrophobicContact CE1-CG 4.11Å; Y10-M14 HydrophobicContact CE1-SD 3.33Å; Y10-M14 WeakPolarHBondContact CE1-SD 3.38Å; Y10-M14 VanDerWaalsContact CZ-SD 3.57Å; Y10-M14 PolarHBondContact O-N 3.23Å |
| 11 | F | 68.4 | Low | 65 | Low | 122 Ų | 122 | 130.3 Ų | 130.3 | 54% | 0.535 | 61% | 0.614 | S | S | . | * | H | α-helix | trans | -62.2 | -36 | 177.2 | -92.1 | -80.3 | 0 | 0 | 0 | 112.4 | T8 M14 F15 | T8-F11 PolarHBondContact O-N 2.81Å; T8-F11 WeakPolarHBondContact OG1-CD2 3.42Å; F11-M14 HydrophobicContact CD1-CE 3.82Å; F11-M14 HydrophobicContact CE1-CE 3.95Å; F11-M14 HydrophobicContact CG-CE 4.17Å; F11-M14 HydrophobicContact CZ-CE 4.4Å; F11-M14 PolarHBondContact O-N 3.09Å; F11-F15 VanDerWaalsContact O-CB 3.29Å; F11-F15 WeakPolarHBondContact O-CB 3.31Å; F11-F15 PolarHBondContact O-N 3.5Å |
| 12 | R | 75.1 | Confident | 66.7 | Low | 176 Ų | 176 | 121.6 Ų | 121.6 | 66% | 0.664 | 58% | 0.577 | S | S | * | * | H | α-helix | trans | -67.7 | -38.2 | 177.8 | -145.9 | 175 | -170.4 | -142.4 | 2.5 | 111.8 | T8 Y10 N16 | T8-R12 PolarHBondContact O-N 3.07Å; Y10-R12 VanDerWaalsContact C-N 3.28Å; Y10-R12 PolarHBondContact O-N 2.99Å; R12-N16 WeakPolarHBondContact O-CB 3.45Å; R12-N16 PolarHBondContact O-N 2.98Å; R12-N16 VanDerWaalsContact O-N 3.09Å; R12-N16 PolarHBondContact O-ND2 3.12Å |
| 13 | R | 76.5 | Confident | 68.2 | Low | 177 Ų | 177 | 122.6 Ų | 122.6 | 67% | 0.668 | 57% | 0.573 | S | S | * | * | H | α-helix | trans | -67.1 | -47.3 | 173.4 | -72.5 | -177.8 | -163.5 | 169.9 | 4.4 | 111.8 | P9 Y10 F15 N16 E17 | P9-R13 WeakPolarHBondContact O-CG 3.23Å; P9-R13 PolarHBondContact O-N 3.37Å; P9-R13 VanDerWaalsContact O-N 3.14Å; Y10-R13 PolarHBondContact O-N 3.47Å; R13-F15 VanDerWaalsContact C-N 3.33Å; R13-F15 PolarHBondContact O-N 2.75Å; R13-N16 PolarHBondContact O-N 3.49Å; R13-E17 WeakPolarHBondContact O-CB 3.42Å; R13-E17 WeakPolarHBondContact O-CG 3.42Å; R13-E17 PolarHBondContact O-N 3.47Å |
| 14 | M | 67.8 | Low | 69.8 | Low | 66 Ų | 66 | 113.7 Ų | 113.7 | 33% | 0.325 | 54% | 0.541 | S | S | . | . | H | α-helix | trans | -60.8 | -40.7 | 177.3 | -72.7 | -164 | -57.1 | 0 | 0 | 112.5 | Y10 F11 E17 S18 | Y10-M14 HydrophobicContact CD1-CE 3.58Å; Y10-M14 HydrophobicContact CD1-CG 4.48Å; Y10-M14 HydrophobicContact CD1-SD 4.08Å; Y10-M14 HydrophobicContact CE1-CE 3.3Å; Y10-M14 HydrophobicContact CE1-CG 4.11Å; Y10-M14 HydrophobicContact CE1-SD 3.33Å; Y10-M14 WeakPolarHBondContact CE1-SD 3.38Å; Y10-M14 VanDerWaalsContact CZ-SD 3.57Å; Y10-M14 PolarHBondContact O-N 3.23Å; F11-M14 HydrophobicContact CD1-CE 3.82Å; F11-M14 HydrophobicContact CE1-CE 3.95Å; F11-M14 HydrophobicContact CG-CE 4.17Å; F11-M14 HydrophobicContact CZ-CE 4.4Å; F11-M14 PolarHBondContact O-N 3.09Å; M14-E17 PolarHBondContact O-N 3.38Å; M14-S18 VanDerWaalsContact O-CB 3.27Å; M14-S18 WeakPolarHBondContact O-CB 3.3Å; M14-S18 PolarHBondContact O-N 3.31Å |
| 15 | F | 71.6 | Confident | 71.2 | Confident | 119 Ų | 119 | 109.7 Ų | 109.7 | 52% | 0.522 | 52% | 0.522 | S | S | . | . | H | α-helix | trans | -65.2 | -43.2 | 176.8 | -175.5 | -97.1 | 0 | 0 | 0 | 111.8 | F11 R13 S18 K19 L24 | F11-F15 VanDerWaalsContact O-CB 3.29Å; F11-F15 WeakPolarHBondContact O-CB 3.31Å; F11-F15 PolarHBondContact O-N 3.5Å; R13-F15 VanDerWaalsContact C-N 3.33Å; R13-F15 PolarHBondContact O-N 2.75Å; F15-S18 PolarHBondContact O-N 2.96Å; F15-K19 WeakPolarHBondContact O-CB 3.39Å; F15-K19 PolarHBondContact O-N 3.46Å; F15-L24 HydrophobicContact CD2-CD1 4.01Å; F15-L24 HydrophobicContact CE2-CD1 3.69Å; F15-L24 HydrophobicContact CE2-CD2 4.29Å; F15-L24 HydrophobicContact CZ-CD1 4.01Å |
| 16 | N | 75.4 | Confident | 72.6 | Confident | 78 Ų | 78 | 112.7 Ų | 112.7 | 42% | 0.417 | 53% | 0.525 | S | S | . | . | H | α-helix | trans | -68.1 | -37.1 | 177.7 | -72.3 | -18.6 | 0 | 0 | 0 | 112.4 | R12 R13 K19 K20 | R12-N16 WeakPolarHBondContact O-CB 3.45Å; R12-N16 PolarHBondContact O-N 2.98Å; R12-N16 VanDerWaalsContact O-N 3.09Å; R12-N16 PolarHBondContact O-ND2 3.12Å; R13-N16 PolarHBondContact O-N 3.49Å; N16-K19 PolarHBondContact O-N 3.05Å; N16-K20 WeakPolarHBondContact O-CB 3.48Å; N16-K20 VanDerWaalsContact O-CG 3.31Å; N16-K20 WeakPolarHBondContact O-CG 3.27Å; N16-K20 PolarHBondContact O-N 2.96Å |
| 17 | E | 71.7 | Confident | 73.8 | Confident | 116 Ų | 116 | 109 Ų | 109 | 54% | 0.542 | 51% | 0.514 | S | S | . | . | H | α-helix | trans | -67 | -42.3 | 173 | -79.3 | 172.6 | -179.3 | 0 | 0 | 111.6 | R13 M14 K19 K20 N21 | R13-E17 WeakPolarHBondContact O-CB 3.42Å; R13-E17 WeakPolarHBondContact O-CG 3.42Å; R13-E17 PolarHBondContact O-N 3.47Å; M14-E17 PolarHBondContact O-N 3.38Å; E17-K19 VanDerWaalsContact C-N 3.31Å; E17-K19 PolarHBondContact O-N 2.9Å; E17-K20 PolarHBondContact O-N 3.42Å; E17-N21 VanDerWaalsContact O-CB 3.24Å; E17-N21 WeakPolarHBondContact O-CB 3.41Å; E17-N21 PolarHBondContact O-N 2.83Å; E17-N21 PolarHBondContact O-ND2 3.42Å |
| 18 | S | 64.9 | Low | 75.3 | Confident | 24 Ų | 24 | 113.6 Ų | 113.6 | 17% | 0.168 | 52% | 0.52 | C | S | . | . | H | α-helix | trans | -66.1 | -32.9 | 176.3 | -165.6 | 0 | 0 | 0 | 0 | 112.6 | M14 F15 G22 Q23 L24 | M14-S18 VanDerWaalsContact O-CB 3.27Å; M14-S18 WeakPolarHBondContact O-CB 3.3Å; M14-S18 PolarHBondContact O-N 3.31Å; F15-S18 PolarHBondContact O-N 2.96Å; S18-G22 PolarHBondContact O-N 3.48Å; S18-Q23 PolarHBondContact O-N 3.32Å; S18-Q23 WeakPolarHBondContact OG-CB 3.42Å; S18-Q23 PolarHBondContact OG-OE1 2.82Å; S18-L24 PolarHBondContact O-N 3.28Å |
| 19 | K | 72.8 | Confident | 76.4 | Confident | 151 Ų | 151 | 113.3 Ų | 113.3 | 66% | 0.657 | 52% | 0.516 | S | S | * | . | H | α-helix | trans | -67.8 | -44.4 | 172.4 | -168.1 | 178.2 | 180 | -178.1 | 0 | 111.2 | F15 N16 E17 G22 L24 | F15-K19 WeakPolarHBondContact O-CB 3.39Å; F15-K19 PolarHBondContact O-N 3.46Å; N16-K19 PolarHBondContact O-N 3.05Å; E17-K19 VanDerWaalsContact C-N 3.31Å; E17-K19 PolarHBondContact O-N 2.9Å; K19-G22 PolarHBondContact O-N 2.92Å; K19-L24 HydrophobicContact CB-CD1 3.97Å |
| 20 | K | 73.1 | Confident | 77.1 | Confident | 180 Ų | 180 | 112.9 Ų | 112.9 | 78% | 0.783 | 51% | 0.505 | S | S | * | . | H | α-helix | trans | -68.9 | -33.5 | 177.1 | -73.3 | 178.8 | 179.9 | -172.4 | 0 | 113.2 | N16 E17 G22 | N16-K20 WeakPolarHBondContact O-CB 3.48Å; N16-K20 VanDerWaalsContact O-CG 3.31Å; N16-K20 WeakPolarHBondContact O-CG 3.27Å; N16-K20 PolarHBondContact O-N 2.96Å; E17-K20 PolarHBondContact O-N 3.42Å; K20-G22 VanDerWaalsContact C-N 3.27Å; K20-G22 PolarHBondContact O-N 3.27Å |
| 21 | N | 77.9 | Confident | 78 | Confident | 105 Ų | 105 | 113.3 Ų | 113.3 | 56% | 0.561 | 51% | 0.507 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -84.1 | 2.8 | -179.6 | -67.9 | -16.5 | 0 | 0 | 0 | 113.5 | E17 Q23 | E17-N21 VanDerWaalsContact O-CB 3.24Å; E17-N21 WeakPolarHBondContact O-CB 3.41Å; E17-N21 PolarHBondContact O-N 2.83Å; E17-N21 PolarHBondContact O-ND2 3.42Å; N21-Q23 HydrophobicContact CB-CG 4.34Å; N21-Q23 PolarHBondContact O-N 2.93Å; N21-Q23 VanDerWaalsContact O-N 3.07Å |
| 22 | G | 84.8 | Confident | 78.8 | Confident | 24 Ų | 24 | 112.8 Ų | 112.8 | 25% | 0.247 | 51% | 0.506 | C | S | . | . | T | Hydrogen-bonded Turn | trans | 66.5 | 7.2 | 179.2 | 0 | 0 | 0 | 0 | 0 | 114.9 | S18 K19 K20 L24 Q25 R26 | S18-G22 PolarHBondContact O-N 3.48Å; K19-G22 PolarHBondContact O-N 2.92Å; K20-G22 VanDerWaalsContact C-N 3.27Å; K20-G22 PolarHBondContact O-N 3.27Å; G22-L24 VanDerWaalsContact C-N 3.32Å; G22-L24 PolarHBondContact O-N 2.87Å; G22-Q25 WeakPolarHBondContact O-CB 3.21Å; G22-Q25 PolarHBondContact O-N 2.96Å; G22-R26 WeakPolarHBondContact O-CG 3.4Å; G22-R26 PolarHBondContact O-N 3.06Å |
| 23 | Q | 78.4 | Confident | 79.3 | Confident | 105 Ų | 105 | 111.1 Ų | 111.1 | 49% | 0.491 | 50% | 0.5 | S | S | . | . | H | α-helix | trans | -65.6 | -37.8 | 179 | -73.4 | 177.8 | -10.5 | 0 | 0 | 111.4 | S18 N21 Q25 R26 L27 | S18-Q23 PolarHBondContact O-N 3.32Å; S18-Q23 WeakPolarHBondContact OG-CB 3.42Å; S18-Q23 PolarHBondContact OG-OE1 2.82Å; N21-Q23 HydrophobicContact CB-CG 4.34Å; N21-Q23 PolarHBondContact O-N 2.93Å; N21-Q23 VanDerWaalsContact O-N 3.07Å; Q23-Q25 VanDerWaalsContact C-N 3.3Å; Q23-Q25 PolarHBondContact O-N 2.91Å; Q23-R26 PolarHBondContact O-N 2.98Å; Q23-L27 WeakPolarHBondContact O-CB 3.42Å; Q23-L27 WeakPolarHBondContact O-CG 3.42Å; Q23-L27 PolarHBondContact O-N 3.11Å |
| 24 | L | 79.8 | Confident | 79.4 | Confident | 46 Ų | 46 | 107.4 Ų | 107.4 | 24% | 0.241 | 49% | 0.492 | C | S | . | . | H | α-helix | trans | -63.8 | -35.6 | 173.1 | -85 | 164.3 | 0 | 0 | 0 | 112.3 | F15 S18 K19 G22 R28 | F15-L24 HydrophobicContact CD2-CD1 4.01Å; F15-L24 HydrophobicContact CE2-CD1 3.69Å; F15-L24 HydrophobicContact CE2-CD2 4.29Å; F15-L24 HydrophobicContact CZ-CD1 4.01Å; S18-L24 PolarHBondContact O-N 3.28Å; K19-L24 HydrophobicContact CB-CD1 3.97Å; G22-L24 VanDerWaalsContact C-N 3.32Å; G22-L24 PolarHBondContact O-N 2.87Å; L24-R28 WeakPolarHBondContact O-CG 3.45Å; L24-R28 PolarHBondContact O-N 3.33Å; L24-R28 VanDerWaalsContact O-N 3.14Å |
| 25 | Q | 83.9 | Confident | 80.1 | Confident | 104 Ų | 104 | 108.9 Ų | 108.9 | 49% | 0.486 | 50% | 0.498 | S | S | . | . | H | α-helix | trans | -69.3 | -47.9 | 175.9 | -170.3 | 61.4 | 39.8 | 0 | 0 | 110.6 | G22 Q23 L27 R28 D29 | G22-Q25 WeakPolarHBondContact O-CB 3.21Å; G22-Q25 PolarHBondContact O-N 2.96Å; Q23-Q25 VanDerWaalsContact C-N 3.3Å; Q23-Q25 PolarHBondContact O-N 2.91Å; Q25-L27 VanDerWaalsContact C-N 3.25Å; Q25-L27 PolarHBondContact O-N 2.96Å; Q25-R28 WeakPolarHBondContact O-CA 3.37Å; Q25-R28 WeakPolarHBondContact O-CB 3.44Å; Q25-R28 PolarHBondContact O-N 3.24Å; Q25-D29 PolarHBondContact NE2-OD1 2.98Å; Q25-D29 PolarHBondContact O-N 2.94Å |
| 26 | R | 84.7 | Confident | 80.7 | Confident | 182 Ų | 182 | 108.9 Ų | 108.9 | 69% | 0.687 | 50% | 0.5 | S | S | * | . | H | α-helix | trans | -57.5 | -37.7 | 176 | -69.5 | 179.3 | -175.5 | -179.2 | 2.2 | 112.9 | G22 Q23 E30 | G22-R26 WeakPolarHBondContact O-CG 3.4Å; G22-R26 PolarHBondContact O-N 3.06Å; Q23-R26 PolarHBondContact O-N 2.98Å; R26-E30 VanDerWaalsContact O-CB 3.26Å; R26-E30 WeakPolarHBondContact O-CB 3.47Å; R26-E30 PolarHBondContact O-N 3.08Å |
| 27 | L | 84.8 | Confident | 81.1 | Confident | 118 Ų | 118 | 112.2 Ų | 112.2 | 62% | 0.618 | 51% | 0.511 | S | S | * | . | H | α-helix | trans | -67.5 | -36.4 | 175 | -81.5 | 167 | 0 | 0 | 0 | 112.6 | Q23 Q25 Y31 | Q23-L27 WeakPolarHBondContact O-CB 3.42Å; Q23-L27 WeakPolarHBondContact O-CG 3.42Å; Q23-L27 PolarHBondContact O-N 3.11Å; Q25-L27 VanDerWaalsContact C-N 3.25Å; Q25-L27 PolarHBondContact O-N 2.96Å; L27-Y31 WeakPolarHBondContact O-CB 3.44Å; L27-Y31 PolarHBondContact O-N 3.39Å |
| 28 | R | 85.7 | Confident | 81.6 | Confident | 174 Ų | 174 | 111 Ų | 111 | 66% | 0.657 | 51% | 0.508 | S | S | * | . | H | α-helix | trans | -66 | -49.4 | 173.4 | -72.6 | 174.5 | -177.4 | -129.5 | 0.9 | 110.9 | L24 Q25 E30 Y31 E32 | L24-R28 WeakPolarHBondContact O-CG 3.45Å; L24-R28 PolarHBondContact O-N 3.33Å; L24-R28 VanDerWaalsContact O-N 3.14Å; Q25-R28 WeakPolarHBondContact O-CA 3.37Å; Q25-R28 WeakPolarHBondContact O-CB 3.44Å; Q25-R28 PolarHBondContact O-N 3.24Å; R28-E30 VanDerWaalsContact C-N 3.27Å; R28-E30 PolarHBondContact O-N 3.36Å; R28-Y31 PolarHBondContact O-N 3.06Å; R28-Y31 VanDerWaalsContact O-N 3.15Å; R28-E32 PolarHBondContact O-N 3.04Å |
| 29 | D | 87.8 | Confident | 82.5 | Confident | 60 Ų | 60 | 113.9 Ų | 113.9 | 32% | 0.321 | 52% | 0.522 | S | S | . | . | H | α-helix | trans | -64.1 | -32.3 | -179.9 | -53.2 | -16.7 | 0 | 0 | 0 | 112 | Q25 R33 | Q25-D29 PolarHBondContact NE2-OD1 2.98Å; Q25-D29 PolarHBondContact O-N 2.94Å; D29-R33 WeakPolarHBondContact O-CB 3.34Å; D29-R33 WeakPolarHBondContact O-CG 3.36Å; D29-R33 PolarHBondContact O-N 2.9Å; D29-R33 VanDerWaalsContact O-N 3.15Å; D29-R33 PolarHBondContact O-NE 3.18Å; D29-R33 VanDerWaalsContact O-NE 3.15Å |
| 30 | E | 85.2 | Confident | 83.3 | Confident | 89 Ų | 89 | 115.5 Ų | 115.5 | 42% | 0.416 | 52% | 0.524 | S | S | . | . | H | α-helix | trans | -72.8 | -41.1 | 174.1 | -165.6 | 67.2 | -158.2 | 0 | 0 | 111.7 | R26 R28 E32 R33 I34 | R26-E30 VanDerWaalsContact O-CB 3.26Å; R26-E30 WeakPolarHBondContact O-CB 3.47Å; R26-E30 PolarHBondContact O-N 3.08Å; R28-E30 VanDerWaalsContact C-N 3.27Å; R28-E30 PolarHBondContact O-N 3.36Å; E30-E32 VanDerWaalsContact C-N 3.35Å; E30-R33 PolarHBondContact O-N 3.22Å; E30-R33 IonicContact OE2-CZ 2.81Å; E30-R33 VanDerWaalsContact OE2-CZ 3.27Å; E30-R33 IonicContact OE2-NE 3.04Å; E30-R33 IonicContact OE2-NH2 3.22Å; E30-R33 PolarHBondContact OE2-NH2 2.92Å; E30-I34 HydrophobicContact CG-CD1 4.04Å; E30-I34 VanDerWaalsContact O-CG1 3.26Å; E30-I34 WeakPolarHBondContact O-CG1 3.36Å; E30-I34 PolarHBondContact O-N 3.44Å |
| 31 | Y | 87 | Confident | 84 | Confident | 164 Ų | 164 | 109.1 Ų | 109.1 | 64% | 0.643 | 50% | 0.5 | S | S | * | . | H | α-helix | trans | -62.4 | -43.6 | 175.9 | -174.5 | -91.6 | 0 | 0 | 0 | 111.5 | L27 R28 I34 Q35 | L27-Y31 WeakPolarHBondContact O-CB 3.44Å; L27-Y31 PolarHBondContact O-N 3.39Å; R28-Y31 PolarHBondContact O-N 3.06Å; R28-Y31 VanDerWaalsContact O-N 3.15Å; Y31-I34 PolarHBondContact O-N 3.02Å; Y31-Q35 WeakPolarHBondContact O-CB 3.33Å; Y31-Q35 PolarHBondContact O-N 3.4Å |
| 32 | E | 86.3 | Confident | 84.3 | Confident | 111 Ų | 111 | 108 Ų | 108 | 52% | 0.519 | 49% | 0.494 | S | S | . | . | H | α-helix | trans | -62 | -46.8 | 176.4 | -171.4 | 167.5 | -150 | 0 | 0 | 111.5 | R28 E30 I34 Q35 E36 | R28-E32 PolarHBondContact O-N 3.04Å; E30-E32 VanDerWaalsContact C-N 3.35Å; E32-I34 PolarHBondContact O-N 2.93Å; E32-Q35 WeakPolarHBondContact O-CB 3.39Å; E32-Q35 PolarHBondContact O-N 3.46Å; E32-E36 WeakPolarHBondContact O-CG 3.46Å; E32-E36 PolarHBondContact O-N 2.97Å |
| 33 | R | 85.1 | Confident | 84.7 | Confident | 140 Ų | 140 | 113.5 Ų | 113.5 | 53% | 0.528 | 51% | 0.512 | S | S | . | . | H | α-helix | trans | -60.2 | -41.1 | 175.1 | -79.3 | -177.2 | -71.1 | 179.5 | 2.4 | 113.5 | D29 E30 Q35 F37 | D29-R33 WeakPolarHBondContact O-CB 3.34Å; D29-R33 WeakPolarHBondContact O-CG 3.36Å; D29-R33 PolarHBondContact O-N 2.9Å; D29-R33 VanDerWaalsContact O-N 3.15Å; D29-R33 PolarHBondContact O-NE 3.18Å; D29-R33 VanDerWaalsContact O-NE 3.15Å; E30-R33 PolarHBondContact O-N 3.22Å; E30-R33 IonicContact OE2-CZ 2.81Å; E30-R33 VanDerWaalsContact OE2-CZ 3.27Å; E30-R33 IonicContact OE2-NE 3.04Å; E30-R33 IonicContact OE2-NH2 3.22Å; E30-R33 PolarHBondContact OE2-NH2 2.92Å; R33-Q35 VanDerWaalsContact C-N 3.34Å; R33-F37 WeakPolarHBondContact O-CB 3.42Å; R33-F37 PolarHBondContact O-N 3.3Å |
| 34 | I | 79.2 | Confident | 85.4 | Confident | 100 Ų | 100 | 113.1 Ų | 113.1 | 51% | 0.513 | 51% | 0.512 | S | S | . | . | H | α-helix | trans | -68.1 | -38.6 | 177.7 | -68.9 | 167.7 | 0 | 0 | 0 | 110.5 | E30 Y31 E32 F37 N38 | E30-I34 HydrophobicContact CG-CD1 4.04Å; E30-I34 VanDerWaalsContact O-CG1 3.26Å; E30-I34 WeakPolarHBondContact O-CG1 3.36Å; E30-I34 PolarHBondContact O-N 3.44Å; Y31-I34 PolarHBondContact O-N 3.02Å; E32-I34 PolarHBondContact O-N 2.93Å; I34-F37 PolarHBondContact O-N 3.28Å; I34-N38 WeakPolarHBondContact O-CB 3.46Å; I34-N38 PolarHBondContact O-N 3.31Å |
| 35 | Q | 83.2 | Confident | 86.1 | Confident | 96 Ų | 96 | 117.1 Ų | 117.1 | 45% | 0.449 | 53% | 0.527 | S | S | . | . | H | α-helix | trans | -63.2 | -49 | 176.1 | -175.9 | 175.6 | -23.2 | 0 | 0 | 111.2 | Y31 E32 R33 F37 N38 D39 | Y31-Q35 WeakPolarHBondContact O-CB 3.33Å; Y31-Q35 PolarHBondContact O-N 3.4Å; E32-Q35 WeakPolarHBondContact O-CB 3.39Å; E32-Q35 PolarHBondContact O-N 3.46Å; R33-Q35 VanDerWaalsContact C-N 3.34Å; Q35-F37 VanDerWaalsContact C-N 3.31Å; Q35-F37 PolarHBondContact O-N 3.42Å; Q35-N38 WeakPolarHBondContact O-CB 3.33Å; Q35-N38 PolarHBondContact O-N 3.12Å; Q35-N38 VanDerWaalsContact O-N 3.1Å; Q35-D39 PolarHBondContact O-N 3.43Å |
| 36 | E | 83.8 | Confident | 86.5 | Confident | 119 Ų | 119 | 116.8 Ų | 116.8 | 56% | 0.556 | 53% | 0.527 | S | S | * | . | H | α-helix | trans | -58.9 | -40.6 | 176 | -72.3 | 178.6 | 177.4 | 0 | 0 | 112.6 | E32 N38 D39 R40 | E32-E36 WeakPolarHBondContact O-CG 3.46Å; E32-E36 PolarHBondContact O-N 2.97Å; E36-N38 VanDerWaalsContact C-N 3.32Å; E36-N38 PolarHBondContact O-N 3.31Å; E36-D39 PolarHBondContact O-N 3.43Å; E36-R40 WeakPolarHBondContact O-CB 3.46Å; E36-R40 PolarHBondContact O-N 3.39Å |
| 37 | F | 83.9 | Confident | 86.9 | Confident | 148 Ų | 148 | 116 Ų | 116 | 65% | 0.649 | 52% | 0.524 | S | S | * | . | H | α-helix | trans | -63.2 | -40 | 175.9 | -178.6 | -95 | 0 | 0 | 0 | 112 | R33 I34 Q35 T41 | R33-F37 WeakPolarHBondContact O-CB 3.42Å; R33-F37 PolarHBondContact O-N 3.3Å; I34-F37 PolarHBondContact O-N 3.28Å; Q35-F37 VanDerWaalsContact C-N 3.31Å; Q35-F37 PolarHBondContact O-N 3.42Å; F37-T41 WeakPolarHBondContact O-CB 3.28Å; F37-T41 PolarHBondContact O-N 3.46Å; F37-T41 PolarHBondContact O-OG1 2.91Å |
| 38 | N | 81.2 | Confident | 87.3 | Confident | 90 Ų | 90 | 116 Ų | 116 | 48% | 0.481 | 52% | 0.521 | S | S | . | . | H | α-helix | trans | -67.5 | -44.1 | 177.3 | -159.8 | 2 | 0 | 0 | 0 | 110.9 | I34 Q35 E36 R40 T41 I42 | I34-N38 WeakPolarHBondContact O-CB 3.46Å; I34-N38 PolarHBondContact O-N 3.31Å; Q35-N38 WeakPolarHBondContact O-CB 3.33Å; Q35-N38 PolarHBondContact O-N 3.12Å; Q35-N38 VanDerWaalsContact O-N 3.1Å; E36-N38 VanDerWaalsContact C-N 3.32Å; E36-N38 PolarHBondContact O-N 3.31Å; N38-R40 PolarHBondContact O-N 3.16Å; N38-T41 CarbonylContact O-C 3.59Å; N38-T41 WeakPolarHBondContact O-CA 3.17Å; N38-T41 WeakPolarHBondContact O-CB 3.4Å; N38-T41 PolarHBondContact O-N 2.97Å; N38-T41 VanDerWaalsContact O-N 3.08Å; N38-I42 VanDerWaalsContact O-CG1 3.27Å; N38-I42 WeakPolarHBondContact O-CG1 3.34Å; N38-I42 PolarHBondContact O-N 3.42Å |
| 39 | D | 84.2 | Confident | 87.8 | Confident | 86 Ų | 86 | 112.1 Ų | 112.1 | 46% | 0.46 | 52% | 0.516 | S | S | . | . | H | α-helix | trans | -62 | -43.3 | 177.5 | -73.1 | -18.3 | 0 | 0 | 0 | 111.8 | Q35 E36 T41 I42 E43 | Q35-D39 PolarHBondContact O-N 3.43Å; E36-D39 PolarHBondContact O-N 3.43Å; D39-T41 VanDerWaalsContact C-N 3.27Å; D39-T41 PolarHBondContact O-N 3.35Å; D39-I42 PolarHBondContact O-N 3.47Å; D39-E43 WeakPolarHBondContact O-CB 3.37Å; D39-E43 PolarHBondContact O-N 3.43Å |
| 40 | R | 89.5 | Confident | 88.1 | Confident | 184 Ų | 184 | 117.4 Ų | 117.4 | 69% | 0.694 | 53% | 0.532 | S | S | * | . | H | α-helix | trans | -61 | -36.9 | 173.5 | -169.1 | 177 | -174 | -175.7 | 2.5 | 112.4 | E36 N38 M44 | E36-R40 WeakPolarHBondContact O-CB 3.46Å; E36-R40 PolarHBondContact O-N 3.39Å; N38-R40 PolarHBondContact O-N 3.16Å; R40-M44 WeakPolarHBondContact O-CB 3.31Å; R40-M44 PolarHBondContact O-N 2.98Å |
| 41 | T | 88.6 | Confident | 88.6 | Confident | 47 Ų | 47 | 116.9 Ų | 116.9 | 29% | 0.288 | 53% | 0.531 | S | S | . | . | H | α-helix | trans | -70.7 | -41.8 | 177.3 | -60.3 | 0 | 0 | 0 | 0 | 111.5 | F37 N38 D39 M44 K45 | F37-T41 WeakPolarHBondContact O-CB 3.28Å; F37-T41 PolarHBondContact O-N 3.46Å; F37-T41 PolarHBondContact O-OG1 2.91Å; N38-T41 CarbonylContact O-C 3.59Å; N38-T41 WeakPolarHBondContact O-CA 3.17Å; N38-T41 WeakPolarHBondContact O-CB 3.4Å; N38-T41 PolarHBondContact O-N 2.97Å; N38-T41 VanDerWaalsContact O-N 3.08Å; D39-T41 VanDerWaalsContact C-N 3.27Å; D39-T41 PolarHBondContact O-N 3.35Å; T41-M44 PolarHBondContact O-N 3.42Å; T41-K45 WeakPolarHBondContact O-CG 3.48Å; T41-K45 PolarHBondContact O-N 3.33Å |
| 42 | I | 83.9 | Confident | 89.1 | Confident | 82 Ų | 82 | 117 Ų | 117 | 42% | 0.421 | 54% | 0.535 | S | S | . | . | H | α-helix | trans | -62.7 | -45.5 | 175.5 | -68.9 | 164.9 | 0 | 0 | 0 | 109.7 | N38 D39 M44 K45 M46 | N38-I42 VanDerWaalsContact O-CG1 3.27Å; N38-I42 WeakPolarHBondContact O-CG1 3.34Å; N38-I42 PolarHBondContact O-N 3.42Å; D39-I42 PolarHBondContact O-N 3.47Å; I42-M44 PolarHBondContact O-N 3.08Å; I42-K45 PolarHBondContact O-N 2.97Å; I42-M46 HydrophobicContact CG2-CG 4.36Å; I42-M46 WeakPolarHBondContact O-CB 3.45Å; I42-M46 WeakPolarHBondContact O-CG 3.44Å; I42-M46 PolarHBondContact O-N 2.94Å |
| 43 | E | 92.6 | Very high | 89.5 | Confident | 138 Ų | 138 | 120.9 Ų | 120.9 | 65% | 0.645 | 55% | 0.545 | S | S | * | . | H | α-helix | trans | -58.4 | -47.3 | 176.5 | -171.1 | -173.2 | 179.7 | 0 | 0 | 111.4 | D39 K45 M46 R47 | D39-E43 WeakPolarHBondContact O-CB 3.37Å; D39-E43 PolarHBondContact O-N 3.43Å; E43-K45 PolarHBondContact O-N 3.41Å; E43-M46 PolarHBondContact O-N 3.34Å; E43-R47 WeakPolarHBondContact O-CB 3.39Å; E43-R47 PolarHBondContact O-N 3.39Å |
| 44 | M | 93.4 | Very high | 90 | Very high | 97 Ų | 97 | 118.6 Ų | 118.6 | 48% | 0.478 | 54% | 0.543 | S | S | . | . | H | α-helix | trans | -59.6 | -44.8 | 177.1 | -170.7 | 66.7 | 72.1 | 0 | 0 | 111.8 | R40 T41 I42 R47 Q48 | R40-M44 WeakPolarHBondContact O-CB 3.31Å; R40-M44 PolarHBondContact O-N 2.98Å; T41-M44 PolarHBondContact O-N 3.42Å; I42-M44 PolarHBondContact O-N 3.08Å; M44-R47 WeakPolarHBondContact O-CB 3.47Å; M44-R47 PolarHBondContact O-N 3.19Å; M44-Q48 WeakPolarHBondContact O-CG 3.48Å; M44-Q48 PolarHBondContact O-N 3.08Å |
| 45 | K | 94.6 | Very high | 90.8 | Very high | 131 Ų | 131 | 120.1 Ų | 120.1 | 57% | 0.57 | 55% | 0.546 | S | S | * | . | H | α-helix | trans | -63.3 | -42.8 | 176.3 | -75.5 | 179.6 | 178.5 | 176.4 | 0 | 111.7 | T41 I42 E43 R47 Q48 V49 | T41-K45 WeakPolarHBondContact O-CG 3.48Å; T41-K45 PolarHBondContact O-N 3.33Å; I42-K45 PolarHBondContact O-N 2.97Å; E43-K45 PolarHBondContact O-N 3.41Å; K45-R47 VanDerWaalsContact C-N 3.34Å; K45-R47 PolarHBondContact O-N 3.46Å; K45-Q48 WeakPolarHBondContact O-CB 3.45Å; K45-Q48 PolarHBondContact O-N 3.28Å; K45-V49 WeakPolarHBondContact O-CG2 3.43Å; K45-V49 PolarHBondContact O-N 3.42Å |
| 46 | M | 91.4 | Very high | 91.4 | Very high | 97 Ų | 97 | 124.5 Ų | 124.5 | 48% | 0.478 | 56% | 0.558 | S | S | . | * | H | α-helix | trans | -64.9 | -38.6 | 177.1 | -73 | -59.5 | -76.9 | 0 | 0 | 111.9 | I42 E43 V49 R50 | I42-M46 HydrophobicContact CG2-CG 4.36Å; I42-M46 WeakPolarHBondContact O-CB 3.45Å; I42-M46 WeakPolarHBondContact O-CG 3.44Å; I42-M46 PolarHBondContact O-N 2.94Å; E43-M46 PolarHBondContact O-N 3.34Å; M46-V49 PolarHBondContact O-N 2.9Å; M46-R50 VanDerWaalsContact O-CG 3.3Å; M46-R50 WeakPolarHBondContact O-CG 3.43Å; M46-R50 PolarHBondContact O-N 2.84Å |
| 47 | R | 92.8 | Very high | 91.7 | Very high | 164 Ų | 164 | 124 Ų | 124 | 62% | 0.619 | 56% | 0.556 | S | S | * | * | H | α-helix | trans | -61.8 | -45.3 | 172.4 | -171.1 | 179.4 | -170.7 | -179 | 3.9 | 111.5 | E43 M44 K45 V49 R50 L51 | E43-R47 WeakPolarHBondContact O-CB 3.39Å; E43-R47 PolarHBondContact O-N 3.39Å; M44-R47 WeakPolarHBondContact O-CB 3.47Å; M44-R47 PolarHBondContact O-N 3.19Å; K45-R47 VanDerWaalsContact C-N 3.34Å; K45-R47 PolarHBondContact O-N 3.46Å; R47-V49 PolarHBondContact O-N 3.49Å; R47-R50 PolarHBondContact O-N 3.25Å; R47-L51 HydrophobicContact CG-CD1 4.25Å; R47-L51 WeakPolarHBondContact O-CB 3.25Å; R47-L51 WeakPolarHBondContact O-CG 3.14Å; R47-L51 PolarHBondContact O-N 3.49Å |
| 48 | Q | 94.3 | Very high | 92.1 | Very high | 119 Ų | 119 | 121.7 Ų | 121.7 | 56% | 0.556 | 55% | 0.549 | S | S | * | . | H | α-helix | trans | -60.8 | -43.1 | 175.4 | -73.4 | 177.5 | -3.2 | 0 | 0 | 112.1 | M44 K45 L51 K52 | M44-Q48 WeakPolarHBondContact O-CG 3.48Å; M44-Q48 PolarHBondContact O-N 3.08Å; K45-Q48 WeakPolarHBondContact O-CB 3.45Å; K45-Q48 PolarHBondContact O-N 3.28Å; Q48-L51 PolarHBondContact O-N 3.26Å; Q48-K52 WeakPolarHBondContact O-CB 3.32Å; Q48-K52 PolarHBondContact O-N 2.94Å |
| 49 | V | 96.4 | Very high | 92.6 | Very high | 92 Ų | 92 | 123.4 Ų | 123.4 | 56% | 0.558 | 56% | 0.555 | S | S | * | * | H | α-helix | trans | -61.7 | -45.2 | 176.1 | 170.4 | 0 | 0 | 0 | 0 | 111.2 | K45 M46 R47 K52 R53 | K45-V49 WeakPolarHBondContact O-CG2 3.43Å; K45-V49 PolarHBondContact O-N 3.42Å; M46-V49 PolarHBondContact O-N 2.9Å; R47-V49 PolarHBondContact O-N 3.49Å; V49-K52 PolarHBondContact O-N 2.96Å; V49-R53 PolarHBondContact O-N 3.35Å |
| 50 | R | 93.6 | Very high | 92.8 | Very high | 172 Ų | 172 | 123.6 Ų | 123.6 | 65% | 0.649 | 56% | 0.559 | S | S | * | * | H | α-helix | trans | -59.9 | -47.9 | 175.9 | -72.7 | 173.6 | -176.3 | 174.6 | 2.8 | 111.3 | M46 R47 R53 L54 | M46-R50 VanDerWaalsContact O-CG 3.3Å; M46-R50 WeakPolarHBondContact O-CG 3.43Å; M46-R50 PolarHBondContact O-N 2.84Å; R47-R50 PolarHBondContact O-N 3.25Å; R50-R53 PolarHBondContact O-N 2.95Å; R50-L54 WeakPolarHBondContact O-CG 3.48Å; R50-L54 PolarHBondContact O-N 3.31Å |
| 51 | L | 96.3 | Very high | 92.6 | Very high | 78 Ų | 78 | 120.1 Ų | 120.1 | 41% | 0.408 | 55% | 0.553 | S | S | . | * | H | α-helix | trans | -62.2 | -45.1 | 177.8 | -73.2 | 172.3 | 0 | 0 | 0 | 112 | R47 Q48 R53 L54 F55 | R47-L51 HydrophobicContact CG-CD1 4.25Å; R47-L51 WeakPolarHBondContact O-CB 3.25Å; R47-L51 WeakPolarHBondContact O-CG 3.14Å; R47-L51 PolarHBondContact O-N 3.49Å; Q48-L51 PolarHBondContact O-N 3.26Å; L51-R53 VanDerWaalsContact C-N 3.28Å; L51-R53 PolarHBondContact O-N 3.25Å; L51-L54 PolarHBondContact O-N 2.96Å; L51-L54 VanDerWaalsContact O-N 3.16Å; L51-F55 HydrophobicContact CB-CD2 4.47Å; L51-F55 HydrophobicContact CB-CE2 4.36Å; L51-F55 WeakPolarHBondContact O-CD2 3.36Å; L51-F55 PolarHBondContact O-N 3.49Å |
| 52 | K | 96.7 | Very high | 92.5 | Very high | 166 Ų | 166 | 125.8 Ų | 125.8 | 72% | 0.722 | 57% | 0.573 | S | S | * | * | H | α-helix | trans | -61.1 | -38 | 178.1 | -169.9 | 174.6 | -176.5 | 175.8 | 0 | 112 | Q48 V49 R56 | Q48-K52 WeakPolarHBondContact O-CB 3.32Å; Q48-K52 PolarHBondContact O-N 2.94Å; V49-K52 PolarHBondContact O-N 2.96Å; K52-R56 WeakPolarHBondContact O-CB 3.47Å; K52-R56 PolarHBondContact O-N 2.86Å; K52-R56 VanDerWaalsContact O-N 3.09Å |
| 53 | R | 95.5 | Very high | 92.2 | Very high | 192 Ų | 192 | 127.3 Ų | 127.3 | 73% | 0.725 | 59% | 0.586 | S | S | * | * | H | α-helix | trans | -64.7 | -45.7 | 173.9 | -174.7 | 177.2 | -179.1 | 166.2 | 0.9 | 111.6 | V49 R50 L51 R56 E57 | V49-R53 PolarHBondContact O-N 3.35Å; R50-R53 PolarHBondContact O-N 2.95Å; L51-R53 VanDerWaalsContact C-N 3.28Å; L51-R53 PolarHBondContact O-N 3.25Å; R53-R56 PolarHBondContact O-N 3.46Å; R53-E57 WeakPolarHBondContact O-CB 3.3Å; R53-E57 PolarHBondContact O-N 3.35Å |
| 54 | L | 95.9 | Very high | 91 | Very high | 93 Ų | 93 | 124 Ų | 124 | 49% | 0.487 | 58% | 0.583 | S | S | . | * | H | α-helix | trans | -61.5 | -45.4 | 176.9 | -72 | 171.6 | 0 | 0 | 0 | 111.9 | R50 L51 R56 E57 I58 | R50-L54 WeakPolarHBondContact O-CG 3.48Å; R50-L54 PolarHBondContact O-N 3.31Å; L51-L54 PolarHBondContact O-N 2.96Å; L51-L54 VanDerWaalsContact O-N 3.16Å; L54-R56 VanDerWaalsContact C-N 3.33Å; L54-R56 PolarHBondContact O-N 3.24Å; L54-E57 PolarHBondContact O-N 3.09Å; L54-I58 VanDerWaalsContact O-CG1 3.3Å; L54-I58 WeakPolarHBondContact O-CG1 3.47Å; L54-I58 PolarHBondContact O-N 2.89Å |
| 55 | F | 96.2 | Very high | 89.4 | Confident | 131 Ų | 131 | 122 Ų | 122 | 58% | 0.575 | 59% | 0.586 | S | S | * | * | H | α-helix | trans | -60.7 | -42.3 | 176.6 | -77.9 | -60.9 | 0 | 0 | 0 | 112.2 | L51 E57 I58 E59 | L51-F55 HydrophobicContact CB-CD2 4.47Å; L51-F55 HydrophobicContact CB-CE2 4.36Å; L51-F55 WeakPolarHBondContact O-CD2 3.36Å; L51-F55 PolarHBondContact O-N 3.49Å; F55-E57 VanDerWaalsContact C-N 3.34Å; F55-E57 PolarHBondContact O-N 3.06Å; F55-I58 PolarHBondContact O-N 3.06Å; F55-E59 WeakPolarHBondContact O-CG 3.49Å; F55-E59 PolarHBondContact O-N 3.34Å |
| 56 | R | 94.1 | Very high | 87.4 | Confident | 188 Ų | 188 | 119 Ų | 119 | 71% | 0.709 | 59% | 0.593 | S | S | * | * | H | α-helix | trans | -63.4 | -39.5 | 175.4 | -169.7 | 178.2 | -174.5 | -179.1 | 2.3 | 112.1 | K52 R53 L54 E59 V60 | K52-R56 WeakPolarHBondContact O-CB 3.47Å; K52-R56 PolarHBondContact O-N 2.86Å; K52-R56 VanDerWaalsContact O-N 3.09Å; R53-R56 PolarHBondContact O-N 3.46Å; L54-R56 VanDerWaalsContact C-N 3.33Å; L54-R56 PolarHBondContact O-N 3.24Å; R56-E59 PolarHBondContact O-N 3.36Å; R56-V60 VanDerWaalsContact O-CG2 3.28Å; R56-V60 WeakPolarHBondContact O-CG2 3.43Å; R56-V60 PolarHBondContact O-N 3.1Å |
| 57 | E | 91.3 | Very high | 85.5 | Confident | 108 Ų | 108 | 118.8 Ų | 118.8 | 51% | 0.505 | 61% | 0.606 | S | S | . | * | H | α-helix | trans | -65.5 | -42.7 | 176.8 | -172.6 | 170.4 | -177.8 | 0 | 0 | 111.6 | R53 L54 F55 E59 V60 I61 | R53-E57 WeakPolarHBondContact O-CB 3.3Å; R53-E57 PolarHBondContact O-N 3.35Å; L54-E57 PolarHBondContact O-N 3.09Å; F55-E57 VanDerWaalsContact C-N 3.34Å; F55-E57 PolarHBondContact O-N 3.06Å; E57-E59 PolarHBondContact O-N 3.43Å; E57-V60 PolarHBondContact O-N 3.42Å; E57-I61 HydrophobicContact CG-CD1 4.33Å; E57-I61 WeakPolarHBondContact O-CG1 3.39Å; E57-I61 PolarHBondContact O-N 3.42Å |
| 58 | I | 92.6 | Very high | 83.6 | Confident | 100 Ų | 100 | 115.2 Ų | 115.2 | 51% | 0.513 | 61% | 0.612 | S | S | . | * | H | α-helix | trans | -61.8 | -42.8 | 173.8 | -67.6 | 165.7 | 0 | 0 | 0 | 110.9 | L54 F55 I61 K62 | L54-I58 VanDerWaalsContact O-CG1 3.3Å; L54-I58 WeakPolarHBondContact O-CG1 3.47Å; L54-I58 PolarHBondContact O-N 2.89Å; F55-I58 PolarHBondContact O-N 3.06Å; I58-I61 PolarHBondContact O-N 3.26Å; I58-K62 WeakPolarHBondContact O-CB 3.4Å; I58-K62 PolarHBondContact O-N 2.92Å |
| 59 | E | 91.4 | Very high | 81.4 | Confident | 127 Ų | 127 | 113.1 Ų | 113.1 | 59% | 0.593 | 62% | 0.623 | S | S | * | * | H | α-helix | trans | -61.5 | -42.5 | 174.9 | -78.5 | 178.2 | 174.9 | 0 | 0 | 112.1 | F55 R56 E57 I61 K62 V63 | F55-E59 WeakPolarHBondContact O-CG 3.49Å; F55-E59 PolarHBondContact O-N 3.34Å; R56-E59 PolarHBondContact O-N 3.36Å; E57-E59 PolarHBondContact O-N 3.43Å; E59-I61 PolarHBondContact O-N 3.44Å; E59-K62 PolarHBondContact O-N 3.37Å; E59-V63 VanDerWaalsContact O-CG2 3.31Å; E59-V63 WeakPolarHBondContact O-CG2 3.33Å; E59-V63 PolarHBondContact O-N 2.85Å |
| 60 | V | 88.6 | Confident | 79.2 | Confident | 90 Ų | 90 | 112.8 Ų | 112.8 | 55% | 0.545 | 64% | 0.638 | S | S | . | * | H | α-helix | trans | -62.1 | -43.1 | 175.8 | 169.8 | 0 | 0 | 0 | 0 | 111 | R56 E57 V63 A64 | R56-V60 VanDerWaalsContact O-CG2 3.28Å; R56-V60 WeakPolarHBondContact O-CG2 3.43Å; R56-V60 PolarHBondContact O-N 3.1Å; E57-V60 PolarHBondContact O-N 3.42Å; V60-V63 PolarHBondContact O-N 3.16Å; V60-A64 WeakPolarHBondContact O-CB 3.42Å; V60-A64 PolarHBondContact O-N 3.29Å |
| 61 | I | 85.1 | Confident | 77.2 | Confident | 110 Ų | 110 | 108.9 Ų | 108.9 | 56% | 0.564 | 64% | 0.642 | S | S | * | * | H | α-helix | trans | -65.1 | -40.7 | 175.9 | -66.5 | 166.3 | 0 | 0 | 0 | 110.8 | E57 I58 E59 V63 A64 G65 | E57-I61 HydrophobicContact CG-CD1 4.33Å; E57-I61 WeakPolarHBondContact O-CG1 3.39Å; E57-I61 PolarHBondContact O-N 3.42Å; I58-I61 PolarHBondContact O-N 3.26Å; E59-I61 PolarHBondContact O-N 3.44Å; I61-V63 PolarHBondContact O-N 3.36Å; I61-A64 PolarHBondContact O-N 3.47Å; I61-G65 WeakPolarHBondContact O-CA 3.44Å; I61-G65 PolarHBondContact O-N 3.41Å |
| 62 | K | 85.8 | Confident | 74.8 | Confident | 166 Ų | 166 | 111 Ų | 111 | 72% | 0.722 | 66% | 0.664 | S | S | * | * | H | α-helix | trans | -63.3 | -41.3 | 177.7 | -174.3 | 179.4 | 177.8 | -177.3 | 0 | 111.9 | I58 E59 G66 | I58-K62 WeakPolarHBondContact O-CB 3.4Å; I58-K62 PolarHBondContact O-N 2.92Å; E59-K62 PolarHBondContact O-N 3.37Å; K62-G66 PolarHBondContact O-N 2.87Å |
| 63 | V | 77 | Confident | 72.2 | Confident | 115 Ų | 115 | 106.8 Ų | 106.8 | 70% | 0.697 | 67% | 0.667 | S | S | * | * | H | α-helix | trans | -73.4 | -40.1 | 177.4 | 175 | 0 | 0 | 0 | 0 | 111.3 | E59 V60 I61 | E59-V63 VanDerWaalsContact O-CG2 3.31Å; E59-V63 WeakPolarHBondContact O-CG2 3.33Å; E59-V63 PolarHBondContact O-N 2.85Å; V60-V63 PolarHBondContact O-N 3.16Å; I61-V63 PolarHBondContact O-N 3.36Å |
| 64 | A | 68.5 | Low | 69.9 | Low | 68 Ų | 68 | 102 Ų | 102 | 56% | 0.562 | 68% | 0.677 | S | S | * | * | H | α-helix | trans | -72.3 | -31.7 | 177.9 | 0 | 0 | 0 | 0 | 0 | 113.2 | V60 I61 | V60-A64 WeakPolarHBondContact O-CB 3.42Å; V60-A64 PolarHBondContact O-N 3.29Å; I61-A64 PolarHBondContact O-N 3.47Å |
| 65 | G | 58.6 | Low | 67.1 | Low | 54 Ų | 54 | 101.2 Ų | 101.2 | 56% | 0.557 | 69% | 0.692 | S | S | * | * | H | α-helix | trans | -79.7 | -18.2 | 177.3 | 0 | 0 | 0 | 0 | 0 | 114.3 | I61 | I61-G65 WeakPolarHBondContact O-CA 3.44Å; I61-G65 PolarHBondContact O-N 3.41Å |
| 66 | G | 53.9 | Low | 64.7 | Low | 68 Ų | 68 | 101.6 Ų | 101.6 | 70% | 0.701 | 71% | 0.705 | S | S | * | * | S | Bend | trans | -80.8 | -15.8 | 178.1 | 0 | 0 | 0 | 0 | 0 | 115.1 | K62 | K62-G66 PolarHBondContact O-N 2.87Š|
| 67 | A | 51.4 | Low | 62.1 | Low | 93 Ų | 93 | 97.8 Ų | 97.8 | 77% | 0.769 | 71% | 0.707 | S | S | * | * | S | Bend | trans | -101.5 | -4.5 | -175.8 | 0 | 0 | 0 | 0 | 0 | 114.4 | ||
| 68 | A | 52.4 | Low | 59.6 | Low | 90 Ų | 90 | 98.9 Ų | 98.9 | 74% | 0.744 | 72% | 0.721 | S | S | * | * | S | Bend | trans | -142.4 | 69.6 | -176.5 | 0 | 0 | 0 | 0 | 0 | 111.7 | ||
| 69 | G | 47.8 | Very low | 57.3 | Low | 75 Ų | 75 | 98.6 Ų | 98.6 | 77% | 0.773 | 73% | 0.734 | S | S | * | * | trans | 179.5 | 36.6 | 179.3 | 0 | 0 | 0 | 0 | 0 | 116.4 | ||||
| 70 | G | 51.4 | Low | 54.7 | Low | 85 Ų | 85 | 98.2 Ų | 98.2 | 88% | 0.876 | 75% | 0.745 | S | S | * | * | trans | -106.2 | 80.8 | 168.1 | 0 | 0 | 0 | 0 | 0 | 111.1 | ||||
| 71 | A | 50.8 | Low | 52.6 | Low | 90 Ų | 90 | 99.2 Ų | 99.2 | 74% | 0.744 | 76% | 0.756 | S | S | * | * | trans | -176 | 140.5 | 155.2 | 0 | 0 | 0 | 0 | 0 | 111.2 | ||||
| 72 | S | 45.8 | Very low | 51 | Low | 122 Ų | 122 | 100.1 Ų | 100.1 | 85% | 0.853 | 77% | 0.769 | S | S | * | * | trans | 81 | 102.3 | -176.7 | 74.6 | 0 | 0 | 0 | 0 | 114.2 | ||||
| 73 | G | 41.9 | Very low | 48.8 | Very low | 78 Ų | 78 | 97.5 Ų | 97.5 | 80% | 0.804 | 77% | 0.772 | S | S | * | * | cis | 70.6 | 95.6 | 37.3 | 0 | 0 | 0 | 0 | 0 | 107.6 | ||||
| 74 | G | 46.5 | Very low | 47.2 | Very low | 90 Ų | 90 | 99.4 Ų | 99.4 | 93% | 0.928 | 78% | 0.779 | S | S | * | * | 81.1 | 91.4 | 64.2 | 0 | 0 | 0 | 0 | 0 | 108.5 | |||||
| 75 | G | 38.7 | Very low | 46.1 | Very low | 77 Ų | 77 | 102.9 Ų | 102.9 | 79% | 0.794 | 79% | 0.793 | S | S | * | * | trans | -175.2 | 81.4 | -176.4 | 0 | 0 | 0 | 0 | 0 | 113.7 | ||||
| 76 | T | 44.9 | Very low | 45 | Very low | 139 Ų | 139 | 106.3 Ų | 106.3 | 85% | 0.853 | 80% | 0.798 | S | S | * | * | trans | -65.8 | 126.6 | 159.9 | 23.7 | 0 | 0 | 0 | 0 | 110.9 | ||||
| 77 | S | 40.6 | Very low | 44.5 | Very low | 108 Ų | 108 | 111.1 Ų | 111.1 | 76% | 0.755 | 80% | 0.802 | S | S | * | * | trans | -178.2 | 116.2 | 143.5 | 12.3 | 0 | 0 | 0 | 0 | 113.3 | ||||
| 78 | T | 38 | Very low | 44 | Very low | 131 Ų | 131 | 111.4 Ų | 111.4 | 80% | 0.804 | 80% | 0.799 | S | S | * | * | 40.6 | 118.9 | 126.1 | 56.3 | 0 | 0 | 0 | 0 | 121.4 | |||||
| 79 | A | 44.7 | Very low | 43.5 | Very low | 95 Ų | 95 | 116.9 Ų | 116.9 | 79% | 0.785 | 81% | 0.806 | S | S | * | * | trans | 4 | 131.7 | 138.6 | 0 | 0 | 0 | 0 | 0 | 119.5 | ||||
| 80 | S | 37.3 | Very low | 43.1 | Very low | 118 Ų | 118 | 117.1 Ų | 117.1 | 83% | 0.825 | 81% | 0.809 | S | S | * | * | 178 | 136 | 118.8 | 52.8 | 0 | 0 | 0 | 0 | 111.4 | |||||
| 81 | S | 44.2 | Very low | 42.9 | Very low | 111 Ų | 111 | 121.1 Ų | 121.1 | 78% | 0.776 | 81% | 0.809 | S | S | * | * | trans | -50.5 | 167.7 | 167.5 | -49.1 | 0 | 0 | 0 | 0 | 113.7 | ||||
| 82 | P | 51 | Low | 42.6 | Very low | 129 Ų | 129 | 121.7 Ų | 121.7 | 84% | 0.838 | 81% | 0.814 | S | S | * | * | -135.7 | 143.2 | 122.2 | 32.1 | -18.1 | 0 | 0 | 0 | 114.4 | |||||
| 83 | S | 39.6 | Very low | 42.4 | Very low | 112 Ų | 112 | 119.9 Ų | 119.9 | 78% | 0.783 | 81% | 0.814 | S | S | * | * | trans | -70.3 | 151.5 | 170.7 | 44.2 | 0 | 0 | 0 | 0 | 113 | ||||
| 84 | N | 42.8 | Very low | 42.3 | Very low | 155 Ų | 155 | 120.1 Ų | 120.1 | 83% | 0.829 | 82% | 0.817 | S | S | * | * | trans | -52.3 | 172.6 | 156.8 | -84.9 | -47.6 | 0 | 0 | 0 | 113.5 | ||||
| 85 | V | 44.8 | Very low | 42.1 | Very low | 141 Ų | 141 | 127.1 Ų | 127.1 | 86% | 0.855 | 82% | 0.815 | S | S | * | * | trans | 100 | 132 | 174.1 | -174.9 | 0 | 0 | 0 | 0 | 111.4 | ||||
| 86 | D | 36.8 | Very low | 42.2 | Very low | 126 Ų | 126 | 129 Ų | 129 | 67% | 0.674 | 81% | 0.811 | S | S | * | * | cis | 179.3 | 163.7 | -13.7 | -169.1 | 9.1 | 0 | 0 | 0 | 104.9 | ||||
| 87 | Q | 43.1 | Very low | 42.3 | Very low | 168 Ų | 168 | 128.3 Ų | 128.3 | 79% | 0.785 | 81% | 0.807 | S | S | * | * | trans | 73.8 | 138.6 | 164.2 | -51.8 | 176.3 | 23.8 | 0 | 0 | 117.1 | ||||
| 88 | S | 41.1 | Very low | 42.6 | Very low | 100 Ų | 100 | 135.1 Ų | 135.1 | 70% | 0.699 | 82% | 0.816 | S | S | * | * | cis | -164.2 | 146 | 25 | 51.8 | 0 | 0 | 0 | 0 | 112.5 | ||||
| 89 | F | 41.7 | Very low | 43 | Very low | 204 Ų | 204 | 140.2 Ų | 140.2 | 90% | 0.895 | 82% | 0.821 | S | S | * | * | trans | 30.2 | 130.2 | 138.5 | -73.2 | -92.1 | 0 | 0 | 0 | 122.3 | ||||
| 90 | G | 40.2 | Very low | 43.4 | Very low | 80 Ų | 80 | 146.8 Ų | 146.8 | 83% | 0.825 | 83% | 0.825 | S | S | * | * | trans | -180 | 89.3 | 158.3 | 0 | 0 | 0 | 0 | 0 | 113.7 | ||||
| 91 | L | 46.8 | Very low | 43.9 | Very low | 169 Ų | 169 | 152.5 Ų | 152.5 | 89% | 0.885 | 83% | 0.829 | S | S | * | * | trans | -68 | 140.9 | 173.4 | -83.4 | 135.2 | 0 | 0 | 0 | 113.2 | ||||
| 92 | A | 44.6 | Very low | 44.2 | Very low | 102 Ų | 102 | 156.1 Ų | 156.1 | 84% | 0.843 | 83% | 0.833 | S | S | * | * | trans | 147.6 | 110.4 | 145.5 | 0 | 0 | 0 | 0 | 0 | 108 | ||||
| 93 | G | 40.3 | Very low | 44.2 | Very low | 84 Ų | 84 | 159.6 Ų | 159.6 | 87% | 0.866 | 84% | 0.838 | S | S | * | * | 93.6 | 94.3 | 65.5 | 0 | 0 | 0 | 0 | 0 | 109 | |||||
| 94 | G | 39.8 | Very low | 44.7 | Very low | 84 Ų | 84 | 158 Ų | 158 | 87% | 0.866 | 83% | 0.832 | S | S | * | * | trans | -177.6 | 96.2 | -179.4 | 0 | 0 | 0 | 0 | 0 | 114.7 | ||||
| 95 | R | 42.9 | Very low | 44.9 | Very low | 236 Ų | 236 | 158.7 Ų | 158.7 | 89% | 0.891 | 83% | 0.83 | S | S | * | * | trans | -70.2 | 152.6 | -178.9 | -90.9 | -178.5 | -178.3 | -169.6 | 1.1 | 114 | ||||
| 96 | V | 41.8 | Very low | 45 | Very low | 117 Ų | 117 | 155.6 Ų | 155.6 | 71% | 0.709 | 83% | 0.827 | S | S | * | * | trans | 82.4 | 113.8 | 130.9 | 169.2 | 0 | 0 | 0 | 0 | 119.4 | ||||
| 97 | T | 47.3 | Very low | 45.6 | Very low | 124 Ų | 124 | 153.8 Ų | 153.8 | 76% | 0.761 | 83% | 0.829 | S | S | * | * | trans | 51.6 | 110.3 | 146.1 | 65.7 | 0 | 0 | 0 | 0 | 119.6 | ||||
| 98 | R | 44.9 | Very low | 46 | Very low | 252 Ų | 252 | 152.8 Ų | 152.8 | 95% | 0.951 | 83% | 0.828 | S | S | * | * | trans | -141.9 | 93.2 | 133.1 | -118.7 | 179 | -172.4 | -164.8 | 3 | 111.7 | ||||
| 99 | R | 48.3 | Very low | 46.4 | Very low | 237 Ų | 237 | 154.3 Ų | 154.3 | 89% | 0.894 | 83% | 0.833 | S | S | * | * | trans | -41.6 | 144.4 | 150.3 | -99.1 | 178.3 | 168.6 | -176.3 | -2.8 | 110.7 | ||||
| 100 | R | 51.3 | Low | 46.8 | Very low | 233 Ų | 233 | 151.4 Ų | 151.4 | 88% | 0.879 | 83% | 0.826 | S | S | * | * | trans | 75.1 | 92 | 139.1 | -161.9 | -175.8 | -156.9 | -170 | 5.2 | 116.7 | ||||
| 101 | R | 48.8 | Very low | 47.5 | Very low | 239 Ų | 239 | 151.9 Ų | 151.9 | 90% | 0.902 | 82% | 0.823 | S | S | * | * | trans | 166.1 | 72.2 | 132.5 | -100 | -174.4 | 162.2 | -163.2 | -1.8 | 111.3 | ||||
| 102 | Q | 50.7 | Low | 48.1 | Very low | 187 Ų | 187 | 148.8 Ų | 148.8 | 87% | 0.874 | 82% | 0.815 | S | S | * | * | S | Bend | trans | -147.1 | 18.2 | 159.1 | -69.4 | -161.2 | 3 | 0 | 0 | 114 | ||
| 103 | Q | 51.4 | Low | 49.3 | Very low | 201 Ų | 201 | 145.9 Ų | 145.9 | 94% | 0.939 | 79% | 0.789 | S | S | * | * | S | Bend | trans | -102.7 | 29.6 | 175.2 | -76.4 | -173.1 | -15.1 | 0 | 0 | 113.3 | ||
| 104 | A | 48.5 | Very low | 51.4 | Low | 80 Ų | 80 | 145.4 Ų | 145.4 | 66% | 0.661 | 77% | 0.769 | S | S | * | * | S | Bend | trans | -130.3 | 23.2 | -178.4 | 0 | 0 | 0 | 0 | 0 | 114.2 | ||
| 105 | H | 47.7 | Very low | 53.6 | Low | 168 Ų | 168 | 146.3 Ų | 146.3 | 78% | 0.778 | 76% | 0.759 | S | S | * | * | S | Bend | trans | -122.1 | 7.7 | 172.7 | -66.3 | -55.2 | 0 | 0 | 0 | 114.1 | ||
| 106 | G | 47.8 | Very low | 55.7 | Low | 77 Ų | 77 | 142.7 Ų | 142.7 | 79% | 0.794 | 75% | 0.753 | S | S | * | * | S | Bend | trans | -85.1 | -2.9 | 178.1 | 0 | 0 | 0 | 0 | 0 | 115.7 | ||
| 107 | A | 49.7 | Very low | 57.9 | Low | 87 Ų | 87 | 142.5 Ų | 142.5 | 72% | 0.719 | 74% | 0.744 | S | S | * | * | S | Bend | trans | -121.3 | 2 | -165.7 | 0 | 0 | 0 | 0 | 0 | 115.9 | ||
| 108 | I | 51.5 | Low | 59.9 | Low | 148 Ų | 148 | 143.9 Ų | 143.9 | 76% | 0.759 | 74% | 0.735 | S | S | * | * | S | Bend | trans | -119.4 | -0.8 | -174.3 | -54.9 | -179.1 | 0 | 0 | 0 | 113.3 | ||
| 109 | T | 49 | Very low | 62.1 | Low | 131 Ų | 131 | 136.6 Ų | 136.6 | 80% | 0.804 | 71% | 0.713 | S | S | * | * | S | Bend | trans | -113.1 | 37.3 | 179.4 | -26.3 | 0 | 0 | 0 | 0 | 113.2 | ||
| 110 | L | 50.6 | Low | 64.3 | Low | 143 Ų | 143 | 130.8 Ų | 130.8 | 75% | 0.749 | 70% | 0.696 | S | S | * | * | trans | -102.5 | 1.1 | 170.1 | -74.2 | 174.1 | 0 | 0 | 0 | 113.4 | S112 | L110-S112 PolarHBondContact O-N 3.37Š| ||
| 111 | A | 53.1 | Low | 66.3 | Low | 91 Ų | 91 | 125.6 Ų | 125.6 | 75% | 0.752 | 68% | 0.68 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -101.8 | 59.7 | -174.9 | 0 | 0 | 0 | 0 | 0 | 112.6 | ||
| 112 | S | 60.2 | Low | 68.5 | Low | 104 Ų | 104 | 119.7 Ų | 119.7 | 73% | 0.727 | 66% | 0.662 | S | S | * | * | T | Hydrogen-bonded Turn | trans | 173.3 | 40.5 | 154 | 46.8 | 0 | 0 | 0 | 0 | 112.9 | L110 T114 | L110-S112 PolarHBondContact O-N 3.37Å; S112-T114 PolarHBondContact O-N 2.9Å |
| 113 | S | 70.3 | Confident | 70.6 | Confident | 41 Ų | 41 | 118.7 Ų | 118.7 | 29% | 0.287 | 65% | 0.651 | S | S | . | * | trans | -63.3 | 117.3 | 161.7 | 53 | 0 | 0 | 0 | 0 | 107.9 | R118 | S113-R118 PolarHBondContact O-NE 3.49Å; S113-R118 WeakPolarHBondContact OG-CG 3.49Å; S113-R118 PolarHBondContact OG-NE 3.4Å | ||
| 114 | T | 83.3 | Confident | 72.8 | Confident | 73 Ų | 73 | 113.3 Ų | 113.3 | 45% | 0.448 | 63% | 0.628 | S | S | . | * | trans | -57.3 | 150.3 | 176.4 | 62.4 | 0 | 0 | 0 | 0 | 108.7 | S112 Q116 Q117 R118 | S112-T114 PolarHBondContact O-N 2.9Å; T114-Q116 PolarHBondContact O-N 2.9Å; T114-Q116 VanDerWaalsContact O-N 3.09Å; T114-Q117 WeakPolarHBondContact O-CA 3.44Å; T114-Q117 WeakPolarHBondContact O-CB 3.39Å; T114-Q117 PolarHBondContact O-N 2.84Å; T114-Q117 WeakPolarHBondContact OG1-CB 3.37Å; T114-Q117 PolarHBondContact OG1-N 3.34Å; T114-R118 PolarHBondContact O-N 3.31Å | ||
| 115 | P | 85.9 | Confident | 75.1 | Confident | 103 Ų | 103 | 113.5 Ų | 113.5 | 67% | 0.669 | 62% | 0.615 | S | S | * | * | H | α-helix | trans | -54.1 | -33.3 | 180 | 19.2 | -31.6 | 0 | 0 | 0 | 112.4 | R118 M119 | P115-R118 PolarHBondContact O-N 2.95Å; P115-M119 WeakPolarHBondContact O-CG 3.49Å; P115-M119 PolarHBondContact O-N 3.33Å; P115-M119 VanDerWaalsContact O-N 3.09Å |
| 116 | Q | 86.8 | Confident | 77.4 | Confident | 160 Ų | 160 | 109.5 Ų | 109.5 | 75% | 0.748 | 60% | 0.602 | S | S | * | * | H | α-helix | trans | -65.3 | -40.7 | 173.5 | -74.7 | 164.7 | -22.8 | 0 | 0 | 113 | T114 R118 M119 H120 | T114-Q116 PolarHBondContact O-N 2.9Å; T114-Q116 VanDerWaalsContact O-N 3.09Å; Q116-R118 VanDerWaalsContact C-N 3.34Å; Q116-R118 PolarHBondContact O-N 3.42Å; Q116-M119 PolarHBondContact O-N 3.09Å; Q116-H120 WeakPolarHBondContact O-CB 3.43Å; Q116-H120 PolarHBondContact O-N 3.01Å |
| 117 | Q | 89.1 | Confident | 79.7 | Confident | 114 Ų | 114 | 111.2 Ų | 111.2 | 53% | 0.533 | 59% | 0.592 | S | S | . | * | H | α-helix | trans | -67.4 | -34.9 | 176.9 | -165.9 | 179.7 | 15.3 | 0 | 0 | 111.9 | T114 H120 K121 | T114-Q117 WeakPolarHBondContact O-CA 3.44Å; T114-Q117 WeakPolarHBondContact O-CB 3.39Å; T114-Q117 PolarHBondContact O-N 2.84Å; T114-Q117 WeakPolarHBondContact OG1-CB 3.37Å; T114-Q117 PolarHBondContact OG1-N 3.34Å; Q117-H120 PolarHBondContact O-N 3.47Å; Q117-K121 WeakPolarHBondContact O-CB 3.49Å; Q117-K121 PolarHBondContact O-N 3.19Å |
| 118 | R | 89.1 | Confident | 81.9 | Confident | 153 Ų | 153 | 109.4 Ų | 109.4 | 58% | 0.577 | 58% | 0.577 | S | S | * | * | H | α-helix | trans | -64.2 | -46.1 | 173.2 | -64.2 | -176.2 | -167.8 | 172.7 | 4.1 | 111.6 | S113 T114 P115 Q116 H120 K121 Q122 | S113-R118 PolarHBondContact O-NE 3.49Å; S113-R118 WeakPolarHBondContact OG-CG 3.49Å; S113-R118 PolarHBondContact OG-NE 3.4Å; T114-R118 PolarHBondContact O-N 3.31Å; P115-R118 PolarHBondContact O-N 2.95Å; Q116-R118 VanDerWaalsContact C-N 3.34Å; Q116-R118 PolarHBondContact O-N 3.42Å; R118-H120 VanDerWaalsContact C-N 3.33Å; R118-H120 PolarHBondContact O-N 3.42Å; R118-K121 PolarHBondContact O-N 2.95Å; R118-Q122 WeakPolarHBondContact O-CB 3.3Å; R118-Q122 PolarHBondContact O-N 3.04Å |
| 119 | M | 91 | Very high | 84.1 | Confident | 99 Ų | 99 | 110.5 Ų | 110.5 | 49% | 0.488 | 57% | 0.572 | S | S | . | * | H | α-helix | trans | -61.1 | -41.7 | 175.3 | -71.4 | -64.6 | -66.2 | 0 | 0 | 111.9 | P115 Q116 Q122 R123 | P115-M119 WeakPolarHBondContact O-CG 3.49Å; P115-M119 PolarHBondContact O-N 3.33Å; P115-M119 VanDerWaalsContact O-N 3.09Å; Q116-M119 PolarHBondContact O-N 3.09Å; M119-Q122 PolarHBondContact O-N 3.31Å; M119-R123 WeakPolarHBondContact O-CG 3.41Å; M119-R123 PolarHBondContact O-N 3.47Å |
| 120 | H | 93.7 | Very high | 86.2 | Confident | 114 Ų | 114 | 107 Ų | 107 | 53% | 0.528 | 56% | 0.556 | S | S | . | * | H | α-helix | trans | -63.9 | -45.1 | 176.7 | -178.2 | 66.5 | 0 | 0 | 0 | 112 | Q116 Q117 R118 Q122 R123 I124 | Q116-H120 WeakPolarHBondContact O-CB 3.43Å; Q116-H120 PolarHBondContact O-N 3.01Å; Q117-H120 PolarHBondContact O-N 3.47Å; R118-H120 VanDerWaalsContact C-N 3.33Å; R118-H120 PolarHBondContact O-N 3.42Å; H120-Q122 VanDerWaalsContact C-N 3.34Å; H120-Q122 PolarHBondContact O-N 2.76Å; H120-R123 WeakPolarHBondContact O-CB 3.34Å; H120-R123 PolarHBondContact O-N 3.24Å; H120-I124 VanDerWaalsContact NE2-CD1 3.28Å; H120-I124 WeakPolarHBondContact NE2-CD1 3.42Å; H120-I124 WeakPolarHBondContact O-CG1 3.33Å; H120-I124 PolarHBondContact O-N 2.94Å |
| 121 | K | 94.2 | Very high | 88.4 | Confident | 125 Ų | 125 | 109.3 Ų | 109.3 | 54% | 0.543 | 56% | 0.555 | S | S | . | * | H | α-helix | trans | -60.7 | -43.1 | 175.4 | -172.9 | 177.5 | 176.1 | -176.5 | 0 | 111.6 | Q117 R118 R123 I124 E125 | Q117-K121 WeakPolarHBondContact O-CB 3.49Å; Q117-K121 PolarHBondContact O-N 3.19Å; R118-K121 PolarHBondContact O-N 2.95Å; K121-R123 PolarHBondContact O-N 3.45Å; K121-I124 PolarHBondContact O-N 3.49Å; K121-E125 WeakPolarHBondContact CE-OE1 3.49Å; K121-E125 WeakPolarHBondContact O-CG 3.36Å; K121-E125 PolarHBondContact O-N 3.26Å |
| 122 | Q | 94.6 | Very high | 90.4 | Very high | 114 Ų | 114 | 111.2 Ų | 111.2 | 53% | 0.533 | 55% | 0.548 | S | S | . | . | H | α-helix | trans | -60.7 | -44.2 | 175.2 | -171 | 179.7 | 7.1 | 0 | 0 | 111.6 | R118 M119 H120 I124 E125 T126 | R118-Q122 WeakPolarHBondContact O-CB 3.3Å; R118-Q122 PolarHBondContact O-N 3.04Å; M119-Q122 PolarHBondContact O-N 3.31Å; H120-Q122 VanDerWaalsContact C-N 3.34Å; H120-Q122 PolarHBondContact O-N 2.76Å; Q122-I124 VanDerWaalsContact C-N 3.35Å; Q122-I124 PolarHBondContact O-N 2.93Å; Q122-E125 PolarHBondContact O-N 2.89Å; Q122-T126 PolarHBondContact O-N 3.38Å; Q122-T126 PolarHBondContact O-OG1 3.11Å |
| 123 | R | 95.2 | Very high | 92.1 | Very high | 166 Ų | 166 | 111.6 Ų | 111.6 | 63% | 0.626 | 54% | 0.542 | S | S | * | . | H | α-helix | trans | -59.8 | -43.5 | 175.4 | -73.4 | 173.9 | -178.7 | -179 | 0.9 | 112.1 | M119 H120 K121 T126 L127 | M119-R123 WeakPolarHBondContact O-CG 3.41Å; M119-R123 PolarHBondContact O-N 3.47Å; H120-R123 WeakPolarHBondContact O-CB 3.34Å; H120-R123 PolarHBondContact O-N 3.24Å; K121-R123 PolarHBondContact O-N 3.45Å; R123-T126 PolarHBondContact O-N 2.89Å; R123-L127 WeakPolarHBondContact O-CB 3.45Å; R123-L127 WeakPolarHBondContact O-CG 3.48Å; R123-L127 PolarHBondContact O-N 2.91Å |
| 124 | I | 97 | Very high | 93.3 | Very high | 89 Ų | 89 | 111.4 Ų | 111.4 | 46% | 0.456 | 55% | 0.547 | S | S | . | . | H | α-helix | trans | -62.5 | -45.6 | 176.7 | -69.9 | 171.4 | 0 | 0 | 0 | 110.7 | H120 K121 Q122 T126 L127 A128 | H120-I124 VanDerWaalsContact NE2-CD1 3.28Å; H120-I124 WeakPolarHBondContact NE2-CD1 3.42Å; H120-I124 WeakPolarHBondContact O-CG1 3.33Å; H120-I124 PolarHBondContact O-N 2.94Å; K121-I124 PolarHBondContact O-N 3.49Å; Q122-I124 VanDerWaalsContact C-N 3.35Å; Q122-I124 PolarHBondContact O-N 2.93Å; I124-T126 VanDerWaalsContact C-N 3.35Å; I124-T126 PolarHBondContact O-N 2.85Å; I124-L127 PolarHBondContact O-N 3.42Å; I124-A128 WeakPolarHBondContact O-CB 3.47Å; I124-A128 PolarHBondContact O-N 3.39Å |
| 125 | E | 96.7 | Very high | 93.9 | Very high | 83 Ų | 83 | 114.5 Ų | 114.5 | 39% | 0.388 | 56% | 0.556 | S | S | . | * | H | α-helix | trans | -62.7 | -41.6 | 177.8 | -73.2 | 176.4 | -165.4 | 0 | 0 | 111.7 | K121 Q122 A128 R129 | K121-E125 WeakPolarHBondContact CE-OE1 3.49Å; K121-E125 WeakPolarHBondContact O-CG 3.36Å; K121-E125 PolarHBondContact O-N 3.26Å; Q122-E125 PolarHBondContact O-N 2.89Å; E125-A128 PolarHBondContact O-N 2.92Å; E125-R129 WeakPolarHBondContact O-CG 3.3Å; E125-R129 PolarHBondContact O-N 3.37Å |
| 126 | T | 96.1 | Very high | 94.3 | Very high | 85 Ų | 85 | 112.2 Ų | 112.2 | 52% | 0.521 | 54% | 0.536 | S | S | . | . | H | α-helix | trans | -62 | -43.5 | 174.3 | -55.9 | 0 | 0 | 0 | 0 | 111.4 | Q122 R123 I124 R129 A130 | Q122-T126 PolarHBondContact O-N 3.38Å; Q122-T126 PolarHBondContact O-OG1 3.11Å; R123-T126 PolarHBondContact O-N 2.89Å; I124-T126 VanDerWaalsContact C-N 3.35Å; I124-T126 PolarHBondContact O-N 2.85Å; T126-R129 PolarHBondContact O-N 3.09Å; T126-A130 WeakPolarHBondContact O-CB 3.45Å; T126-A130 PolarHBondContact O-N 3.49Å |
| 127 | L | 97.1 | Very high | 94.4 | Very high | 112 Ų | 112 | 108.5 Ų | 108.5 | 59% | 0.586 | 52% | 0.521 | S | S | * | . | H | α-helix | trans | -64.4 | -39.5 | 176.3 | -75.1 | 170.2 | 0 | 0 | 0 | 112.1 | R123 I124 A130 R131 | R123-L127 WeakPolarHBondContact O-CB 3.45Å; R123-L127 WeakPolarHBondContact O-CG 3.48Å; R123-L127 PolarHBondContact O-N 2.91Å; I124-L127 PolarHBondContact O-N 3.42Å; L127-A130 PolarHBondContact O-N 3.4Å; L127-R131 WeakPolarHBondContact O-CG 3.49Å; L127-R131 PolarHBondContact O-N 3.06Å |
| 128 | A | 96.4 | Very high | 94.4 | Very high | 49 Ų | 49 | 107 Ų | 107 | 41% | 0.405 | 52% | 0.523 | S | S | . | . | H | α-helix | trans | -63.5 | -45.3 | 176.1 | 0 | 0 | 0 | 0 | 0 | 111.4 | I124 E125 R131 Q132 | I124-A128 WeakPolarHBondContact O-CB 3.47Å; I124-A128 PolarHBondContact O-N 3.39Å; E125-A128 PolarHBondContact O-N 2.92Å; A128-R131 PolarHBondContact O-N 3.25Å; A128-Q132 PolarHBondContact O-N 3.46Å |
| 129 | R | 96.3 | Very high | 94.6 | Very high | 172 Ų | 172 | 106.6 Ų | 106.6 | 65% | 0.649 | 52% | 0.521 | S | S | * | . | H | α-helix | trans | -62.8 | -42.2 | 174.6 | -69.6 | -177.6 | -160.7 | -166.4 | 6.1 | 111.9 | E125 T126 R131 Q132 L133 | E125-R129 WeakPolarHBondContact O-CG 3.3Å; E125-R129 PolarHBondContact O-N 3.37Å; T126-R129 PolarHBondContact O-N 3.09Å; R129-R131 VanDerWaalsContact C-N 3.33Å; R129-R131 PolarHBondContact O-N 2.94Å; R129-Q132 PolarHBondContact O-N 3.02Å; R129-L133 WeakPolarHBondContact O-CB 3.28Å; R129-L133 PolarHBondContact O-N 3.5Å |
| 130 | A | 94.6 | Very high | 94.4 | Very high | 57 Ų | 57 | 108.7 Ų | 108.7 | 47% | 0.471 | 52% | 0.524 | S | S | . | . | H | α-helix | trans | -62.2 | -40.7 | 177.3 | 0 | 0 | 0 | 0 | 0 | 111.8 | T126 L127 L133 G134 | T126-A130 WeakPolarHBondContact O-CB 3.45Å; T126-A130 PolarHBondContact O-N 3.49Å; L127-A130 PolarHBondContact O-N 3.4Å; A130-L133 PolarHBondContact O-N 3.07Å; A130-G134 PolarHBondContact O-N 2.82Å |
| 131 | R | 95.8 | Very high | 93.9 | Very high | 191 Ų | 191 | 107.5 Ų | 107.5 | 72% | 0.721 | 52% | 0.521 | S | S | * | . | H | α-helix | trans | -62.8 | -46.3 | 173.9 | -77.2 | -179.4 | 178.2 | 176.5 | -0.2 | 112.2 | L127 A128 R129 L133 G134 Q135 | L127-R131 WeakPolarHBondContact O-CG 3.49Å; L127-R131 PolarHBondContact O-N 3.06Å; A128-R131 PolarHBondContact O-N 3.25Å; R129-R131 VanDerWaalsContact C-N 3.33Å; R129-R131 PolarHBondContact O-N 2.94Å; R131-L133 VanDerWaalsContact C-N 3.32Å; R131-L133 PolarHBondContact O-N 3.31Å; R131-G134 PolarHBondContact O-N 2.94Å; R131-Q135 WeakPolarHBondContact O-CG 3.33Å; R131-Q135 PolarHBondContact O-N 3.37Å |
| 132 | Q | 95.4 | Very high | 93.5 | Very high | 131 Ų | 131 | 102.9 Ų | 102.9 | 61% | 0.612 | 51% | 0.509 | S | S | * | . | H | α-helix | trans | -60.6 | -42.5 | 176.3 | -75.5 | -179.9 | -22.1 | 0 | 0 | 111.8 | A128 R129 Q135 E136 | A128-Q132 PolarHBondContact O-N 3.46Å; R129-Q132 PolarHBondContact O-N 3.02Å; Q132-Q135 PolarHBondContact O-N 3.33Å; Q132-E136 PolarHBondContact O-N 3.43Å |
| 133 | L | 96.4 | Very high | 93 | Very high | 112 Ų | 112 | 101.8 Ų | 101.8 | 59% | 0.586 | 51% | 0.507 | S | S | * | . | H | α-helix | trans | -64.9 | -42.3 | 177.2 | -172.8 | 130.8 | 0 | 0 | 0 | 111.7 | R129 A130 R131 Q135 E136 I137 | R129-L133 WeakPolarHBondContact O-CB 3.28Å; R129-L133 PolarHBondContact O-N 3.5Å; A130-L133 PolarHBondContact O-N 3.07Å; R131-L133 VanDerWaalsContact C-N 3.32Å; R131-L133 PolarHBondContact O-N 3.31Å; L133-Q135 PolarHBondContact O-N 2.99Å; L133-E136 PolarHBondContact O-N 3.4Å; L133-I137 HydrophobicContact CD2-CD1 3.57Å; L133-I137 HydrophobicContact CG-CD1 4.2Å; L133-I137 VanDerWaalsContact O-CG1 3.3Å; L133-I137 WeakPolarHBondContact O-CG1 3.41Å; L133-I137 PolarHBondContact O-N 2.9Å |
| 134 | G | 95.4 | Very high | 92.1 | Very high | 38 Ų | 38 | 98 Ų | 98 | 39% | 0.392 | 50% | 0.497 | S | S | . | . | H | α-helix | trans | -61.4 | -41.7 | 173.9 | 0 | 0 | 0 | 0 | 0 | 112.9 | A130 R131 I137 S138 | A130-G134 PolarHBondContact O-N 2.82Å; R131-G134 PolarHBondContact O-N 2.94Å; G134-I137 PolarHBondContact O-N 3.26Å; G134-S138 WeakPolarHBondContact O-CB 3.19Å; G134-S138 PolarHBondContact O-N 3.31Å |
| 135 | Q | 94.9 | Very high | 91.3 | Very high | 138 Ų | 138 | 97 Ų | 97 | 65% | 0.645 | 50% | 0.501 | S | S | * | . | H | α-helix | trans | -63.7 | -43.9 | 174.8 | -74.2 | 175.9 | -9.9 | 0 | 0 | 111.9 | R131 Q132 L133 S138 R139 | R131-Q135 WeakPolarHBondContact O-CG 3.33Å; R131-Q135 PolarHBondContact O-N 3.37Å; Q132-Q135 PolarHBondContact O-N 3.33Å; L133-Q135 PolarHBondContact O-N 2.99Å; Q135-S138 PolarHBondContact O-N 2.94Å; Q135-R139 WeakPolarHBondContact O-CB 3.46Å; Q135-R139 PolarHBondContact O-N 3.24Å |
| 136 | E | 94 | Very high | 90.6 | Very high | 54 Ų | 54 | 100.6 Ų | 100.6 | 25% | 0.252 | 52% | 0.518 | S | S | . | . | H | α-helix | trans | -65.4 | -39.9 | 178.2 | -179.8 | 60.4 | -169.3 | 0 | 0 | 112.1 | Q132 L133 R139 R140 | Q132-E136 PolarHBondContact O-N 3.43Å; L133-E136 PolarHBondContact O-N 3.4Å; E136-R139 VanDerWaalsContact CD-NH2 3.32Å; E136-R139 PolarHBondContact O-N 3.36Å; E136-R139 IonicContact OE1-CZ 3.27Å; E136-R139 IonicContact OE1-NE 3.07Å; E136-R139 IonicContact OE1-NH2 3.32Å; E136-R139 PolarHBondContact OE1-NH2 3.01Å; E136-R139 IonicContact OE2-CZ 2.64Å; E136-R139 VanDerWaalsContact OE2-CZ 3.32Å; E136-R139 IonicContact OE2-NE 3.68Å; E136-R139 PolarHBondContact OE2-NE 3.21Å; E136-R139 IonicContact OE2-NH2 3.72Å; E136-R139 PolarHBondContact OE2-NH2 2.84Å; E136-R140 WeakPolarHBondContact O-CG 3.26Å; E136-R140 PolarHBondContact O-N 3.37Å; E136-R140 IonicContact OE1-CZ 2.77Å; E136-R140 VanDerWaalsContact OE1-CZ 3.22Å; E136-R140 IonicContact OE1-NE 3.74Å; E136-R140 PolarHBondContact OE1-NE 3.48Å; E136-R140 IonicContact OE1-NH2 2.82Å; E136-R140 PolarHBondContact OE1-NH2 3.24Å |
| 137 | I | 89.5 | Confident | 89.9 | Confident | 82 Ų | 82 | 99.9 Ų | 99.9 | 42% | 0.421 | 52% | 0.521 | S | S | . | . | H | α-helix | trans | -63.6 | -45.2 | 173.5 | -69 | 169.7 | 0 | 0 | 0 | 110.3 | L133 G134 R139 R140 N141 | L133-I137 HydrophobicContact CD2-CD1 3.57Å; L133-I137 HydrophobicContact CG-CD1 4.2Å; L133-I137 VanDerWaalsContact O-CG1 3.3Å; L133-I137 WeakPolarHBondContact O-CG1 3.41Å; L133-I137 PolarHBondContact O-N 2.9Å; G134-I137 PolarHBondContact O-N 3.26Å; I137-R139 VanDerWaalsContact C-N 3.3Å; I137-R139 PolarHBondContact O-N 2.91Å; I137-R140 PolarHBondContact O-N 3.21Å; I137-N141 WeakPolarHBondContact O-CB 3.45Å; I137-N141 VanDerWaalsContact O-CG 3.27Å; I137-N141 PolarHBondContact O-N 2.98Å |
| 138 | S | 89.8 | Confident | 88.8 | Confident | 82 Ų | 82 | 97.7 Ų | 97.7 | 57% | 0.573 | 53% | 0.526 | S | S | * | . | H | α-helix | trans | -60.7 | -40.4 | 177 | -165.8 | 0 | 0 | 0 | 0 | 111.7 | G134 Q135 N141 G142 | G134-S138 WeakPolarHBondContact O-CB 3.19Å; G134-S138 PolarHBondContact O-N 3.31Å; Q135-S138 PolarHBondContact O-N 2.94Å; S138-N141 PolarHBondContact O-N 3.48Å; S138-G142 PolarHBondContact O-N 3.01Å |
| 139 | R | 93.6 | Very high | 87.3 | Confident | 145 Ų | 145 | 97.9 Ų | 97.9 | 55% | 0.547 | 52% | 0.522 | S | S | . | . | H | α-helix | trans | -61.7 | -48 | 175.5 | -172.1 | -179.3 | 74.7 | 114.3 | 2.4 | 111.4 | Q135 E136 I137 G142 L143 | Q135-R139 WeakPolarHBondContact O-CB 3.46Å; Q135-R139 PolarHBondContact O-N 3.24Å; E136-R139 VanDerWaalsContact CD-NH2 3.32Å; E136-R139 PolarHBondContact O-N 3.36Å; E136-R139 IonicContact OE1-CZ 3.27Å; E136-R139 IonicContact OE1-NE 3.07Å; E136-R139 IonicContact OE1-NH2 3.32Å; E136-R139 PolarHBondContact OE1-NH2 3.01Å; E136-R139 IonicContact OE2-CZ 2.64Å; E136-R139 VanDerWaalsContact OE2-CZ 3.32Å; E136-R139 IonicContact OE2-NE 3.68Å; E136-R139 PolarHBondContact OE2-NE 3.21Å; E136-R139 IonicContact OE2-NH2 3.72Å; E136-R139 PolarHBondContact OE2-NH2 2.84Å; I137-R139 VanDerWaalsContact C-N 3.3Å; I137-R139 PolarHBondContact O-N 2.91Å; R139-G142 PolarHBondContact O-N 3.47Å; R139-L143 WeakPolarHBondContact O-CG 3.43Å; R139-L143 PolarHBondContact O-N 3.48Å |
| 140 | R | 86.7 | Confident | 85.6 | Confident | 144 Ų | 144 | 91 Ų | 91 | 54% | 0.543 | 50% | 0.504 | S | S | . | . | H | α-helix | trans | -64.3 | -40.1 | 177.1 | -72.9 | -177.3 | -170.6 | 152.9 | 7.7 | 112.7 | E136 I137 G142 L143 M144 | E136-R140 WeakPolarHBondContact O-CG 3.26Å; E136-R140 PolarHBondContact O-N 3.37Å; E136-R140 IonicContact OE1-CZ 2.77Å; E136-R140 VanDerWaalsContact OE1-CZ 3.22Å; E136-R140 IonicContact OE1-NE 3.74Å; E136-R140 PolarHBondContact OE1-NE 3.48Å; E136-R140 IonicContact OE1-NH2 2.82Å; E136-R140 PolarHBondContact OE1-NH2 3.24Å; I137-R140 PolarHBondContact O-N 3.21Å; R140-G142 VanDerWaalsContact C-N 3.3Å; R140-G142 PolarHBondContact O-N 3.44Å; R140-L143 PolarHBondContact O-N 3.47Å; R140-M144 WeakPolarHBondContact O-CG 3.47Å; R140-M144 PolarHBondContact O-N 2.97Å |
| 141 | N | 83.2 | Confident | 84.1 | Confident | 88 Ų | 88 | 91 Ų | 91 | 47% | 0.471 | 51% | 0.509 | S | S | . | . | H | α-helix | trans | -63.6 | -38.4 | 175.3 | -73.4 | -11.7 | 0 | 0 | 0 | 111.6 | I137 S138 M144 A145 | I137-N141 WeakPolarHBondContact O-CB 3.45Å; I137-N141 VanDerWaalsContact O-CG 3.27Å; I137-N141 PolarHBondContact O-N 2.98Å; S138-N141 PolarHBondContact O-N 3.48Å; N141-M144 PolarHBondContact O-N 3.45Å; N141-A145 WeakPolarHBondContact O-CB 3.41Å; N141-A145 PolarHBondContact O-N 3.4Å |
| 142 | G | 85.7 | Confident | 82.5 | Confident | 28 Ų | 28 | 88.2 Ų | 88.2 | 29% | 0.289 | 50% | 0.503 | S | S | . | . | H | α-helix | trans | -59.5 | -50.6 | 171.1 | 0 | 0 | 0 | 0 | 0 | 111.9 | S138 R139 R140 M144 A145 E146 | S138-G142 PolarHBondContact O-N 3.01Å; R139-G142 PolarHBondContact O-N 3.47Å; R140-G142 VanDerWaalsContact C-N 3.3Å; R140-G142 PolarHBondContact O-N 3.44Å; G142-M144 VanDerWaalsContact C-N 3.34Å; G142-M144 PolarHBondContact O-N 2.89Å; G142-A145 WeakPolarHBondContact O-CB 3.39Å; G142-A145 PolarHBondContact O-N 3.21Å; G142-A145 VanDerWaalsContact O-N 3.07Å; G142-E146 WeakPolarHBondContact O-CG 3.45Å; G142-E146 PolarHBondContact O-N 2.94Å |
| 143 | L | 83.9 | Confident | 81.1 | Confident | 92 Ų | 92 | 84.7 Ų | 84.7 | 48% | 0.482 | 49% | 0.488 | S | S | . | . | H | α-helix | trans | -60.2 | -39.9 | 177.5 | -68.4 | 172.4 | 0 | 0 | 0 | 112.9 | R139 R140 A145 E146 A147 | R139-L143 WeakPolarHBondContact O-CG 3.43Å; R139-L143 PolarHBondContact O-N 3.48Å; R140-L143 PolarHBondContact O-N 3.47Å; L143-A145 VanDerWaalsContact C-N 3.33Å; L143-E146 PolarHBondContact O-N 2.9Å; L143-A147 VanDerWaalsContact O-CB 3.29Å; L143-A147 WeakPolarHBondContact O-CB 3.42Å; L143-A147 PolarHBondContact O-N 2.92Å |
| 144 | M | 76.4 | Confident | 79.5 | Confident | 87 Ų | 87 | 88.6 Ų | 88.6 | 43% | 0.429 | 50% | 0.495 | S | S | . | . | H | α-helix | trans | -69.1 | -30.2 | 175.6 | -71 | -157.9 | -59.6 | 0 | 0 | 113 | R140 N141 G142 | R140-M144 WeakPolarHBondContact O-CG 3.47Å; R140-M144 PolarHBondContact O-N 2.97Å; N141-M144 PolarHBondContact O-N 3.45Å; G142-M144 VanDerWaalsContact C-N 3.34Å; G142-M144 PolarHBondContact O-N 2.89Å |
| 145 | A | 79.3 | Confident | 78.3 | Confident | 66 Ų | 66 | 89.8 Ų | 89.8 | 55% | 0.545 | 50% | 0.498 | S | S | . | . | H | α-helix | trans | -73 | -43.7 | 173.8 | 0 | 0 | 0 | 0 | 0 | 111.3 | N141 G142 L143 A147 G148 | N141-A145 WeakPolarHBondContact O-CB 3.41Å; N141-A145 PolarHBondContact O-N 3.4Å; G142-A145 WeakPolarHBondContact O-CB 3.39Å; G142-A145 PolarHBondContact O-N 3.21Å; G142-A145 VanDerWaalsContact O-N 3.07Å; L143-A145 VanDerWaalsContact C-N 3.33Å; A145-A147 VanDerWaalsContact C-N 3.34Å; A145-A147 PolarHBondContact O-N 3.32Å; A145-G148 PolarHBondContact O-N 2.97Å |
| 146 | E | 82.7 | Confident | 77.3 | Confident | 160 Ų | 160 | 88.2 Ų | 88.2 | 75% | 0.748 | 49% | 0.49 | S | S | * | . | H | α-helix | trans | -64.8 | -35.6 | 177.4 | -73.2 | 175.3 | -175.6 | 0 | 0 | 112.6 | G142 L143 G148 | G142-E146 WeakPolarHBondContact O-CG 3.45Å; G142-E146 PolarHBondContact O-N 2.94Å; L143-E146 PolarHBondContact O-N 2.9Å; E146-G148 PolarHBondContact O-N 3.36Å; E146-G148 VanDerWaalsContact O-N 3.07Å |
| 147 | A | 81.8 | Confident | 76.4 | Confident | 69 Ų | 69 | 90.4 Ų | 90.4 | 57% | 0.57 | 50% | 0.503 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -71.9 | 6.3 | 175.9 | 0 | 0 | 0 | 0 | 0 | 114 | L143 A145 T149 | L143-A147 VanDerWaalsContact O-CB 3.29Å; L143-A147 WeakPolarHBondContact O-CB 3.42Å; L143-A147 PolarHBondContact O-N 2.92Å; A145-A147 VanDerWaalsContact C-N 3.34Å; A145-A147 PolarHBondContact O-N 3.32Å; A147-T149 VanDerWaalsContact CB-OG1 3.31Å; A147-T149 WeakPolarHBondContact CB-OG1 3.33Å; A147-T149 PolarHBondContact O-N 2.64Å; A147-T149 PolarHBondContact O-OG1 3.38Å; A147-T149 VanDerWaalsContact O-OG1 3.05Å |
| 148 | G | 72.8 | Confident | 75.7 | Confident | 67 Ų | 67 | 94.6 Ų | 94.6 | 69% | 0.691 | 51% | 0.513 | S | S | * | . | T | Hydrogen-bonded Turn | trans | 64.2 | 5 | 177.7 | 0 | 0 | 0 | 0 | 0 | 114.5 | A145 E146 G150 | A145-G148 PolarHBondContact O-N 2.97Å; E146-G148 PolarHBondContact O-N 3.36Å; E146-G148 VanDerWaalsContact O-N 3.07Å; G148-G150 PolarHBondContact O-N 3.34Å |
| 149 | T | 64.4 | Low | 75.2 | Confident | 53 Ų | 53 | 96.4 Ų | 96.4 | 33% | 0.325 | 51% | 0.514 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -85.4 | -1.4 | -172.4 | -4.7 | 0 | 0 | 0 | 0 | 112.2 | A147 G151 L153 | A147-T149 VanDerWaalsContact CB-OG1 3.31Å; A147-T149 WeakPolarHBondContact CB-OG1 3.33Å; A147-T149 PolarHBondContact O-N 2.64Å; A147-T149 PolarHBondContact O-OG1 3.38Å; A147-T149 VanDerWaalsContact O-OG1 3.05Å; T149-G151 VanDerWaalsContact C-N 3.32Å; T149-G151 PolarHBondContact O-N 3.08Å; T149-L153 HydrophobicContact CG2-CD1 3.56Å; T149-L153 HydrophobicContact CG2-CD2 4.43Å; T149-L153 HydrophobicContact CG2-CG 3.71Å; T149-L153 VanDerWaalsContact O-CB 3.27Å; T149-L153 WeakPolarHBondContact O-CB 3.45Å; T149-L153 WeakPolarHBondContact O-CG 3.27Å; T149-L153 PolarHBondContact O-N 3.05Å; T149-L153 VanDerWaalsContact O-N 3.1Å |
| 150 | G | 61.4 | Low | 74.7 | Confident | 26 Ų | 26 | 93.2 Ų | 93.2 | 27% | 0.268 | 51% | 0.511 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -66.9 | -20.5 | -172.1 | 0 | 0 | 0 | 0 | 0 | 116.1 | G148 R154 | G148-G150 PolarHBondContact O-N 3.34Å; G150-R154 WeakPolarHBondContact O-CD 3.46Å; G150-R154 WeakPolarHBondContact O-CG 3.39Å; G150-R154 PolarHBondContact O-NE 3.45Å |
| 151 | G | 63.5 | Low | 74.4 | Confident | 57 Ų | 57 | 89 Ų | 89 | 59% | 0.588 | 51% | 0.507 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -84.3 | -56 | 177.1 | 0 | 0 | 0 | 0 | 0 | 112.7 | T149 R154 | T149-G151 VanDerWaalsContact C-N 3.32Å; T149-G151 PolarHBondContact O-N 3.08Å; G151-R154 PolarHBondContact O-N 3.04Å |
| 152 | F | 62.4 | Low | 74.6 | Confident | 134 Ų | 134 | 90.1 Ų | 90.1 | 59% | 0.588 | 51% | 0.507 | S | S | * | . | H | α-helix | trans | -71.1 | -40.1 | -175.8 | -176.1 | -98.8 | 0 | 0 | 0 | 113.1 | R154 S155 E156 | F152-R154 VanDerWaalsContact C-N 3.29Å; F152-R154 PolarHBondContact O-N 2.95Å; F152-S155 PolarHBondContact O-N 3.4Å; F152-S155 PolarHBondContact O-OG 2.9Å; F152-E156 HydrophobicContact CE1-CG 4Å; F152-E156 HydrophobicContact CE2-CG 4.49Å; F152-E156 HydrophobicContact CZ-CG 3.98Å; F152-E156 PolarHBondContact O-N 3.48Å; F152-E156 VanDerWaalsContact O-N 3.16Å |
| 153 | L | 64.8 | Low | 75 | Confident | 57 Ų | 57 | 94.2 Ų | 94.2 | 30% | 0.298 | 52% | 0.522 | S | S | . | . | H | α-helix | trans | -68 | -29 | 177 | -67.1 | 179.3 | 0 | 0 | 0 | 112.1 | T149 L157 | T149-L153 HydrophobicContact CG2-CD1 3.56Å; T149-L153 HydrophobicContact CG2-CD2 4.43Å; T149-L153 HydrophobicContact CG2-CG 3.71Å; T149-L153 VanDerWaalsContact O-CB 3.27Å; T149-L153 WeakPolarHBondContact O-CB 3.45Å; T149-L153 WeakPolarHBondContact O-CG 3.27Å; T149-L153 PolarHBondContact O-N 3.05Å; T149-L153 VanDerWaalsContact O-N 3.1Å; L153-L157 HydrophobicContact CB-CD1 4.21Å; L153-L157 WeakPolarHBondContact O-CA 3.44Å; L153-L157 WeakPolarHBondContact O-CB 3.31Å; L153-L157 WeakPolarHBondContact O-CD1 3.42Å; L153-L157 WeakPolarHBondContact O-CG 3.29Å; L153-L157 PolarHBondContact O-N 3.06Å |
| 154 | R | 64.1 | Low | 75.4 | Confident | 193 Ų | 193 | 95.6 Ų | 95.6 | 73% | 0.728 | 53% | 0.526 | S | S | * | . | H | α-helix | trans | -69.6 | -38.4 | 178.2 | -76.8 | -179.7 | -166.7 | -133.5 | 1.8 | 112.1 | G150 G151 F152 R158 | G150-R154 WeakPolarHBondContact O-CD 3.46Å; G150-R154 WeakPolarHBondContact O-CG 3.39Å; G150-R154 PolarHBondContact O-NE 3.45Å; G151-R154 PolarHBondContact O-N 3.04Å; F152-R154 VanDerWaalsContact C-N 3.29Å; F152-R154 PolarHBondContact O-N 2.95Å; R154-R158 WeakPolarHBondContact O-CB 3.46Å; R154-R158 PolarHBondContact O-N 3.44Å |
| 155 | S | 69.9 | Low | 76 | Confident | 64 Ų | 64 | 94.2 Ų | 94.2 | 45% | 0.448 | 53% | 0.528 | S | S | . | . | H | α-helix | trans | -68.5 | -45.6 | 175.2 | 46.1 | 0 | 0 | 0 | 0 | 111.7 | F152 R158 M159 | F152-S155 PolarHBondContact O-N 3.4Å; F152-S155 PolarHBondContact O-OG 2.9Å; S155-R158 PolarHBondContact O-N 3.18Å; S155-M159 WeakPolarHBondContact O-CG 3.46Å; S155-M159 PolarHBondContact O-N 2.83Å |
| 156 | E | 73.1 | Confident | 76.7 | Confident | 105 Ų | 105 | 93.1 Ų | 93.1 | 49% | 0.491 | 52% | 0.52 | S | S | . | . | H | α-helix | trans | -70.5 | -41 | 178.8 | -71.6 | -141.3 | 142.4 | 0 | 0 | 113.1 | F152 R158 M159 T160 | F152-E156 HydrophobicContact CE1-CG 4Å; F152-E156 HydrophobicContact CE2-CG 4.49Å; F152-E156 HydrophobicContact CZ-CG 3.98Å; F152-E156 PolarHBondContact O-N 3.48Å; F152-E156 VanDerWaalsContact O-N 3.16Å; E156-R158 VanDerWaalsContact C-N 3.26Å; E156-R158 PolarHBondContact O-N 2.91Å; E156-M159 PolarHBondContact O-N 3.24Å; E156-M159 VanDerWaalsContact O-N 3.15Å; E156-T160 WeakPolarHBondContact O-CG2 3.32Å; E156-T160 PolarHBondContact O-N 3.45Å; E156-T160 PolarHBondContact O-OG1 3.1Å |
| 157 | L | 75.4 | Confident | 77.2 | Confident | 99 Ų | 99 | 89.1 Ų | 89.1 | 52% | 0.518 | 50% | 0.504 | S | S | . | . | H | α-helix | trans | -63.6 | -34.5 | 174 | -72.4 | 168.8 | 0 | 0 | 0 | 111.4 | L153 T160 A161 | L153-L157 HydrophobicContact CB-CD1 4.21Å; L153-L157 WeakPolarHBondContact O-CA 3.44Å; L153-L157 WeakPolarHBondContact O-CB 3.31Å; L153-L157 WeakPolarHBondContact O-CD1 3.42Å; L153-L157 WeakPolarHBondContact O-CG 3.29Å; L153-L157 PolarHBondContact O-N 3.06Å; L157-T160 VanDerWaalsContact CA-OG1 3.26Å; L157-T160 WeakPolarHBondContact CA-OG1 3.26Å; L157-T160 PolarHBondContact O-OG1 3.02Å; L157-T160 VanDerWaalsContact O-OG1 3.06Å; L157-A161 WeakPolarHBondContact O-CB 3.47Å; L157-A161 PolarHBondContact O-N 3.36Å |
| 158 | R | 75.7 | Confident | 77.8 | Confident | 170 Ų | 170 | 89.4 Ų | 89.4 | 64% | 0.642 | 50% | 0.495 | S | S | * | . | H | α-helix | trans | -67.3 | -39.7 | 173.7 | -172.3 | 178 | -175.3 | -167.2 | -0.4 | 111.4 | R154 S155 E156 K162 | R154-R158 WeakPolarHBondContact O-CB 3.46Å; R154-R158 PolarHBondContact O-N 3.44Å; S155-R158 PolarHBondContact O-N 3.18Å; E156-R158 VanDerWaalsContact C-N 3.26Å; E156-R158 PolarHBondContact O-N 2.91Å; R158-K162 WeakPolarHBondContact O-CB 3.44Å; R158-K162 VanDerWaalsContact O-CG 3.23Å; R158-K162 WeakPolarHBondContact O-CG 3.33Å; R158-K162 PolarHBondContact O-N 3.24Å |
| 159 | M | 78.8 | Confident | 78.7 | Confident | 121 Ų | 121 | 89.1 Ų | 89.1 | 60% | 0.596 | 49% | 0.487 | S | S | * | . | H | α-helix | trans | -68 | -44.7 | 177.4 | -73.8 | -57.6 | -67.7 | 0 | 0 | 112.2 | S155 E156 K162 L163 | S155-M159 WeakPolarHBondContact O-CG 3.46Å; S155-M159 PolarHBondContact O-N 2.83Å; E156-M159 PolarHBondContact O-N 3.24Å; E156-M159 VanDerWaalsContact O-N 3.15Å; M159-K162 PolarHBondContact O-N 2.82Å; M159-K162 HydrophobicContact SD-CD 4.29Å; M159-L163 WeakPolarHBondContact O-CB 3.34Å; M159-L163 PolarHBondContact O-N 2.93Å |
| 160 | T | 81.9 | Confident | 80.2 | Confident | 78 Ų | 78 | 95 Ų | 95 | 48% | 0.479 | 50% | 0.503 | S | S | . | . | H | α-helix | trans | -65.5 | -40 | 175.5 | 50.9 | 0 | 0 | 0 | 0 | 111.9 | E156 L157 L163 Q164 | E156-T160 WeakPolarHBondContact O-CG2 3.32Å; E156-T160 PolarHBondContact O-N 3.45Å; E156-T160 PolarHBondContact O-OG1 3.1Å; L157-T160 VanDerWaalsContact CA-OG1 3.26Å; L157-T160 WeakPolarHBondContact CA-OG1 3.26Å; L157-T160 PolarHBondContact O-OG1 3.02Å; L157-T160 VanDerWaalsContact O-OG1 3.06Å; T160-L163 PolarHBondContact O-N 2.99Å; T160-Q164 WeakPolarHBondContact O-CB 3.46Å; T160-Q164 PolarHBondContact O-N 3.43Å |
| 161 | A | 81.3 | Confident | 81.9 | Confident | 54 Ų | 54 | 101.4 Ų | 101.4 | 45% | 0.446 | 52% | 0.519 | S | S | . | . | H | α-helix | trans | -64.4 | -39.8 | 173.4 | 0 | 0 | 0 | 0 | 0 | 112.4 | L157 Q164 A165 | L157-A161 WeakPolarHBondContact O-CB 3.47Å; L157-A161 PolarHBondContact O-N 3.36Å; A161-Q164 PolarHBondContact O-N 2.84Å; A161-A165 VanDerWaalsContact O-CB 3.27Å; A161-A165 WeakPolarHBondContact O-CB 3.49Å; A161-A165 PolarHBondContact O-N 2.86Å |
| 162 | K | 87.8 | Confident | 83.3 | Confident | 112 Ų | 112 | 100.3 Ų | 100.3 | 49% | 0.487 | 50% | 0.504 | S | S | . | . | H | α-helix | trans | -62.8 | -45 | 173.2 | -79.4 | 176.5 | 176.6 | -172.7 | 0 | 111.4 | R158 M159 Q164 A165 A166 | R158-K162 WeakPolarHBondContact O-CB 3.44Å; R158-K162 VanDerWaalsContact O-CG 3.23Å; R158-K162 WeakPolarHBondContact O-CG 3.33Å; R158-K162 PolarHBondContact O-N 3.24Å; M159-K162 PolarHBondContact O-N 2.82Å; M159-K162 HydrophobicContact SD-CD 4.29Å; K162-Q164 VanDerWaalsContact C-N 3.35Å; K162-A165 PolarHBondContact O-N 3.47Å; K162-A166 WeakPolarHBondContact O-CB 3.41Å; K162-A166 PolarHBondContact O-N 2.87Å |
| 163 | L | 93 | Very high | 84.9 | Confident | 114 Ų | 114 | 95.9 Ų | 95.9 | 60% | 0.597 | 49% | 0.492 | S | S | * | . | H | α-helix | trans | -62.3 | -43.3 | 177.6 | -170.4 | 76 | 0 | 0 | 0 | 111.2 | M159 T160 A166 N167 | M159-L163 WeakPolarHBondContact O-CB 3.34Å; M159-L163 PolarHBondContact O-N 2.93Å; T160-L163 PolarHBondContact O-N 2.99Å; L163-A166 PolarHBondContact O-N 3.25Å; L163-N167 PolarHBondContact O-N 3.12Å; L163-N167 PolarHBondContact O-ND2 3.25Å |
| 164 | Q | 92.4 | Very high | 86.5 | Confident | 121 Ų | 121 | 96.6 Ų | 96.6 | 57% | 0.565 | 50% | 0.499 | S | S | * | . | H | α-helix | trans | -64.6 | -46 | 176.2 | -174.6 | 171.4 | -0.6 | 0 | 0 | 111.5 | T160 A161 K162 A166 N167 D168 | T160-Q164 WeakPolarHBondContact O-CB 3.46Å; T160-Q164 PolarHBondContact O-N 3.43Å; A161-Q164 PolarHBondContact O-N 2.84Å; K162-Q164 VanDerWaalsContact C-N 3.35Å; Q164-A166 VanDerWaalsContact C-N 3.28Å; Q164-A166 PolarHBondContact O-N 2.92Å; Q164-N167 PolarHBondContact O-N 3.11Å; Q164-N167 VanDerWaalsContact O-N 3.13Å; Q164-D168 WeakPolarHBondContact O-CB 3.47Å; Q164-D168 PolarHBondContact O-N 3.39Å |
| 165 | A | 90.3 | Very high | 88.1 | Confident | 58 Ų | 58 | 92.5 Ų | 92.5 | 48% | 0.479 | 49% | 0.488 | S | S | . | . | H | α-helix | trans | -60.3 | -38.5 | 175.7 | 0 | 0 | 0 | 0 | 0 | 112.1 | A161 K162 A169 | A161-A165 VanDerWaalsContact O-CB 3.27Å; A161-A165 WeakPolarHBondContact O-CB 3.49Å; A161-A165 PolarHBondContact O-N 2.86Å; K162-A165 PolarHBondContact O-N 3.47Å; A165-A169 VanDerWaalsContact O-CB 3.27Å; A165-A169 WeakPolarHBondContact O-CB 3.35Å; A165-A169 PolarHBondContact O-N 3.38Å |
| 166 | A | 93.4 | Very high | 89.4 | Confident | 44 Ų | 44 | 98.1 Ų | 98.1 | 36% | 0.364 | 50% | 0.499 | S | S | . | . | H | α-helix | trans | -65.7 | -41.1 | 174.5 | 0 | 0 | 0 | 0 | 0 | 112 | K162 L163 Q164 A169 R170 | K162-A166 WeakPolarHBondContact O-CB 3.41Å; K162-A166 PolarHBondContact O-N 2.87Å; L163-A166 PolarHBondContact O-N 3.25Å; Q164-A166 VanDerWaalsContact C-N 3.28Å; Q164-A166 PolarHBondContact O-N 2.92Å; A166-A169 PolarHBondContact O-N 3.48Å; A166-R170 WeakPolarHBondContact O-CG 3.4Å; A166-R170 PolarHBondContact O-N 3.44Å |
| 167 | N | 93 | Very high | 90.5 | Very high | 76 Ų | 76 | 102 Ų | 102 | 41% | 0.406 | 51% | 0.509 | S | S | . | . | H | α-helix | trans | -66.9 | -41.7 | 175.7 | -77.3 | -31.1 | 0 | 0 | 0 | 112.5 | L163 Q164 A169 R170 R171 | L163-N167 PolarHBondContact O-N 3.12Å; L163-N167 PolarHBondContact O-ND2 3.25Å; Q164-N167 PolarHBondContact O-N 3.11Å; Q164-N167 VanDerWaalsContact O-N 3.13Å; N167-A169 VanDerWaalsContact C-N 3.33Å; N167-R170 WeakPolarHBondContact O-CB 3.42Å; N167-R170 PolarHBondContact O-N 3.24Å; N167-R171 PolarHBondContact O-N 3.26Å |
| 168 | D | 94.1 | Very high | 91.5 | Very high | 75 Ų | 75 | 101.3 Ų | 101.3 | 40% | 0.401 | 51% | 0.506 | S | S | . | . | H | α-helix | trans | -64.8 | -39.8 | 175.6 | -70.6 | -21.1 | 0 | 0 | 0 | 110.9 | Q164 R171 A172 | Q164-D168 WeakPolarHBondContact O-CB 3.47Å; Q164-D168 PolarHBondContact O-N 3.39Å; D168-R171 PolarHBondContact O-N 2.96Å; D168-A172 WeakPolarHBondContact O-CB 3.35Å; D168-A172 PolarHBondContact O-N 3.31Å |
| 169 | A | 92 | Very high | 92.6 | Very high | 61 Ų | 61 | 98.8 Ų | 98.8 | 50% | 0.504 | 51% | 0.505 | S | S | . | . | H | α-helix | trans | -62.6 | -41.9 | 173.6 | 0 | 0 | 0 | 0 | 0 | 112.1 | A165 A166 N167 A172 A173 | A165-A169 VanDerWaalsContact O-CB 3.27Å; A165-A169 WeakPolarHBondContact O-CB 3.35Å; A165-A169 PolarHBondContact O-N 3.38Å; A166-A169 PolarHBondContact O-N 3.48Å; N167-A169 VanDerWaalsContact C-N 3.33Å; A169-A172 PolarHBondContact O-N 2.86Å; A169-A173 WeakPolarHBondContact O-CB 3.33Å; A169-A173 PolarHBondContact O-N 2.85Å |
| 170 | R | 95.4 | Very high | 93.5 | Very high | 176 Ų | 176 | 95.3 Ų | 95.3 | 66% | 0.664 | 50% | 0.496 | S | S | * | . | H | α-helix | trans | -61.9 | -46.2 | 174.3 | -75.1 | 174 | 179.4 | 174.2 | -1.7 | 111.5 | A166 N167 A173 V174 | A166-R170 WeakPolarHBondContact O-CG 3.4Å; A166-R170 PolarHBondContact O-N 3.44Å; N167-R170 WeakPolarHBondContact O-CB 3.42Å; N167-R170 PolarHBondContact O-N 3.24Å; R170-A173 PolarHBondContact O-N 3.15Å; R170-V174 WeakPolarHBondContact O-CG2 3.45Å; R170-V174 PolarHBondContact O-N 2.98Å |
| 171 | R | 97.3 | Very high | 94.2 | Very high | 161 Ų | 161 | 94.3 Ų | 94.3 | 61% | 0.608 | 50% | 0.495 | S | S | * | . | H | α-helix | trans | -60.9 | -47.4 | 177.1 | -172.2 | -177.4 | -70.6 | 156.4 | -2.2 | 111.3 | N167 D168 A173 V174 E175 | N167-R171 PolarHBondContact O-N 3.26Å; D168-R171 PolarHBondContact O-N 2.96Å; R171-A173 VanDerWaalsContact C-N 3.27Å; R171-A173 PolarHBondContact O-N 2.93Å; R171-V174 PolarHBondContact O-N 3.24Å; R171-V174 VanDerWaalsContact O-N 3.15Å; R171-E175 WeakPolarHBondContact O-CG 3.4Å; R171-E175 PolarHBondContact O-N 3.42Å |
| 172 | A | 94.1 | Very high | 95 | Very high | 33 Ų | 33 | 98.7 Ų | 98.7 | 27% | 0.273 | 50% | 0.504 | S | S | . | . | H | α-helix | trans | -61.9 | -34.6 | 177.5 | 0 | 0 | 0 | 0 | 0 | 112.7 | D168 A169 R176 | D168-A172 WeakPolarHBondContact O-CB 3.35Å; D168-A172 PolarHBondContact O-N 3.31Å; A169-A172 PolarHBondContact O-N 2.86Å; A172-R176 VanDerWaalsContact O-CG 3.31Å; A172-R176 WeakPolarHBondContact O-CG 3.41Å; A172-R176 PolarHBondContact O-N 3.15Å; A172-R176 VanDerWaalsContact O-N 3.11Å |
| 173 | A | 95.9 | Very high | 95.4 | Very high | 41 Ų | 41 | 103.3 Ų | 103.3 | 34% | 0.339 | 52% | 0.518 | S | S | . | . | H | α-helix | trans | -67.1 | -40.9 | 174.9 | 0 | 0 | 0 | 0 | 0 | 112.1 | A169 R170 R171 R176 R177 | A169-A173 WeakPolarHBondContact O-CB 3.33Å; A169-A173 PolarHBondContact O-N 2.85Å; R170-A173 PolarHBondContact O-N 3.15Å; R171-A173 VanDerWaalsContact C-N 3.27Å; R171-A173 PolarHBondContact O-N 2.93Å; A173-R176 PolarHBondContact O-N 3.41Å; A173-R177 WeakPolarHBondContact O-CG 3.24Å; A173-R177 PolarHBondContact O-N 3.15Å; A173-R177 VanDerWaalsContact O-N 3.12Å |
| 174 | V | 97.6 | Very high | 95.5 | Very high | 73 Ų | 73 | 103 Ų | 103 | 44% | 0.442 | 52% | 0.516 | S | S | . | . | H | α-helix | trans | -63.5 | -47.3 | 174.5 | 173.8 | 0 | 0 | 0 | 0 | 110.7 | R170 R171 R176 R177 D178 | R170-V174 WeakPolarHBondContact O-CG2 3.45Å; R170-V174 PolarHBondContact O-N 2.98Å; R171-V174 PolarHBondContact O-N 3.24Å; R171-V174 VanDerWaalsContact O-N 3.15Å; V174-R176 VanDerWaalsContact C-N 3.27Å; V174-R176 PolarHBondContact O-N 2.92Å; V174-R177 WeakPolarHBondContact O-CA 3.35Å; V174-R177 WeakPolarHBondContact O-CB 3.38Å; V174-R177 PolarHBondContact O-N 3.01Å; V174-D178 PolarHBondContact O-N 3.33Å |
| 175 | E | 97.8 | Very high | 95.7 | Very high | 106 Ų | 106 | 100.1 Ų | 100.1 | 50% | 0.495 | 51% | 0.51 | S | S | . | . | H | α-helix | trans | -58.2 | -39 | 178 | -72.3 | 173.7 | -173.3 | 0 | 0 | 112.5 | R171 D178 L179 | R171-E175 WeakPolarHBondContact O-CG 3.4Å; R171-E175 PolarHBondContact O-N 3.42Å; E175-D178 PolarHBondContact O-N 3.48Å; E175-L179 WeakPolarHBondContact O-CB 3.44Å; E175-L179 VanDerWaalsContact O-CG 3.29Å; E175-L179 WeakPolarHBondContact O-CG 3.47Å; E175-L179 PolarHBondContact O-N 3.14Å |
| 176 | R | 96.7 | Very high | 96.1 | Very high | 182 Ų | 182 | 104.8 Ų | 104.8 | 69% | 0.687 | 52% | 0.516 | S | S | * | . | H | α-helix | trans | -64.7 | -40.8 | 174.3 | -72.8 | 175.7 | -166.3 | 165 | 5.5 | 112.3 | A172 A173 V174 D178 L179 A180 | A172-R176 VanDerWaalsContact O-CG 3.31Å; A172-R176 WeakPolarHBondContact O-CG 3.41Å; A172-R176 PolarHBondContact O-N 3.15Å; A172-R176 VanDerWaalsContact O-N 3.11Å; A173-R176 PolarHBondContact O-N 3.41Å; V174-R176 VanDerWaalsContact C-N 3.27Å; V174-R176 PolarHBondContact O-N 2.92Å; R176-D178 VanDerWaalsContact C-N 3.35Å; R176-L179 PolarHBondContact O-N 2.88Å; R176-A180 WeakPolarHBondContact O-CB 3.49Å; R176-A180 PolarHBondContact O-N 3.06Å |
| 177 | R | 96.9 | Very high | 96.3 | Very high | 187 Ų | 187 | 104.2 Ų | 104.2 | 71% | 0.706 | 51% | 0.514 | S | S | * | . | H | α-helix | trans | -63.3 | -43.1 | 175.6 | -72.7 | 176.9 | -179.9 | 172.2 | 0.8 | 110.7 | A173 V174 A180 A181 | A173-R177 WeakPolarHBondContact O-CG 3.24Å; A173-R177 PolarHBondContact O-N 3.15Å; A173-R177 VanDerWaalsContact O-N 3.12Å; V174-R177 WeakPolarHBondContact O-CA 3.35Å; V174-R177 WeakPolarHBondContact O-CB 3.38Å; V174-R177 PolarHBondContact O-N 3.01Å; R177-A180 PolarHBondContact O-N 3.29Å; R177-A181 WeakPolarHBondContact O-CB 3.47Å; R177-A181 PolarHBondContact O-N 2.88Å |
| 178 | D | 97.3 | Very high | 96.5 | Very high | 85 Ų | 85 | 104.8 Ų | 104.8 | 46% | 0.455 | 52% | 0.517 | S | S | . | . | H | α-helix | trans | -65.3 | -40.9 | 178.5 | -67.8 | -15.6 | 0 | 0 | 0 | 112.1 | V174 E175 R176 A181 K182 | V174-D178 PolarHBondContact O-N 3.33Å; E175-D178 PolarHBondContact O-N 3.48Å; R176-D178 VanDerWaalsContact C-N 3.35Å; D178-A181 PolarHBondContact O-N 2.95Å; D178-K182 WeakPolarHBondContact O-CB 3.5Å; D178-K182 VanDerWaalsContact O-CG 3.3Å; D178-K182 WeakPolarHBondContact O-CG 3.27Å; D178-K182 PolarHBondContact O-N 3.15Å |
| 179 | L | 97.5 | Very high | 96.7 | Very high | 116 Ų | 116 | 104.8 Ų | 104.8 | 61% | 0.607 | 52% | 0.517 | S | S | * | . | H | α-helix | trans | -64.3 | -40.2 | 174.1 | -72.7 | 172.6 | 0 | 0 | 0 | 112 | E175 R176 K182 R183 | E175-L179 WeakPolarHBondContact O-CB 3.44Å; E175-L179 VanDerWaalsContact O-CG 3.29Å; E175-L179 WeakPolarHBondContact O-CG 3.47Å; E175-L179 PolarHBondContact O-N 3.14Å; R176-L179 PolarHBondContact O-N 2.88Å; L179-K182 PolarHBondContact O-N 2.9Å; L179-R183 PolarHBondContact O-N 2.91Å |
| 180 | A | 97.3 | Very high | 96.9 | Very high | 49 Ų | 49 | 106.5 Ų | 106.5 | 41% | 0.405 | 52% | 0.515 | S | S | . | . | H | α-helix | trans | -64.4 | -44.3 | 174.6 | 0 | 0 | 0 | 0 | 0 | 111.4 | R176 R177 K182 R183 I184 | R176-A180 WeakPolarHBondContact O-CB 3.49Å; R176-A180 PolarHBondContact O-N 3.06Å; R177-A180 PolarHBondContact O-N 3.29Å; A180-K182 PolarHBondContact O-N 3.46Å; A180-R183 PolarHBondContact O-N 2.95Å; A180-I184 WeakPolarHBondContact O-CG1 3.4Å; A180-I184 PolarHBondContact O-N 3.33Å |
| 181 | A | 97.4 | Very high | 97 | Very high | 56 Ų | 56 | 101 Ų | 101 | 46% | 0.463 | 50% | 0.503 | S | S | . | . | H | α-helix | trans | -60.6 | -44.2 | 176.2 | 0 | 0 | 0 | 0 | 0 | 111.7 | R177 D178 R183 I184 S185 | R177-A181 WeakPolarHBondContact O-CB 3.47Å; R177-A181 PolarHBondContact O-N 2.88Å; D178-A181 PolarHBondContact O-N 2.95Å; A181-R183 VanDerWaalsContact C-N 3.35Å; A181-R183 PolarHBondContact O-N 3.25Å; A181-I184 PolarHBondContact O-N 2.93Å; A181-S185 WeakPolarHBondContact O-CB 3.37Å; A181-S185 PolarHBondContact O-N 2.95Å |
| 182 | K | 98 | Very high | 97.1 | Very high | 147 Ų | 147 | 102 Ų | 102 | 64% | 0.639 | 51% | 0.507 | S | S | * | . | H | α-helix | trans | -60 | -42.4 | 174.3 | -75.3 | 172.7 | -178.2 | 176 | 0 | 112.2 | D178 L179 A180 S185 Y186 | D178-K182 WeakPolarHBondContact O-CB 3.5Å; D178-K182 VanDerWaalsContact O-CG 3.3Å; D178-K182 WeakPolarHBondContact O-CG 3.27Å; D178-K182 PolarHBondContact O-N 3.15Å; L179-K182 PolarHBondContact O-N 2.9Å; A180-K182 PolarHBondContact O-N 3.46Å; K182-S185 PolarHBondContact O-N 3.06Å; K182-Y186 WeakPolarHBondContact O-CB 3.36Å; K182-Y186 PolarHBondContact O-N 3.32Å |
| 183 | R | 96 | Very high | 97.3 | Very high | 208 Ų | 208 | 105 Ų | 105 | 79% | 0.785 | 52% | 0.516 | S | S | * | . | H | α-helix | trans | -63.9 | -41.7 | 176.8 | -175.1 | 178.1 | 179.7 | -179.1 | -0.4 | 112 | L179 A180 A181 G187 | L179-R183 PolarHBondContact O-N 2.91Å; A180-R183 PolarHBondContact O-N 2.95Å; A181-R183 VanDerWaalsContact C-N 3.35Å; A181-R183 PolarHBondContact O-N 3.25Å; R183-G187 PolarHBondContact O-N 3.46Å |
| 184 | I | 95.3 | Very high | 97.3 | Very high | 108 Ų | 108 | 106.9 Ų | 106.9 | 55% | 0.554 | 52% | 0.52 | S | S | * | . | H | α-helix | trans | -65.1 | -46 | 176.3 | -67.5 | 166.2 | 0 | 0 | 0 | 110.2 | A180 A181 Y186 G187 N188 | A180-I184 WeakPolarHBondContact O-CG1 3.4Å; A180-I184 PolarHBondContact O-N 3.33Å; A181-I184 PolarHBondContact O-N 2.93Å; I184-Y186 PolarHBondContact O-N 3.38Å; I184-G187 PolarHBondContact O-N 2.87Å; I184-N188 WeakPolarHBondContact O-CB 3.39Å; I184-N188 VanDerWaalsContact O-CG 3.25Å; I184-N188 PolarHBondContact O-N 3.07Å; I184-N188 PolarHBondContact O-ND2 3.38Å |
| 185 | S | 97.4 | Very high | 97.4 | Very high | 61 Ų | 61 | 107.5 Ų | 107.5 | 43% | 0.427 | 52% | 0.52 | S | S | . | . | H | α-helix | trans | -57.2 | -49.6 | 177 | -167 | 0 | 0 | 0 | 0 | 111.3 | A181 K182 G187 N188 D189 | A181-S185 WeakPolarHBondContact O-CB 3.37Å; A181-S185 PolarHBondContact O-N 2.95Å; K182-S185 PolarHBondContact O-N 3.06Å; S185-G187 VanDerWaalsContact C-N 3.34Å; S185-G187 PolarHBondContact O-N 3.43Å; S185-N188 WeakPolarHBondContact O-CB 3.48Å; S185-N188 PolarHBondContact O-N 2.82Å; S185-N188 VanDerWaalsContact O-N 3.11Å; S185-D189 VanDerWaalsContact O-CG 3.27Å; S185-D189 PolarHBondContact O-N 3.01Å |
| 186 | Y | 97.6 | Very high | 97.4 | Very high | 156 Ų | 156 | 107 Ų | 107 | 61% | 0.612 | 52% | 0.517 | S | S | * | . | H | α-helix | trans | -59.2 | -43.3 | 177.8 | 178.4 | -101.4 | 0 | 0 | 0 | 112.6 | K182 I184 N188 D189 Q190 | K182-Y186 WeakPolarHBondContact O-CB 3.36Å; K182-Y186 PolarHBondContact O-N 3.32Å; I184-Y186 PolarHBondContact O-N 3.38Å; Y186-N188 VanDerWaalsContact C-N 3.33Å; Y186-N188 PolarHBondContact O-N 3.33Å; Y186-D189 PolarHBondContact O-N 3.32Å; Y186-Q190 WeakPolarHBondContact O-CB 3.34Å; Y186-Q190 PolarHBondContact O-N 3.26Å |
| 187 | G | 97.6 | Very high | 97.4 | Very high | 31 Ų | 31 | 105.8 Ų | 105.8 | 32% | 0.32 | 51% | 0.513 | S | S | . | . | H | α-helix | trans | -62.8 | -39 | 175.3 | 0 | 0 | 0 | 0 | 0 | 112.8 | R183 I184 S185 Q190 S191 | R183-G187 PolarHBondContact O-N 3.46Å; I184-G187 PolarHBondContact O-N 2.87Å; S185-G187 VanDerWaalsContact C-N 3.34Å; S185-G187 PolarHBondContact O-N 3.43Å; G187-Q190 PolarHBondContact O-N 3.47Å; G187-S191 WeakPolarHBondContact O-CB 3.29Å; G187-S191 PolarHBondContact O-N 3.37Å |
| 188 | N | 97.9 | Very high | 97.5 | Very high | 89 Ų | 89 | 101.5 Ų | 101.5 | 48% | 0.476 | 50% | 0.502 | S | S | . | . | H | α-helix | trans | -65.8 | -43 | 175.7 | -71 | -17.8 | 0 | 0 | 0 | 111.7 | I184 S185 Y186 S191 R192 | I184-N188 WeakPolarHBondContact O-CB 3.39Å; I184-N188 VanDerWaalsContact O-CG 3.25Å; I184-N188 PolarHBondContact O-N 3.07Å; I184-N188 PolarHBondContact O-ND2 3.38Å; S185-N188 WeakPolarHBondContact O-CB 3.48Å; S185-N188 PolarHBondContact O-N 2.82Å; S185-N188 VanDerWaalsContact O-N 3.11Å; Y186-N188 VanDerWaalsContact C-N 3.33Å; Y186-N188 PolarHBondContact O-N 3.33Å; N188-S191 WeakPolarHBondContact O-CB 3.48Å; N188-S191 PolarHBondContact O-N 2.83Å; N188-R192 WeakPolarHBondContact O-CG 3.38Å; N188-R192 PolarHBondContact O-N 3.18Å |
| 189 | D | 97.8 | Very high | 97.5 | Very high | 75 Ų | 75 | 102.3 Ų | 102.3 | 40% | 0.401 | 51% | 0.506 | S | S | . | . | H | α-helix | trans | -64.2 | -42.3 | 177.6 | -65.1 | -28.1 | 0 | 0 | 0 | 111.2 | S185 Y186 S191 R192 Q193 | S185-D189 VanDerWaalsContact O-CG 3.27Å; S185-D189 PolarHBondContact O-N 3.01Å; Y186-D189 PolarHBondContact O-N 3.32Å; D189-S191 VanDerWaalsContact C-N 3.34Å; D189-S191 PolarHBondContact O-N 2.89Å; D189-R192 PolarHBondContact O-N 3.48Å; D189-Q193 WeakPolarHBondContact O-CG 3.27Å; D189-Q193 PolarHBondContact O-N 3.45Å |
| 190 | Q | 97.3 | Very high | 97.5 | Very high | 96 Ų | 96 | 99.3 Ų | 99.3 | 45% | 0.449 | 49% | 0.49 | S | S | . | . | H | α-helix | trans | -62.3 | -41.4 | 174.2 | -168.2 | -179.9 | 16.7 | 0 | 0 | 111.8 | Y186 G187 Q193 N194 | Y186-Q190 WeakPolarHBondContact O-CB 3.34Å; Y186-Q190 PolarHBondContact O-N 3.26Å; G187-Q190 PolarHBondContact O-N 3.47Å; Q190-Q193 PolarHBondContact O-N 3.42Å; Q190-N194 VanDerWaalsContact O-CG 3.31Å; Q190-N194 PolarHBondContact O-N 2.9Å; Q190-N194 PolarHBondContact O-ND2 2.84Å |
| 191 | S | 97.4 | Very high | 97.5 | Very high | 61 Ų | 61 | 102 Ų | 102 | 43% | 0.427 | 49% | 0.494 | S | S | . | . | H | α-helix | trans | -62.9 | -45.5 | 175 | -175.4 | 0 | 0 | 0 | 0 | 111.8 | G187 N188 D189 Q193 N194 I195 | G187-S191 WeakPolarHBondContact O-CB 3.29Å; G187-S191 PolarHBondContact O-N 3.37Å; N188-S191 WeakPolarHBondContact O-CB 3.48Å; N188-S191 PolarHBondContact O-N 2.83Å; D189-S191 VanDerWaalsContact C-N 3.34Å; D189-S191 PolarHBondContact O-N 2.89Å; S191-Q193 VanDerWaalsContact C-N 3.34Å; S191-Q193 PolarHBondContact O-N 2.98Å; S191-N194 PolarHBondContact O-N 3.39Å; S191-N194 VanDerWaalsContact O-N 3.16Å; S191-I195 WeakPolarHBondContact O-CG1 3.48Å; S191-I195 PolarHBondContact O-N 2.96Å |
| 192 | R | 98 | Very high | 97.5 | Very high | 181 Ų | 181 | 107.3 Ų | 107.3 | 68% | 0.683 | 50% | 0.502 | S | S | * | . | H | α-helix | trans | -57.3 | -46.4 | 175.2 | -73.8 | 174.7 | -174.1 | -104.5 | 2.6 | 111.4 | N188 D189 N194 I195 Q196 | N188-R192 WeakPolarHBondContact O-CG 3.38Å; N188-R192 PolarHBondContact O-N 3.18Å; D189-R192 PolarHBondContact O-N 3.48Å; R192-N194 PolarHBondContact O-N 2.87Å; R192-I195 PolarHBondContact O-N 3.23Å; R192-Q196 WeakPolarHBondContact O-CB 3.5Å; R192-Q196 PolarHBondContact O-N 2.9Å |
| 193 | Q | 97.8 | Very high | 97.4 | Very high | 98 Ų | 98 | 105.8 Ų | 105.8 | 46% | 0.458 | 50% | 0.497 | S | S | . | . | H | α-helix | trans | -61.3 | -42.5 | 176.3 | -71.6 | -179 | 13.5 | 0 | 0 | 112.1 | D189 Q190 S191 Q196 R197 | D189-Q193 WeakPolarHBondContact O-CG 3.27Å; D189-Q193 PolarHBondContact O-N 3.45Å; Q190-Q193 PolarHBondContact O-N 3.42Å; S191-Q193 VanDerWaalsContact C-N 3.34Å; S191-Q193 PolarHBondContact O-N 2.98Å; Q193-Q196 PolarHBondContact O-N 3.18Å; Q193-R197 WeakPolarHBondContact O-CG 3.37Å; Q193-R197 PolarHBondContact O-N 3.49Å |
| 194 | N | 97.4 | Very high | 97.4 | Very high | 79 Ų | 79 | 102.4 Ų | 102.4 | 42% | 0.422 | 48% | 0.484 | S | S | . | . | H | α-helix | trans | -64.2 | -42.3 | 177.9 | -74.8 | -18.9 | 0 | 0 | 0 | 112.2 | Q190 S191 R192 R197 M198 | Q190-N194 VanDerWaalsContact O-CG 3.31Å; Q190-N194 PolarHBondContact O-N 2.9Å; Q190-N194 PolarHBondContact O-ND2 2.84Å; S191-N194 PolarHBondContact O-N 3.39Å; S191-N194 VanDerWaalsContact O-N 3.16Å; R192-N194 PolarHBondContact O-N 2.87Å; N194-R197 PolarHBondContact O-N 3.48Å; N194-M198 PolarHBondContact O-N 3.48Å |
| 195 | I | 98.1 | Very high | 97.4 | Very high | 87 Ų | 87 | 104.2 Ų | 104.2 | 45% | 0.446 | 48% | 0.484 | S | S | . | . | H | α-helix | trans | -61.4 | -46.2 | 175.2 | -68.6 | 166.8 | 0 | 0 | 0 | 110.1 | S191 R192 R197 M198 L199 | S191-I195 WeakPolarHBondContact O-CG1 3.48Å; S191-I195 PolarHBondContact O-N 2.96Å; R192-I195 PolarHBondContact O-N 3.23Å; I195-R197 PolarHBondContact O-N 3.09Å; I195-M198 WeakPolarHBondContact O-CB 3.23Å; I195-M198 PolarHBondContact O-N 3.22Å; I195-L199 HydrophobicContact CG2-CD1 4.03Å; I195-L199 HydrophobicContact CG2-CG 4.36Å; I195-L199 WeakPolarHBondContact O-CG 3.31Å; I195-L199 PolarHBondContact O-N 3.34Å |
| 196 | Q | 97.9 | Very high | 97.3 | Very high | 95 Ų | 95 | 106.4 Ų | 106.4 | 44% | 0.444 | 49% | 0.488 | S | S | . | . | H | α-helix | trans | -60.4 | -44.1 | 178.6 | -170.1 | -179.5 | 6.4 | 0 | 0 | 111.9 | R192 Q193 M198 L199 I200 | R192-Q196 WeakPolarHBondContact O-CB 3.5Å; R192-Q196 PolarHBondContact O-N 2.9Å; Q193-Q196 PolarHBondContact O-N 3.18Å; Q196-M198 VanDerWaalsContact C-N 3.33Å; Q196-M198 PolarHBondContact O-N 3.14Å; Q196-L199 PolarHBondContact O-N 3.38Å; Q196-I200 HydrophobicContact CG-CD1 4.13Å; Q196-I200 WeakPolarHBondContact O-CG1 3.27Å; Q196-I200 PolarHBondContact O-N 3.4Å |
| 197 | R | 98 | Very high | 97.1 | Very high | 156 Ų | 156 | 103.5 Ų | 103.5 | 59% | 0.589 | 48% | 0.48 | S | S | * | . | H | α-helix | trans | -59.8 | -43.3 | 174.9 | -70.1 | 176.6 | -159 | -178.6 | 7.6 | 111.9 | Q193 N194 I195 I200 Q201 | Q193-R197 WeakPolarHBondContact O-CG 3.37Å; Q193-R197 PolarHBondContact O-N 3.49Å; N194-R197 PolarHBondContact O-N 3.48Å; I195-R197 PolarHBondContact O-N 3.09Å; R197-I200 PolarHBondContact O-N 2.96Å; R197-Q201 WeakPolarHBondContact O-CB 3.09Å; R197-Q201 PolarHBondContact O-N 3.39Å |
| 198 | M | 97.9 | Very high | 96.9 | Very high | 97 Ų | 97 | 108 Ų | 108 | 48% | 0.478 | 49% | 0.493 | S | S | . | . | H | α-helix | trans | -61.7 | -43.2 | 175.4 | -96.5 | -142.9 | -60.4 | 0 | 0 | 112.3 | N194 I195 Q196 Q201 R202 | N194-M198 PolarHBondContact O-N 3.48Å; I195-M198 WeakPolarHBondContact O-CB 3.23Å; I195-M198 PolarHBondContact O-N 3.22Å; Q196-M198 VanDerWaalsContact C-N 3.33Å; Q196-M198 PolarHBondContact O-N 3.14Å; M198-Q201 PolarHBondContact O-N 3.24Å; M198-R202 WeakPolarHBondContact O-CG 3.39Å; M198-R202 PolarHBondContact O-N 2.96Å |
| 199 | L | 98 | Very high | 96.5 | Very high | 102 Ų | 102 | 110 Ų | 110 | 53% | 0.534 | 50% | 0.499 | S | S | . | . | H | α-helix | trans | -62.7 | -45.9 | 178.5 | -71.3 | 173.7 | 0 | 0 | 0 | 111.3 | I195 Q196 Q201 R202 Q203 | I195-L199 HydrophobicContact CG2-CD1 4.03Å; I195-L199 HydrophobicContact CG2-CG 4.36Å; I195-L199 WeakPolarHBondContact O-CG 3.31Å; I195-L199 PolarHBondContact O-N 3.34Å; Q196-L199 PolarHBondContact O-N 3.38Å; L199-Q201 VanDerWaalsContact C-N 3.31Å; L199-Q201 PolarHBondContact O-N 2.91Å; L199-R202 PolarHBondContact O-N 3.26Å; L199-Q203 PolarHBondContact O-N 2.89Å |
| 200 | I | 97.4 | Very high | 96.2 | Very high | 54 Ų | 54 | 112 Ų | 112 | 28% | 0.277 | 51% | 0.506 | S | S | . | . | H | α-helix | trans | -60.3 | -42.2 | 175.5 | -66.8 | 166.5 | 0 | 0 | 0 | 110.8 | Q196 R197 Q203 R204 | Q196-I200 HydrophobicContact CG-CD1 4.13Å; Q196-I200 WeakPolarHBondContact O-CG1 3.27Å; Q196-I200 PolarHBondContact O-N 3.4Å; R197-I200 PolarHBondContact O-N 2.96Å; I200-Q203 PolarHBondContact O-N 2.91Å; I200-R204 WeakPolarHBondContact O-CG 3.36Å; I200-R204 PolarHBondContact O-N 2.82Å |
| 201 | Q | 97.6 | Very high | 95.7 | Very high | 106 Ų | 106 | 110.1 Ų | 110.1 | 50% | 0.495 | 51% | 0.506 | S | S | . | . | H | α-helix | trans | -65.1 | -40.4 | 178.5 | -168.9 | -179.5 | 23.4 | 0 | 0 | 112.1 | R197 M198 L199 R205 | R197-Q201 WeakPolarHBondContact O-CB 3.09Å; R197-Q201 PolarHBondContact O-N 3.39Å; M198-Q201 PolarHBondContact O-N 3.24Å; L199-Q201 VanDerWaalsContact C-N 3.31Å; L199-Q201 PolarHBondContact O-N 2.91Å; Q201-R205 WeakPolarHBondContact O-CG 3.41Å; Q201-R205 PolarHBondContact O-N 2.9Å |
| 202 | R | 96.8 | Very high | 95.2 | Very high | 166 Ų | 166 | 113 Ų | 113 | 63% | 0.626 | 52% | 0.516 | S | S | * | . | H | α-helix | trans | -64.2 | -43 | 175.1 | -73.9 | -178.9 | -174.7 | -173 | 1.8 | 111.5 | M198 L199 R205 H206 | M198-R202 WeakPolarHBondContact O-CG 3.39Å; M198-R202 PolarHBondContact O-N 2.96Å; L199-R202 PolarHBondContact O-N 3.26Å; R202-R205 PolarHBondContact O-N 3.43Å; R202-H206 PolarHBondContact O-N 3.34Å |
| 203 | Q | 96.3 | Very high | 94.3 | Very high | 116 Ų | 116 | 107.2 Ų | 107.2 | 54% | 0.542 | 51% | 0.508 | S | S | . | . | H | α-helix | trans | -59.5 | -49.4 | 176.3 | -177.6 | 177 | -1 | 0 | 0 | 111.4 | L199 I200 R205 H206 E207 | L199-Q203 PolarHBondContact O-N 2.89Å; I200-Q203 PolarHBondContact O-N 2.91Å; Q203-R205 VanDerWaalsContact C-N 3.31Å; Q203-R205 PolarHBondContact O-N 2.94Å; Q203-H206 WeakPolarHBondContact O-CB 3.3Å; Q203-H206 PolarHBondContact O-N 2.9Å; Q203-H206 VanDerWaalsContact O-N 3.08Å; Q203-E207 WeakPolarHBondContact CG-OE1 3.4Å; Q203-E207 PolarHBondContact NE2-OE1 3.3Å; Q203-E207 WeakPolarHBondContact O-CG 3.44Å; Q203-E207 PolarHBondContact O-N 3.41Å |
| 204 | R | 96.4 | Very high | 93.4 | Very high | 136 Ų | 136 | 105.8 Ų | 105.8 | 51% | 0.513 | 51% | 0.513 | S | S | . | . | H | α-helix | trans | -59.4 | -39.3 | 177 | -71.7 | -175.6 | -169.6 | -168 | 2.5 | 112.8 | I200 H206 E207 Q208 | I200-R204 WeakPolarHBondContact O-CG 3.36Å; I200-R204 PolarHBondContact O-N 2.82Å; R204-H206 VanDerWaalsContact C-N 3.35Å; R204-E207 PolarHBondContact O-N 3.31Å; R204-Q208 WeakPolarHBondContact O-CB 3.4Å; R204-Q208 VanDerWaalsContact O-CG 3.27Å; R204-Q208 WeakPolarHBondContact O-CG 3.26Å; R204-Q208 PolarHBondContact O-N 2.89Å |
| 205 | R | 95.1 | Very high | 92.4 | Very high | 147 Ų | 147 | 107.1 Ų | 107.1 | 56% | 0.555 | 52% | 0.523 | S | S | * | . | H | α-helix | trans | -64.9 | -40 | 175.5 | -75.5 | -176.8 | -176.7 | -176.4 | 2.8 | 111.8 | Q201 R202 Q203 Q208 Q209 | Q201-R205 WeakPolarHBondContact O-CG 3.41Å; Q201-R205 PolarHBondContact O-N 2.9Å; R202-R205 PolarHBondContact O-N 3.43Å; Q203-R205 VanDerWaalsContact C-N 3.31Å; Q203-R205 PolarHBondContact O-N 2.94Å; R205-Q208 PolarHBondContact O-N 3.46Å; R205-Q209 WeakPolarHBondContact O-CB 3.44Å; R205-Q209 VanDerWaalsContact O-CG 3.3Å; R205-Q209 WeakPolarHBondContact O-CG 3.47Å; R205-Q209 PolarHBondContact O-N 3.41Å |
| 206 | H | 94.1 | Very high | 91.1 | Very high | 107 Ų | 107 | 109.1 Ų | 109.1 | 50% | 0.495 | 54% | 0.539 | S | S | . | . | H | α-helix | trans | -65.2 | -44.1 | 177.1 | -166 | -84.1 | 0 | 0 | 0 | 111.5 | R202 Q203 R204 Q209 Q210 | R202-H206 PolarHBondContact O-N 3.34Å; Q203-H206 WeakPolarHBondContact O-CB 3.3Å; Q203-H206 PolarHBondContact O-N 2.9Å; Q203-H206 VanDerWaalsContact O-N 3.08Å; R204-H206 VanDerWaalsContact C-N 3.35Å; H206-Q209 PolarHBondContact O-N 3.46Å; H206-Q210 PolarHBondContact CE1-NE2 2.99Å; H206-Q210 PolarHBondContact ND1-NE2 2.89Å; H206-Q210 WeakPolarHBondContact O-CG 3.36Å; H206-Q210 PolarHBondContact O-N 3.3Å |
| 207 | E | 94.4 | Very high | 89.4 | Confident | 95 Ų | 95 | 108.3 Ų | 108.3 | 44% | 0.444 | 55% | 0.549 | S | S | . | . | H | α-helix | trans | -62.2 | -41.9 | 174.5 | -71 | 167.5 | -174 | 0 | 0 | 111.8 | Q203 R204 Q210 A211 | Q203-E207 WeakPolarHBondContact CG-OE1 3.4Å; Q203-E207 PolarHBondContact NE2-OE1 3.3Å; Q203-E207 WeakPolarHBondContact O-CG 3.44Å; Q203-E207 PolarHBondContact O-N 3.41Å; R204-E207 PolarHBondContact O-N 3.31Å; E207-Q210 PolarHBondContact O-N 3.47Å; E207-A211 WeakPolarHBondContact O-CB 3.15Å; E207-A211 PolarHBondContact O-N 2.9Å |
| 208 | Q | 92.4 | Very high | 87.4 | Confident | 126 Ų | 126 | 105.2 Ų | 105.2 | 59% | 0.589 | 55% | 0.551 | S | S | * | * | H | α-helix | trans | -62.6 | -42.1 | 174 | -76.6 | 175.9 | -2.4 | 0 | 0 | 112.3 | R204 R205 A211 L212 | R204-Q208 WeakPolarHBondContact O-CB 3.4Å; R204-Q208 VanDerWaalsContact O-CG 3.27Å; R204-Q208 WeakPolarHBondContact O-CG 3.26Å; R204-Q208 PolarHBondContact O-N 2.89Å; R205-Q208 PolarHBondContact O-N 3.46Å; Q208-A211 PolarHBondContact O-N 2.85Å; Q208-L212 VanDerWaalsContact O-CG 3.31Å; Q208-L212 WeakPolarHBondContact O-CG 3.07Å; Q208-L212 PolarHBondContact O-N 3.35Å |
| 209 | Q | 91.3 | Very high | 85.4 | Confident | 131 Ų | 131 | 106.1 Ų | 106.1 | 61% | 0.612 | 57% | 0.565 | S | S | * | * | H | α-helix | trans | -64.1 | -40.9 | 175.8 | -75.2 | 175.6 | -1.7 | 0 | 0 | 111.6 | R205 H206 L212 A213 | R205-Q209 WeakPolarHBondContact O-CB 3.44Å; R205-Q209 VanDerWaalsContact O-CG 3.3Å; R205-Q209 WeakPolarHBondContact O-CG 3.47Å; R205-Q209 PolarHBondContact O-N 3.41Å; H206-Q209 PolarHBondContact O-N 3.46Å; Q209-L212 PolarHBondContact O-N 3.36Å; Q209-A213 WeakPolarHBondContact O-CB 3.38Å; Q209-A213 PolarHBondContact O-N 3.34Å |
| 210 | Q | 89.6 | Confident | 83.3 | Confident | 117 Ų | 117 | 105.9 Ų | 105.9 | 55% | 0.547 | 58% | 0.577 | S | S | . | * | H | α-helix | trans | -64.2 | -43.1 | 174.4 | -75.2 | -175.8 | -10.3 | 0 | 0 | 112.2 | H206 E207 L212 A213 A214 | H206-Q210 PolarHBondContact CE1-NE2 2.99Å; H206-Q210 PolarHBondContact ND1-NE2 2.89Å; H206-Q210 WeakPolarHBondContact O-CG 3.36Å; H206-Q210 PolarHBondContact O-N 3.3Å; E207-Q210 PolarHBondContact O-N 3.47Å; Q210-L212 PolarHBondContact O-N 3.37Å; Q210-A213 PolarHBondContact O-N 2.95Å; Q210-A214 WeakPolarHBondContact O-CB 3.05Å; Q210-A214 PolarHBondContact O-N 2.92Å |
| 211 | A | 87.3 | Confident | 81.4 | Confident | 55 Ų | 55 | 107.5 Ų | 107.5 | 46% | 0.455 | 60% | 0.598 | S | S | . | * | H | α-helix | trans | -62.7 | -42.3 | 177.4 | 0 | 0 | 0 | 0 | 0 | 111.9 | E207 Q208 A214 T215 | E207-A211 WeakPolarHBondContact O-CB 3.15Å; E207-A211 PolarHBondContact O-N 2.9Å; Q208-A211 PolarHBondContact O-N 2.85Å; A211-A214 PolarHBondContact O-N 2.93Å; A211-T215 PolarHBondContact O-N 3.33Å; A211-T215 PolarHBondContact O-OG1 2.85Å |
| 212 | L | 87.1 | Confident | 79.4 | Confident | 121 Ų | 121 | 108.7 Ų | 108.7 | 63% | 0.634 | 62% | 0.616 | S | S | * | * | H | α-helix | trans | -64.6 | -43.3 | 175.1 | -70.4 | 172.1 | 0 | 0 | 0 | 111.7 | Q208 Q209 Q210 A214 T215 V216 | Q208-L212 VanDerWaalsContact O-CG 3.31Å; Q208-L212 WeakPolarHBondContact O-CG 3.07Å; Q208-L212 PolarHBondContact O-N 3.35Å; Q209-L212 PolarHBondContact O-N 3.36Å; Q210-L212 PolarHBondContact O-N 3.37Å; L212-A214 PolarHBondContact O-N 3.13Å; L212-T215 PolarHBondContact O-N 2.85Å; L212-V216 WeakPolarHBondContact O-CG2 3.08Å; L212-V216 PolarHBondContact O-N 3.34Å; L212-V216 VanDerWaalsContact O-N 3.12Å |
| 213 | A | 80.5 | Confident | 77.3 | Confident | 61 Ų | 61 | 106.3 Ų | 106.3 | 50% | 0.504 | 62% | 0.624 | S | S | . | * | H | α-helix | trans | -62.5 | -40.7 | 176.3 | 0 | 0 | 0 | 0 | 0 | 112.4 | Q209 Q210 T215 V216 A217 | Q209-A213 WeakPolarHBondContact O-CB 3.38Å; Q209-A213 PolarHBondContact O-N 3.34Å; Q210-A213 PolarHBondContact O-N 2.95Å; A213-T215 VanDerWaalsContact C-N 3.32Å; A213-T215 PolarHBondContact O-N 3.29Å; A213-V216 PolarHBondContact O-N 3.49Å; A213-A217 WeakPolarHBondContact O-CB 3.03Å; A213-A217 PolarHBondContact O-N 2.94Å; A213-A217 VanDerWaalsContact O-N 3.09Å |
| 214 | A | 77.4 | Confident | 75.1 | Confident | 68 Ų | 68 | 106.2 Ų | 106.2 | 56% | 0.562 | 64% | 0.636 | S | S | * | * | H | α-helix | trans | -65.5 | -33.7 | 175.8 | 0 | 0 | 0 | 0 | 0 | 112.7 | Q210 A211 L212 | Q210-A214 WeakPolarHBondContact O-CB 3.05Å; Q210-A214 PolarHBondContact O-N 2.92Å; A211-A214 PolarHBondContact O-N 2.93Å; L212-A214 PolarHBondContact O-N 3.13Å |
| 215 | T | 76.1 | Confident | 72.9 | Confident | 106 Ų | 106 | 106.7 Ų | 106.7 | 65% | 0.65 | 65% | 0.649 | S | S | * | * | H | α-helix | trans | -70.1 | -37.4 | 177.2 | -47.8 | 0 | 0 | 0 | 0 | 111.6 | A211 L212 A213 | A211-T215 PolarHBondContact O-N 3.33Å; A211-T215 PolarHBondContact O-OG1 2.85Å; L212-T215 PolarHBondContact O-N 2.85Å; A213-T215 VanDerWaalsContact C-N 3.32Å; A213-T215 PolarHBondContact O-N 3.29Å |
| 216 | V | 71.7 | Confident | 71 | Confident | 129 Ų | 129 | 103.8 Ų | 103.8 | 78% | 0.782 | 65% | 0.651 | S | S | * | * | H | α-helix | trans | -74.6 | -27.8 | 177.8 | 177 | 0 | 0 | 0 | 0 | 112.2 | L212 A213 S218 | L212-V216 WeakPolarHBondContact O-CG2 3.08Å; L212-V216 PolarHBondContact O-N 3.34Å; L212-V216 VanDerWaalsContact O-N 3.12Å; A213-V216 PolarHBondContact O-N 3.49Å; V216-S218 VanDerWaalsContact C-N 3.33Å; V216-S218 PolarHBondContact O-N 3.48Å |
| 217 | A | 62.3 | Low | 68.7 | Low | 79 Ų | 79 | 108.4 Ų | 108.4 | 65% | 0.653 | 67% | 0.666 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -82.9 | -1.7 | 179.5 | 0 | 0 | 0 | 0 | 0 | 114.5 | A213 P219 | A213-A217 WeakPolarHBondContact O-CB 3.03Å; A213-A217 PolarHBondContact O-N 2.94Å; A213-A217 VanDerWaalsContact O-N 3.09Å; A217-P219 VanDerWaalsContact O-CD 3.23Å; A217-P219 WeakPolarHBondContact O-CD 3.47Å |
| 218 | S | 54.8 | Low | 66.2 | Low | 90 Ų | 90 | 112.1 Ų | 112.1 | 63% | 0.629 | 68% | 0.683 | S | S | * | * | S | Bend | trans | -80.3 | 109.8 | 173.3 | -158.1 | 0 | 0 | 0 | 0 | 109.3 | V216 A220 | V216-S218 VanDerWaalsContact C-N 3.33Å; V216-S218 PolarHBondContact O-N 3.48Å; S218-A220 PolarHBondContact O-N 3.49Å; S218-A220 VanDerWaalsContact O-N 3.15Å |
| 219 | P | 56.3 | Low | 64.3 | Low | 117 Ų | 117 | 112.1 Ų | 112.1 | 76% | 0.76 | 69% | 0.691 | S | S | * | * | trans | -65.7 | 119.3 | -178.7 | 26.4 | -31.8 | 0 | 0 | 0 | 109.2 | A217 A221 | A217-P219 VanDerWaalsContact O-CD 3.23Å; A217-P219 WeakPolarHBondContact O-CD 3.47Å; P219-A221 PolarHBondContact O-N 3.37Å | ||
| 220 | A | 54.5 | Low | 62 | Low | 96 Ų | 96 | 111.5 Ų | 111.5 | 79% | 0.793 | 70% | 0.702 | S | S | * | * | trans | -52.7 | 110.9 | 171 | 0 | 0 | 0 | 0 | 0 | 109.2 | S218 | S218-A220 PolarHBondContact O-N 3.49Å; S218-A220 VanDerWaalsContact O-N 3.15Å | ||
| 221 | A | 57.9 | Low | 60.2 | Low | 88 Ų | 88 | 113.2 Ų | 113.2 | 73% | 0.727 | 71% | 0.713 | S | S | * | * | trans | -59.8 | 126.5 | 164.2 | 0 | 0 | 0 | 0 | 0 | 107.6 | P219 S223 | P219-A221 PolarHBondContact O-N 3.37Å; A221-S223 PolarHBondContact O-N 3.16Å | ||
| 222 | P | 56 | Low | 57.9 | Low | 132 Ų | 132 | 114.6 Ų | 114.6 | 86% | 0.857 | 72% | 0.724 | S | S | * | * | trans | -74.4 | 113.3 | 177.6 | 28.9 | -31.2 | 0 | 0 | 0 | 108.5 | ||||
| 223 | S | 52.6 | Low | 56.1 | Low | 116 Ų | 116 | 117.7 Ų | 117.7 | 81% | 0.811 | 74% | 0.736 | S | S | * | * | trans | -120.7 | 120.5 | 161.8 | 64.7 | 0 | 0 | 0 | 0 | 110.4 | A221 | A221-S223 PolarHBondContact O-N 3.16Š| ||
| 224 | S | 48.3 | Very low | 54.3 | Low | 113 Ų | 113 | 122.9 Ų | 122.9 | 79% | 0.79 | 75% | 0.749 | S | S | * | * | trans | -61.3 | 137.3 | 178.6 | -68.2 | 0 | 0 | 0 | 0 | 113.1 | ||||
| 225 | N | 52 | Low | 52.7 | Low | 146 Ų | 146 | 124.7 Ų | 124.7 | 78% | 0.781 | 76% | 0.756 | S | S | * | * | trans | 54.4 | 123.2 | 139.4 | -75.3 | -12.4 | 0 | 0 | 0 | 122.3 | ||||
| 226 | S | 54.4 | Low | 51.4 | Low | 86 Ų | 86 | 126 Ų | 126 | 60% | 0.601 | 76% | 0.763 | S | S | * | * | trans | 68.4 | 126.7 | 136 | 76.4 | 0 | 0 | 0 | 0 | 116.1 | ||||
| 227 | Y | 45.3 | Very low | 50.1 | Low | 204 Ų | 204 | 125.9 Ų | 125.9 | 80% | 0.8 | 76% | 0.763 | S | S | * | * | cis | -160.2 | 163.2 | 40.3 | -86.5 | -89 | 0 | 0 | 0 | 110.6 | ||||
| 228 | Q | 43.1 | Very low | 49.2 | Very low | 173 Ų | 173 | 132.7 Ų | 132.7 | 81% | 0.808 | 77% | 0.772 | S | S | * | * | trans | 58.3 | 104.9 | 145.6 | -77.5 | -178 | -21.3 | 0 | 0 | 120.8 | ||||
| 229 | V | 52.3 | Low | 48.8 | Very low | 126 Ų | 126 | 133.6 Ų | 133.6 | 76% | 0.764 | 78% | 0.776 | S | S | * | * | 16 | 112.4 | 121.4 | -172.3 | 0 | 0 | 0 | 0 | 116.4 | |||||
| 230 | S | 41.6 | Very low | 48.3 | Very low | 118 Ų | 118 | 139.6 Ų | 139.6 | 83% | 0.825 | 78% | 0.783 | S | S | * | * | trans | -144.3 | 111.8 | 141.7 | -79.3 | 0 | 0 | 0 | 0 | 109.1 | A232 | S230-A232 PolarHBondContact O-N 2.87Å; S230-A232 VanDerWaalsContact O-N 3.15Å | ||
| 231 | I | 51.8 | Low | 48 | Very low | 153 Ų | 153 | 141.7 Ų | 141.7 | 79% | 0.785 | 78% | 0.776 | S | S | * | * | trans | -69.1 | 100.6 | 170.7 | -65.2 | 166 | 0 | 0 | 0 | 106.6 | ||||
| 232 | A | 40.8 | Very low | 47.5 | Very low | 84 Ų | 84 | 145.3 Ų | 145.3 | 69% | 0.694 | 78% | 0.778 | S | S | * | * | trans | -104.9 | 104.2 | 164.1 | 0 | 0 | 0 | 0 | 0 | 107.8 | S230 Q234 | S230-A232 PolarHBondContact O-N 2.87Å; S230-A232 VanDerWaalsContact O-N 3.15Å; A232-Q234 PolarHBondContact O-N 3.15Å | ||
| 233 | Q | 49.3 | Very low | 47.2 | Very low | 187 Ų | 187 | 146.2 Ų | 146.2 | 87% | 0.874 | 77% | 0.765 | S | S | * | * | trans | -58.9 | 100.8 | 163.8 | -72.1 | 174.8 | 2.2 | 0 | 0 | 107.8 | ||||
| 234 | Q | 41.3 | Very low | 47 | Very low | 169 Ų | 169 | 145.6 Ų | 145.6 | 79% | 0.79 | 76% | 0.757 | S | S | * | * | trans | -84.3 | 131.7 | 162.8 | -75.3 | -149.6 | -2.5 | 0 | 0 | 109 | A232 V236 | A232-Q234 PolarHBondContact O-N 3.15Å; Q234-V236 PolarHBondContact O-N 3.03Å | ||
| 235 | P | 44.5 | Very low | 47 | Very low | 107 Ų | 107 | 145.1 Ų | 145.1 | 70% | 0.695 | 75% | 0.745 | S | S | * | * | trans | -65.5 | 128.6 | 176.7 | 26.4 | -31.2 | 0 | 0 | 0 | 109.1 | T237 | P235-T237 PolarHBondContact O-N 3.37Š| ||
| 236 | V | 47.9 | Very low | 47 | Very low | 134 Ų | 134 | 143.7 Ų | 143.7 | 81% | 0.812 | 74% | 0.738 | S | S | * | * | trans | -62.2 | 86.7 | 169.6 | 179 | 0 | 0 | 0 | 0 | 108.2 | Q234 R238 | Q234-V236 PolarHBondContact O-N 3.03Å; V236-R238 VanDerWaalsContact C-N 3.32Å; V236-R238 PolarHBondContact O-N 3.38Å | ||
| 237 | T | 44.3 | Very low | 47 | Very low | 125 Ų | 125 | 143.1 Ų | 143.1 | 77% | 0.767 | 73% | 0.733 | S | S | * | * | trans | -72.3 | 95.5 | 160.1 | 37.4 | 0 | 0 | 0 | 0 | 106.7 | P235 P239 | P235-T237 PolarHBondContact O-N 3.37Å; T237-P239 WeakPolarHBondContact O-CD 3.45Å; T237-P239 VanDerWaalsContact O-N 3.14Å | ||
| 238 | R | 44.3 | Very low | 47.5 | Very low | 222 Ų | 222 | 140 Ų | 140 | 84% | 0.838 | 73% | 0.726 | S | S | * | * | trans | -46.4 | 120.3 | 163.3 | -84.8 | 178.4 | 170 | 162.1 | -2.8 | 107.8 | V236 R240 | V236-R238 VanDerWaalsContact C-N 3.32Å; V236-R238 PolarHBondContact O-N 3.38Å; R238-R240 PolarHBondContact O-N 2.87Å | ||
| 239 | P | 46.7 | Very low | 48 | Very low | 110 Ų | 110 | 137.5 Ų | 137.5 | 71% | 0.714 | 71% | 0.714 | S | S | * | * | trans | -64.2 | 109 | 162.7 | 0.2 | 13.8 | 0 | 0 | 0 | 104.8 | T237 H241 | T237-P239 WeakPolarHBondContact O-CD 3.45Å; T237-P239 VanDerWaalsContact O-N 3.14Å; P239-H241 PolarHBondContact O-N 3.03Å | ||
| 240 | R | 45.4 | Very low | 48.3 | Very low | 242 Ų | 242 | 136.5 Ų | 136.5 | 91% | 0.913 | 70% | 0.701 | S | S | * | * | trans | -63.9 | 96.9 | 168.8 | -154.6 | -173.9 | -168.8 | -164.8 | 3.7 | 104.7 | R238 E242 | R238-R240 PolarHBondContact O-N 2.87Å; R240-E242 PolarHBondContact O-N 2.89Å | ||
| 241 | H | 49.3 | Very low | 49.2 | Very low | 141 Ų | 141 | 137.3 Ų | 137.3 | 65% | 0.653 | 69% | 0.692 | S | S | * | * | trans | -58 | 106.3 | -179 | -112.7 | 7.3 | 0 | 0 | 0 | 108.6 | P239 Y243 | P239-H241 PolarHBondContact O-N 3.03Å; H241-Y243 HydrophobicContact CB-CD2 3.81Å; H241-Y243 AromaticContact CD2-CD2 3.37Å; H241-Y243 WeakPolarHBondContact CD2-CD2 3.47Å; H241-Y243 AromaticContact CD2-CE2 3.21Å; H241-Y243 WeakPolarHBondContact CD2-CE2 3.42Å; H241-Y243 AromaticContact CG-CD2 3.66Å; H241-Y243 AromaticContact CG-CE2 3.92Å; H241-Y243 AromaticContact NE2-CE2 3.55Å; H241-Y243 PolarHBondContact O-N 3.06Å | ||
| 242 | E | 47 | Very low | 49.4 | Very low | 164 Ų | 164 | 136.4 Ų | 136.4 | 77% | 0.766 | 68% | 0.684 | S | S | * | * | trans | -61.1 | 76.2 | 159.9 | -70.1 | 168.3 | 164 | 0 | 0 | 108 | R240 T244 | R240-E242 PolarHBondContact O-N 2.89Å; E242-T244 VanDerWaalsContact C-N 3.33Å | ||
| 243 | Y | 48.8 | Very low | 50.1 | Low | 151 Ų | 151 | 137.9 Ų | 137.9 | 59% | 0.592 | 68% | 0.68 | S | S | * | * | trans | -91.8 | 3.1 | 179.1 | -119.3 | -98 | 0 | 0 | 0 | 112.6 | H241 | H241-Y243 HydrophobicContact CB-CD2 3.81Å; H241-Y243 AromaticContact CD2-CD2 3.37Å; H241-Y243 WeakPolarHBondContact CD2-CD2 3.47Å; H241-Y243 AromaticContact CD2-CE2 3.21Å; H241-Y243 WeakPolarHBondContact CD2-CE2 3.42Å; H241-Y243 AromaticContact CG-CD2 3.66Å; H241-Y243 AromaticContact CG-CE2 3.92Å; H241-Y243 AromaticContact NE2-CE2 3.55Å; H241-Y243 PolarHBondContact O-N 3.06Å | ||
| 244 | T | 49.9 | Very low | 50.4 | Low | 103 Ų | 103 | 133.7 Ų | 133.7 | 63% | 0.632 | 66% | 0.663 | S | S | * | * | S | Bend | trans | -94.2 | -31.2 | -177.6 | 47 | 0 | 0 | 0 | 0 | 113.6 | E242 C247 | E242-T244 VanDerWaalsContact C-N 3.33Å; T244-C247 PolarHBondContact O-N 3.48Å |
| 245 | D | 47.4 | Very low | 51 | Low | 103 Ų | 103 | 128.3 Ų | 128.3 | 55% | 0.551 | 65% | 0.647 | S | S | * | * | H | α-helix | trans | -77.7 | -32.5 | -172.7 | -78.9 | 6.7 | 0 | 0 | 0 | 113.5 | C247 Q248 Q249 | D245-C247 PolarHBondContact O-N 3.43Å; D245-Q248 PolarHBondContact O-N 3.32Å; D245-Q249 PolarHBondContact O-N 2.93Å; D245-Q249 VanDerWaalsContact O-N 3.12Å |
| 246 | N | 52.3 | Low | 51.4 | Low | 115 Ų | 115 | 128 Ų | 128 | 62% | 0.615 | 64% | 0.643 | S | S | * | * | H | α-helix | trans | -68.7 | -22.7 | 176.5 | -110.7 | -40.6 | 0 | 0 | 0 | 113.1 | Q250 | N246-Q250 PolarHBondContact O-N 3.27Å |
| 247 | C | 53 | Low | 51.4 | Low | 75 Ų | 75 | 126.3 Ų | 126.3 | 51% | 0.507 | 63% | 0.633 | S | S | . | * | H | α-helix | trans | -81.3 | -28.9 | 178.7 | -147.4 | 0 | 0 | 0 | 0 | 112.1 | T244 D245 Q251 | T244-C247 PolarHBondContact O-N 3.48Å; D245-C247 PolarHBondContact O-N 3.43Å; C247-Q251 PolarHBondContact O-N 2.86Å |
| 248 | Q | 55.9 | Low | 51.5 | Low | 138 Ų | 138 | 124.8 Ų | 124.8 | 65% | 0.645 | 63% | 0.628 | S | S | * | * | H | α-helix | trans | -75.7 | -43.4 | 172.9 | -80.1 | -177.8 | -6.5 | 0 | 0 | 111.5 | D245 Q250 Q251 E252 | D245-Q248 PolarHBondContact O-N 3.32Å; Q248-Q250 VanDerWaalsContact C-N 3.3Å; Q248-Q250 PolarHBondContact O-N 3.4Å; Q248-Q251 PolarHBondContact O-N 3.27Å; Q248-Q251 VanDerWaalsContact O-N 3.08Å; Q248-E252 PolarHBondContact O-N 2.99Å |
| 249 | Q | 55.5 | Low | 51.6 | Low | 121 Ų | 121 | 122 Ų | 122 | 57% | 0.565 | 62% | 0.624 | S | S | * | * | H | α-helix | trans | -66.4 | -30.9 | 179.7 | -153.1 | 173.4 | 37.4 | 0 | 0 | 112.7 | D245 L253 | D245-Q249 PolarHBondContact O-N 2.93Å; D245-Q249 VanDerWaalsContact O-N 3.12Å; Q249-L253 PolarHBondContact O-N 2.77Å; Q249-L253 VanDerWaalsContact O-N 3.1Å |
| 250 | Q | 57.9 | Low | 51.5 | Low | 105 Ų | 105 | 128 Ų | 128 | 49% | 0.491 | 63% | 0.633 | S | S | . | * | H | α-helix | trans | -71.7 | -32.6 | 171 | -97.8 | -175.2 | 11.9 | 0 | 0 | 113.8 | N246 Q248 L254 | N246-Q250 PolarHBondContact O-N 3.27Å; Q248-Q250 VanDerWaalsContact C-N 3.3Å; Q248-Q250 PolarHBondContact O-N 3.4Å; Q250-L254 WeakPolarHBondContact O-CD1 3.27Å; Q250-L254 WeakPolarHBondContact O-CG 3.35Å; Q250-L254 PolarHBondContact O-N 3.37Å |
| 251 | Q | 60.1 | Low | 51.5 | Low | 134 Ų | 134 | 121.5 Ų | 121.5 | 63% | 0.626 | 62% | 0.624 | S | S | * | * | H | α-helix | trans | -71.2 | -35.7 | 173.9 | -78.4 | -177.9 | 30.3 | 0 | 0 | 111.6 | C247 Q248 L254 A255 | C247-Q251 PolarHBondContact O-N 2.86Å; Q248-Q251 PolarHBondContact O-N 3.27Å; Q248-Q251 VanDerWaalsContact O-N 3.08Å; Q251-L254 PolarHBondContact O-N 2.97Å; Q251-A255 WeakPolarHBondContact O-CB 3.45Å; Q251-A255 PolarHBondContact O-N 3.07Å |
| 252 | E | 56.6 | Low | 51.4 | Low | 134 Ų | 134 | 120.7 Ų | 120.7 | 63% | 0.626 | 63% | 0.63 | S | S | * | * | H | α-helix | trans | -69.1 | -40.3 | 177.5 | -155.6 | 169.5 | -160.2 | 0 | 0 | 111.7 | Q248 L254 A255 V256 | Q248-E252 PolarHBondContact O-N 2.99Å; E252-L254 VanDerWaalsContact C-N 3.33Å; E252-L254 PolarHBondContact O-N 3.04Å; E252-A255 PolarHBondContact O-N 3.24Å; E252-V256 VanDerWaalsContact O-CG2 3.25Å; E252-V256 WeakPolarHBondContact O-CG2 3.41Å; E252-V256 PolarHBondContact O-N 2.87Å |
| 253 | L | 55.2 | Low | 51.3 | Low | 116 Ų | 116 | 122 Ų | 122 | 61% | 0.607 | 64% | 0.635 | S | S | * | * | H | α-helix | trans | -65.2 | -32.6 | 172.5 | -86.7 | 156.9 | 0 | 0 | 0 | 113.3 | Q249 T257 | Q249-L253 PolarHBondContact O-N 2.77Å; Q249-L253 VanDerWaalsContact O-N 3.1Å; L253-T257 WeakPolarHBondContact O-CG2 3.42Å; L253-T257 PolarHBondContact O-N 2.82Å; L253-T257 PolarHBondContact O-OG1 2.81Å |
| 254 | L | 55.3 | Low | 51.1 | Low | 98 Ų | 98 | 124.3 Ų | 124.3 | 51% | 0.513 | 65% | 0.652 | S | S | . | * | H | α-helix | trans | -76.4 | -35.4 | 175.6 | -77.3 | 163.1 | 0 | 0 | 0 | 112.3 | Q250 Q251 E252 T257 S258 | Q250-L254 WeakPolarHBondContact O-CD1 3.27Å; Q250-L254 WeakPolarHBondContact O-CG 3.35Å; Q250-L254 PolarHBondContact O-N 3.37Å; Q251-L254 PolarHBondContact O-N 2.97Å; E252-L254 VanDerWaalsContact C-N 3.33Å; E252-L254 PolarHBondContact O-N 3.04Å; L254-T257 PolarHBondContact O-N 3.4Å; L254-T257 PolarHBondContact O-OG1 3.37Å; L254-S258 PolarHBondContact O-N 2.8Å |
| 255 | A | 53.8 | Low | 50.5 | Low | 56 Ų | 56 | 123.1 Ų | 123.1 | 46% | 0.463 | 66% | 0.66 | S | S | . | * | H | α-helix | trans | -63.9 | -42.4 | 173 | 0 | 0 | 0 | 0 | 0 | 111.7 | Q251 E252 T257 S258 E259 | Q251-A255 WeakPolarHBondContact O-CB 3.45Å; Q251-A255 PolarHBondContact O-N 3.07Å; E252-A255 PolarHBondContact O-N 3.24Å; A255-T257 VanDerWaalsContact C-N 3.27Å; A255-T257 PolarHBondContact O-N 3.43Å; A255-S258 PolarHBondContact O-N 2.95Å; A255-E259 PolarHBondContact O-N 3.25Å |
| 256 | V | 52.7 | Low | 50 | Low | 101 Ų | 101 | 126.1 Ų | 126.1 | 61% | 0.612 | 68% | 0.676 | S | S | * | * | H | α-helix | trans | -66 | -27.2 | 178.1 | 172.8 | 0 | 0 | 0 | 0 | 112.6 | E252 | E252-V256 VanDerWaalsContact O-CG2 3.25Å; E252-V256 WeakPolarHBondContact O-CG2 3.41Å; E252-V256 PolarHBondContact O-N 2.87Å |
| 257 | T | 49 | Very low | 49.3 | Very low | 98 Ų | 98 | 127.7 Ų | 127.7 | 60% | 0.601 | 68% | 0.679 | S | S | * | * | H | α-helix | trans | -83.2 | -15.2 | 173.3 | 57.3 | 0 | 0 | 0 | 0 | 114.3 | L253 L254 A255 | L253-T257 WeakPolarHBondContact O-CG2 3.42Å; L253-T257 PolarHBondContact O-N 2.82Å; L253-T257 PolarHBondContact O-OG1 2.81Å; L254-T257 PolarHBondContact O-N 3.4Å; L254-T257 PolarHBondContact O-OG1 3.37Å; A255-T257 VanDerWaalsContact C-N 3.27Å; A255-T257 PolarHBondContact O-N 3.43Å |
| 258 | S | 44.9 | Very low | 48.8 | Very low | 93 Ų | 93 | 132.3 Ų | 132.3 | 65% | 0.65 | 70% | 0.698 | S | S | * | * | H | α-helix | trans | -83 | -22 | 178.6 | -165.9 | 0 | 0 | 0 | 0 | 113 | L254 A255 | L254-S258 PolarHBondContact O-N 2.8Å; A255-S258 PolarHBondContact O-N 2.95Å |
| 259 | E | 47.1 | Very low | 48.2 | Very low | 164 Ų | 164 | 132.1 Ų | 132.1 | 77% | 0.766 | 70% | 0.697 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -87.5 | -5.4 | -178.5 | -64.9 | -166.9 | 163.5 | 0 | 0 | 114 | A255 | A255-E259 PolarHBondContact O-N 3.25Š|
| 260 | R | 44.8 | Very low | 47.2 | Very low | 236 Ų | 236 | 134.9 Ų | 134.9 | 89% | 0.891 | 71% | 0.712 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -100.2 | 13.3 | -175.7 | -142.9 | 177.7 | -173.2 | -179.9 | 2.2 | 115.2 | ||
| 261 | S | 44.2 | Very low | 46.2 | Very low | 105 Ų | 105 | 137.3 Ų | 137.3 | 73% | 0.734 | 72% | 0.723 | S | S | * | * | S | Bend | trans | -124.2 | 34.5 | -176.8 | -169.1 | 0 | 0 | 0 | 0 | 113.6 | ||
| 262 | T | 48.8 | Very low | 45.2 | Very low | 125 Ų | 125 | 137.5 Ų | 137.5 | 77% | 0.767 | 74% | 0.738 | S | S | * | * | trans | -133.5 | 9.7 | 173.9 | 31.1 | 0 | 0 | 0 | 0 | 115.1 | ||||
| 263 | E | 45.1 | Very low | 44.2 | Very low | 190 Ų | 190 | 139.5 Ų | 139.5 | 89% | 0.888 | 75% | 0.747 | S | S | * | * | trans | -108.2 | 79.9 | 176 | -75 | -171.8 | 155.4 | 0 | 0 | 112.1 | ||||
| 264 | Q | 43.3 | Very low | 43.8 | Very low | 201 Ų | 201 | 137.5 Ų | 137.5 | 94% | 0.939 | 76% | 0.755 | S | S | * | * | trans | -173.9 | 108.6 | 143.8 | -110.4 | 176.4 | 4.4 | 0 | 0 | 109.2 | ||||
| 265 | G | 37.4 | Very low | 42.7 | Very low | 77 Ų | 77 | 142.1 Ų | 142.1 | 79% | 0.794 | 77% | 0.774 | S | S | * | * | S | Bend | trans | 162.2 | 61.6 | 175.1 | 0 | 0 | 0 | 0 | 0 | 115 | ||
| 266 | D | 37.6 | Very low | 42.1 | Very low | 166 Ų | 166 | 144.6 Ų | 144.6 | 89% | 0.888 | 79% | 0.788 | S | S | * | * | trans | 55.8 | 102.3 | 148.9 | -67.6 | -15.4 | 0 | 0 | 0 | 122 | L268 | D266-L268 PolarHBondContact O-N 2.86Š| ||
| 267 | H | 38 | Very low | 41.7 | Very low | 149 Ų | 149 | 150.4 Ų | 150.4 | 69% | 0.69 | 80% | 0.8 | S | S | * | * | trans | -53.2 | 109.6 | 149.7 | -167.3 | -75.2 | 0 | 0 | 0 | 113 | Q269 | H267-Q269 PolarHBondContact CE1-OE1 3.16Š| ||
| 268 | L | 42.2 | Very low | 41.3 | Very low | 172 Ų | 172 | 151.3 Ų | 151.3 | 90% | 0.901 | 81% | 0.811 | S | S | * | * | trans | -127.7 | 101 | 147 | -84.3 | 176.2 | 0 | 0 | 0 | 109.7 | D266 | D266-L268 PolarHBondContact O-N 2.86Š| ||
| 269 | Q | 42.2 | Very low | 41.5 | Very low | 133 Ų | 133 | 155.6 Ų | 155.6 | 62% | 0.621 | 82% | 0.82 | S | S | * | * | trans | -61.4 | 122.1 | 166.5 | -175 | 177.2 | 2 | 0 | 0 | 109.2 | H267 | H267-Q269 PolarHBondContact CE1-OE1 3.16Š| ||
| 270 | M | 35.9 | Very low | 41 | Very low | 180 Ų | 180 | 156.9 Ų | 156.9 | 89% | 0.887 | 83% | 0.826 | S | S | * | * | trans | -131.2 | 111.9 | 162.3 | -96.3 | -75.7 | -71 | 0 | 0 | 107.9 | ||||
| 271 | E | 35.3 | Very low | 40.8 | Very low | 156 Ų | 156 | 150.5 Ų | 150.5 | 73% | 0.729 | 82% | 0.818 | S | S | * | * | trans | -61.7 | 131.2 | -175.8 | -68.1 | 166.5 | 146.4 | 0 | 0 | 111 | E273 | E271-E273 PolarHBondContact O-N 3.07Š| ||
| 272 | C | 39.6 | Very low | 40.8 | Very low | 137 Ų | 137 | 154.7 Ų | 154.7 | 93% | 0.926 | 82% | 0.823 | S | S | * | * | trans | -82.4 | 96.9 | 158.3 | -87.1 | 0 | 0 | 0 | 0 | 108 | ||||
| 273 | E | 36.6 | Very low | 40.1 | Very low | 176 Ų | 176 | 157.3 Ų | 157.3 | 82% | 0.822 | 83% | 0.827 | S | S | * | * | trans | -129 | 120.7 | 154.9 | -72.8 | -164.6 | 162.3 | 0 | 0 | 109.2 | E271 | E271-E273 PolarHBondContact O-N 3.07Š| ||
| 274 | G | 46 | Very low | 39.7 | Very low | 75 Ų | 75 | 153.3 Ų | 153.3 | 77% | 0.773 | 82% | 0.82 | S | S | * | * | trans | -74.2 | 140.2 | 175.5 | 0 | 0 | 0 | 0 | 0 | 111 | ||||
| 275 | Q | 33.2 | Very low | 39.4 | Very low | 194 Ų | 194 | 151.1 Ų | 151.1 | 91% | 0.907 | 82% | 0.815 | S | S | * | * | trans | -149.7 | 135.1 | 155.9 | -104.5 | 167.8 | 38.2 | 0 | 0 | 110.6 | ||||
| 276 | S | 40.7 | Very low | 39.6 | Very low | 108 Ų | 108 | 155 Ų | 155 | 76% | 0.755 | 82% | 0.817 | S | S | * | * | trans | -28.7 | 147.1 | 175.3 | -68.4 | 0 | 0 | 0 | 0 | 120.1 | ||||
| 277 | Y | 44.2 | Very low | 39.9 | Very low | 223 Ų | 223 | 152.7 Ų | 152.7 | 88% | 0.875 | 81% | 0.812 | S | S | * | * | trans | 37.2 | 110.4 | 137 | -79.3 | -95.3 | 0 | 0 | 0 | 118.9 | ||||
| 278 | S | 40.2 | Very low | 40.1 | Very low | 118 Ų | 118 | 154 Ų | 154 | 83% | 0.825 | 82% | 0.824 | S | S | * | * | -154.2 | 130.7 | 124.4 | 58.1 | 0 | 0 | 0 | 0 | 111.1 | |||||
| 279 | E | 50 | Low | 40 | Very low | 182 Ų | 182 | 150.7 Ų | 150.7 | 85% | 0.85 | 82% | 0.821 | S | S | * | * | trans | -64.8 | 124.8 | 166.4 | -63.7 | 169.6 | 134.3 | 0 | 0 | 108.8 | ||||
| 280 | Q | 35.6 | Very low | 39.8 | Very low | 191 Ų | 191 | 153.4 Ų | 153.4 | 89% | 0.893 | 83% | 0.834 | S | S | * | * | trans | -171.2 | 122.5 | 145 | -109.3 | 163.5 | 31.8 | 0 | 0 | 113.6 | ||||
| 281 | S | 41.2 | Very low | 40.1 | Very low | 103 Ų | 103 | 150 Ų | 150 | 72% | 0.72 | 83% | 0.828 | S | S | * | * | trans | 67.4 | 93.6 | 138.8 | -150.5 | 0 | 0 | 0 | 0 | 119 | H283 | S281-H283 PolarHBondContact O-N 3.37Š| ||
| 282 | F | 43 | Very low | 40.6 | Very low | 192 Ų | 192 | 150.6 Ų | 150.6 | 84% | 0.842 | 83% | 0.833 | S | S | * | * | trans | -50 | 120.9 | 152.3 | -79.5 | -96.3 | 0 | 0 | 0 | 111.3 | ||||
| 283 | H | 35.4 | Very low | 40.6 | Very low | 180 Ų | 180 | 152 Ų | 152 | 83% | 0.833 | 83% | 0.831 | S | S | * | * | trans | -145.6 | 102.1 | 145.4 | -91.2 | 7.5 | 0 | 0 | 0 | 108.1 | S281 | S281-H283 PolarHBondContact O-N 3.37Š| ||
| 284 | S | 37.1 | Very low | 41.2 | Very low | 106 Ų | 106 | 151.6 Ų | 151.6 | 74% | 0.741 | 83% | 0.829 | S | S | * | * | trans | -66.2 | 127 | 172.8 | -59.7 | 0 | 0 | 0 | 0 | 110.4 | ||||
| 285 | N | 35.3 | Very low | 41.4 | Very low | 156 Ų | 156 | 155 Ų | 155 | 83% | 0.834 | 83% | 0.829 | S | S | * | * | trans | -113.4 | 83.7 | 163.5 | -91.2 | -26 | 0 | 0 | 0 | 108.3 | ||||
| 286 | D | 42.4 | Very low | 42.2 | Very low | 157 Ų | 157 | 153.3 Ų | 153.3 | 84% | 0.84 | 83% | 0.826 | S | S | * | * | trans | -103.9 | 95.3 | 157.8 | -92.3 | -29.2 | 0 | 0 | 0 | 106.8 | ||||
| 287 | C | 43.6 | Very low | 42.4 | Very low | 118 Ų | 118 | 155 Ų | 155 | 80% | 0.797 | 83% | 0.826 | S | S | * | * | trans | -152.8 | 63.2 | 174.4 | -91.6 | 0 | 0 | 0 | 0 | 110.9 | ||||
| 288 | L | 43.3 | Very low | 42.5 | Very low | 178 Ų | 178 | 147.9 Ų | 147.9 | 93% | 0.932 | 82% | 0.821 | S | S | * | * | trans | -148.3 | 73.5 | 157.6 | -79.2 | -177 | 0 | 0 | 0 | 110.2 | ||||
| 289 | A | 39.3 | Very low | 42.8 | Very low | 101 Ų | 101 | 151 Ų | 151 | 84% | 0.835 | 82% | 0.823 | S | S | * | * | trans | -124 | 113.2 | 153 | 0 | 0 | 0 | 0 | 0 | 107.1 | S291 | A289-S291 PolarHBondContact O-N 2.99Š| ||
| 290 | Q | 38.4 | Very low | 42.8 | Very low | 191 Ų | 191 | 151 Ų | 151 | 89% | 0.893 | 82% | 0.822 | S | S | * | * | trans | -61 | 119.9 | -177.9 | -79.3 | 164.9 | -18.5 | 0 | 0 | 110.6 | M292 | Q290-M292 PolarHBondContact O-N 3.47Š| ||
| 291 | S | 42.3 | Very low | 43.3 | Very low | 109 Ų | 109 | 150.3 Ų | 150.3 | 76% | 0.762 | 82% | 0.819 | S | S | * | * | trans | -63.4 | 113.5 | 156.2 | 164.3 | 0 | 0 | 0 | 0 | 108.9 | A289 | A289-S291 PolarHBondContact O-N 2.99Š| ||
| 292 | M | 45.1 | Very low | 43.7 | Very low | 168 Ų | 168 | 152.3 Ų | 152.3 | 83% | 0.828 | 82% | 0.821 | S | S | * | * | trans | -147.6 | 90.9 | 153.1 | -83.8 | -136.1 | -89.2 | 0 | 0 | 106 | Q290 | Q290-M292 PolarHBondContact O-N 3.47Š| ||
| 293 | D | 40.1 | Very low | 43.9 | Very low | 167 Ų | 167 | 150.8 Ų | 150.8 | 89% | 0.893 | 82% | 0.816 | S | S | * | * | trans | -167.2 | 71.1 | 157.9 | -83.3 | -33 | 0 | 0 | 0 | 106.8 | ||||
| 294 | E | 48.5 | Very low | 44.4 | Very low | 167 Ų | 167 | 152.3 Ų | 152.3 | 78% | 0.78 | 82% | 0.816 | S | S | * | * | trans | -111.7 | 141.9 | 155.6 | -77.6 | -167.9 | 165.7 | 0 | 0 | 108.1 | ||||
| 295 | D | 50.8 | Low | 45 | Very low | 145 Ų | 145 | 152.5 Ų | 152.5 | 78% | 0.775 | 81% | 0.813 | S | S | * | * | trans | 78 | 95.9 | 165.9 | -50.8 | -29.8 | 0 | 0 | 0 | 116.6 | ||||
| 296 | L | 50.1 | Low | 45.5 | Very low | 159 Ų | 159 | 155 Ų | 155 | 83% | 0.832 | 81% | 0.811 | S | S | * | * | -172.4 | 136.8 | 124.3 | -92.2 | 168.5 | 0 | 0 | 0 | 109.8 | |||||
| 297 | D | 44.8 | Very low | 45.6 | Very low | 144 Ų | 144 | 156.2 Ų | 156.2 | 77% | 0.77 | 81% | 0.811 | S | S | * | * | trans | 105 | 37.3 | 158.3 | -46.4 | -23.9 | 0 | 0 | 0 | 119.8 | E299 | D297-E299 PolarHBondContact O-N 2.9Š| ||
| 298 | G | 46.2 | Very low | 45.8 | Very low | 74 Ų | 74 | 162 Ų | 162 | 76% | 0.763 | 82% | 0.816 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -88.1 | 35.8 | 170.1 | 0 | 0 | 0 | 0 | 0 | 116.8 | ||
| 299 | E | 46.8 | Very low | 45.9 | Very low | 184 Ų | 184 | 164.5 Ų | 164.5 | 86% | 0.86 | 81% | 0.813 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -121.8 | -7 | -177.7 | -72 | -89.8 | 153.3 | 0 | 0 | 114.7 | D297 | D297-E299 PolarHBondContact O-N 2.9Š|
| 300 | E | 48.7 | Very low | 46.1 | Very low | 180 Ų | 180 | 167.3 Ų | 167.3 | 84% | 0.841 | 81% | 0.814 | S | S | * | * | S | Bend | trans | -96.6 | -11.7 | -175.9 | -157.3 | 167.4 | -168.5 | 0 | 0 | 114.1 | ||
| 301 | E | 47.3 | Very low | 46.3 | Very low | 177 Ų | 177 | 161.5 Ų | 161.5 | 83% | 0.827 | 81% | 0.805 | S | S | * | * | S | Bend | trans | -88 | -13.1 | -175.2 | -158.3 | 173.2 | 177.1 | 0 | 0 | 114.3 | ||
| 302 | L | 48.8 | Very low | 46.5 | Very low | 145 Ų | 145 | 164.1 Ų | 164.1 | 76% | 0.759 | 81% | 0.811 | S | S | * | * | S | Bend | trans | -89.4 | -9.1 | -177.7 | -91.8 | 160.8 | 0 | 0 | 0 | 114.9 | ||
| 303 | E | 48.4 | Very low | 46.4 | Very low | 160 Ų | 160 | 160.3 Ų | 160.3 | 75% | 0.748 | 81% | 0.806 | S | S | * | * | S | Bend | trans | -91.2 | -21.8 | -179.8 | -162.1 | 161.3 | -158.5 | 0 | 0 | 112.9 | T305 | E303-T305 PolarHBondContact O-N 3.27Š|
| 304 | Y | 45.8 | Very low | 46.6 | Very low | 212 Ų | 212 | 159.7 Ų | 159.7 | 83% | 0.831 | 80% | 0.802 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -78.6 | -18.5 | -177.9 | -150.2 | -100.1 | 0 | 0 | 0 | 114.1 | ||
| 305 | T | 49.5 | Very low | 46.2 | Very low | 110 Ų | 110 | 161.5 Ų | 161.5 | 68% | 0.675 | 81% | 0.811 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -91.2 | -5.6 | -179.8 | 27.1 | 0 | 0 | 0 | 0 | 114.4 | E303 | E303-T305 PolarHBondContact O-N 3.27Š|
| 306 | R | 46.1 | Very low | 45.7 | Very low | 210 Ų | 210 | 162.9 Ų | 162.9 | 79% | 0.792 | 81% | 0.813 | S | S | * | * | S | Bend | trans | -88.9 | -16.5 | -178.7 | -138.2 | 178 | -158.9 | 172.7 | 6.4 | 114.7 | ||
| 307 | H | 44.4 | Very low | 46 | Very low | 182 Ų | 182 | 159.9 Ų | 159.9 | 84% | 0.843 | 80% | 0.803 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -92.8 | 6.7 | -176.6 | -93.3 | -47 | 0 | 0 | 0 | 115.9 | ||
| 308 | R | 46.3 | Very low | 45.5 | Very low | 240 Ų | 240 | 161.4 Ų | 161.4 | 91% | 0.906 | 81% | 0.805 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -108.9 | 11.4 | -177 | -137.4 | -177 | -177.3 | 176.8 | 1.7 | 115.2 | ||
| 309 | R | 46.9 | Very low | 45.1 | Very low | 230 Ų | 230 | 169.8 Ų | 169.8 | 87% | 0.868 | 81% | 0.814 | S | S | * | * | S | Bend | trans | -126.5 | 5.6 | -173.3 | -106.8 | -170.5 | -164.3 | 178.8 | 6.8 | 117.8 | ||
| 310 | D | 42.9 | Very low | 44.6 | Very low | 160 Ų | 160 | 170.4 Ų | 170.4 | 86% | 0.856 | 82% | 0.817 | S | S | * | * | trans | -123.8 | 68.5 | -179 | -63.5 | -30.8 | 0 | 0 | 0 | 111.3 | ||||
| 311 | G | 42.1 | Very low | 43.8 | Very low | 68 Ų | 68 | 167 Ų | 167 | 70% | 0.701 | 81% | 0.813 | S | S | * | * | trans | -160.2 | 47.8 | 180 | 0 | 0 | 0 | 0 | 0 | 113.9 | ||||
| 312 | D | 46 | Very low | 43 | Very low | 165 Ų | 165 | 163.7 Ų | 163.7 | 88% | 0.882 | 81% | 0.808 | S | S | * | * | trans | -152.7 | 139.4 | 161.4 | -91.8 | -33.7 | 0 | 0 | 0 | 108.5 | ||||
| 313 | A | 43.3 | Very low | 42.2 | Very low | 87 Ų | 87 | 163.6 Ų | 163.6 | 72% | 0.719 | 81% | 0.807 | S | S | * | * | trans | 91.2 | 116.8 | -170.3 | 0 | 0 | 0 | 0 | 0 | 112.6 | ||||
| 314 | D | 44.3 | Very low | 41.4 | Very low | 154 Ų | 154 | 161.3 Ų | 161.3 | 82% | 0.824 | 80% | 0.804 | S | S | * | * | cis | -159.7 | 138.5 | 23.4 | -75.2 | -54.5 | 0 | 0 | 0 | 108.8 | ||||
| 315 | E | 39.9 | Very low | 40.7 | Very low | 205 Ų | 205 | 156.7 Ų | 156.7 | 96% | 0.958 | 80% | 0.798 | S | S | * | * | trans | -168.6 | 111.7 | 142.4 | -108.3 | -178.5 | -162.2 | 0 | 0 | 111.2 | ||||
| 316 | E | 42 | Very low | 40.1 | Very low | 175 Ų | 175 | 158.6 Ų | 158.6 | 82% | 0.818 | 80% | 0.803 | S | S | * | * | trans | -130.9 | 167.8 | 164.5 | -124.5 | -108.9 | 136.6 | 0 | 0 | 104.8 | ||||
| 317 | P | 54.6 | Low | 39.4 | Very low | 95 Ų | 95 | 155.2 Ų | 155.2 | 62% | 0.617 | 80% | 0.801 | S | S | * | * | cis | -130.2 | -163.6 | -3.7 | 11.2 | 17.4 | 0 | 0 | 0 | 112.7 | ||||
| 318 | E | 36.3 | Very low | 38.9 | Very low | 176 Ų | 176 | 154.3 Ų | 154.3 | 82% | 0.822 | 80% | 0.795 | S | S | * | * | trans | 103.7 | 89.3 | 157.3 | -63.6 | -168.3 | 155.3 | 0 | 0 | 116.3 | ||||
| 319 | R | 37.1 | Very low | 38.2 | Very low | 251 Ų | 251 | 150.5 Ų | 150.5 | 95% | 0.947 | 79% | 0.787 | S | S | * | * | -149.2 | 101.2 | 121.9 | -70.7 | -154.5 | 173.2 | 169.1 | -1.8 | 111 | |||||
| 320 | Q | 36.4 | Very low | 37.5 | Very low | 196 Ų | 196 | 150.6 Ų | 150.6 | 92% | 0.916 | 79% | 0.788 | S | S | * | * | trans | -64.8 | 144.1 | 153.7 | -71.3 | 171.3 | -6.3 | 0 | 0 | 109.7 | ||||
| 321 | S | 32.2 | Very low | 37.2 | Very low | 108 Ų | 108 | 147.7 Ų | 147.7 | 76% | 0.755 | 78% | 0.78 | S | S | * | * | 141.3 | 135.7 | 130 | -168.5 | 0 | 0 | 0 | 0 | 113.6 | |||||
| 322 | C | 29.6 | Very low | 36.8 | Very low | 108 Ų | 108 | 150 Ų | 150 | 73% | 0.73 | 78% | 0.781 | S | S | * | * | trans | 84.8 | 124.6 | 172.4 | -58.9 | 0 | 0 | 0 | 0 | 116 | ||||
| 323 | L | 31.9 | Very low | 36.2 | Very low | 143 Ų | 143 | 150 Ų | 150 | 75% | 0.749 | 78% | 0.78 | S | S | * | * | cis | -174 | 128.6 | 0.5 | -119 | 152.9 | 0 | 0 | 0 | 106.4 | ||||
| 324 | V | 32.7 | Very low | 35.7 | Very low | 112 Ų | 112 | 150.3 Ų | 150.3 | 68% | 0.679 | 78% | 0.783 | S | S | * | * | trans | 55.4 | 102.2 | 132.2 | 170.8 | 0 | 0 | 0 | 0 | 118.4 | ||||
| 325 | T | 30.9 | Very low | 35 | Very low | 116 Ų | 116 | 147.2 Ų | 147.2 | 71% | 0.712 | 78% | 0.778 | S | S | * | * | 76 | 143.6 | 80 | 59 | 0 | 0 | 0 | 0 | 117.9 | |||||
| 326 | L | 36.1 | Very low | 34.7 | Very low | 149 Ų | 149 | 144.2 Ų | 144.2 | 78% | 0.78 | 77% | 0.774 | S | S | * | * | trans | 89.7 | 125.8 | 165.9 | -58.7 | 172.2 | 0 | 0 | 0 | 115.7 | ||||
| 327 | N | 32.1 | Very low | 34.2 | Very low | 140 Ų | 140 | 141.6 Ų | 141.6 | 75% | 0.749 | 78% | 0.775 | S | S | * | * | cis | -149.5 | 142.4 | 28.3 | -77.6 | -54.9 | 0 | 0 | 0 | 109.4 | ||||
| 328 | K | 33 | Very low | 34.1 | Very low | 162 Ų | 162 | 142.4 Ų | 142.4 | 70% | 0.704 | 78% | 0.78 | S | S | * | * | 82.1 | 97.3 | 57.3 | -163.3 | 163.8 | -172.7 | 170.4 | 0 | 115.2 | |||||
| 329 | E | 33 | Very low | 34.2 | Very low | 160 Ų | 160 | 142.2 Ų | 142.2 | 75% | 0.748 | 78% | 0.784 | S | S | * | * | trans | 51.4 | 124.2 | 134.1 | -61.5 | 172.1 | 171.4 | 0 | 0 | 122.8 | ||||
| 330 | R | 31.5 | Very low | 34 | Very low | 232 Ų | 232 | 137.3 Ų | 137.3 | 88% | 0.875 | 78% | 0.776 | S | S | * | * | 177 | 118.7 | 118.8 | -103 | 179.2 | 164.8 | -177.4 | -4.1 | 109.8 | |||||
| 331 | S | 35.8 | Very low | 33.8 | Very low | 99 Ų | 99 | 134.8 Ų | 134.8 | 69% | 0.692 | 77% | 0.767 | S | S | * | * | 67.3 | 136.8 | 86 | -64.3 | 0 | 0 | 0 | 0 | 113.1 | |||||
| 332 | T | 33.5 | Very low | 34.1 | Very low | 117 Ų | 117 | 140.9 Ų | 140.9 | 72% | 0.718 | 77% | 0.773 | S | S | * | * | cis | 175.4 | 157.8 | 3.3 | 23.2 | 0 | 0 | 0 | 0 | 107.6 | ||||
| 333 | L | 33.5 | Very low | 34.3 | Very low | 165 Ų | 165 | 146.1 Ų | 146.1 | 86% | 0.864 | 78% | 0.777 | S | S | * | * | trans | 84.4 | 121.1 | 146.5 | -70.5 | 157.2 | 0 | 0 | 0 | 122.9 | ||||
| 334 | A | 32.6 | Very low | 34.5 | Very low | 94 Ų | 94 | 146.4 Ų | 146.4 | 78% | 0.777 | 78% | 0.784 | S | S | * | * | 147.9 | 105.7 | 124.7 | 0 | 0 | 0 | 0 | 0 | 109.6 | |||||
| 335 | A | 31 | Very low | 34.8 | Very low | 88 Ų | 88 | 149 Ų | 149 | 73% | 0.727 | 79% | 0.786 | S | S | * | * | 87.9 | 136.7 | 57.4 | 0 | 0 | 0 | 0 | 0 | 115.3 | |||||
| 336 | T | 33.9 | Very low | 35.3 | Very low | 143 Ų | 143 | 148.9 Ų | 148.9 | 88% | 0.877 | 79% | 0.791 | S | S | * | * | trans | 88.3 | 139.6 | 166.8 | 78.8 | 0 | 0 | 0 | 0 | 117.9 | ||||
| 337 | S | 30.8 | Very low | 35.3 | Very low | 119 Ų | 119 | 146.9 Ų | 146.9 | 83% | 0.832 | 79% | 0.789 | S | S | * | * | cis | -176 | 165.4 | -22.2 | -151 | 0 | 0 | 0 | 0 | 107.2 | ||||
| 338 | P | 51.7 | Low | 35.7 | Very low | 112 Ų | 112 | 148.1 Ų | 148.1 | 73% | 0.727 | 79% | 0.794 | S | S | * | * | trans | -114.5 | 175.6 | -152.5 | 43.3 | -36.8 | 0 | 0 | 0 | 117.4 | ||||
| 339 | L | 38.9 | Very low | 35.9 | Very low | 172 Ų | 172 | 147.4 Ų | 147.4 | 90% | 0.901 | 80% | 0.798 | S | S | * | * | trans | -160.3 | 119.4 | 155.4 | -86.4 | 168.8 | 0 | 0 | 0 | 106 | ||||
| 340 | D | 32.4 | Very low | 36.1 | Very low | 148 Ų | 148 | 145.1 Ų | 145.1 | 79% | 0.791 | 80% | 0.8 | S | S | * | * | cis | 89.5 | 130.5 | 44.8 | -151.9 | 20.6 | 0 | 0 | 0 | 116.6 | ||||
| 341 | M | 33.3 | Very low | 36.5 | Very low | 144 Ų | 144 | 143.9 Ų | 143.9 | 71% | 0.709 | 80% | 0.796 | S | S | * | * | trans | 83.8 | 108.4 | 161.6 | -60.7 | -136.4 | -67.9 | 0 | 0 | 123.5 | ||||
| 342 | R | 38.8 | Very low | 36.4 | Very low | 235 Ų | 235 | 150.9 Ų | 150.9 | 89% | 0.887 | 81% | 0.808 | S | S | * | * | 152.5 | 104.9 | 116 | -80.7 | 178.4 | -163.5 | -177.2 | 5.8 | 108.8 | |||||
| 343 | R | 32.7 | Very low | 36.6 | Very low | 219 Ų | 219 | 153 Ų | 153 | 83% | 0.826 | 81% | 0.807 | S | S | * | * | 61.8 | 92.5 | 61.6 | -155.6 | -170.4 | -147.7 | -146.3 | 10.8 | 114.3 | |||||
| 344 | V | 37.2 | Very low | 36.9 | Very low | 148 Ų | 148 | 151.7 Ų | 151.7 | 90% | 0.897 | 81% | 0.806 | S | S | * | * | trans | -144.9 | 133 | 136 | -179.3 | 0 | 0 | 0 | 0 | 109.2 | ||||
| 345 | K | 38.5 | Very low | 37.3 | Very low | 166 Ų | 166 | 154.2 Ų | 154.2 | 72% | 0.722 | 80% | 0.802 | S | S | * | * | trans | -95.6 | 148.6 | -179.4 | -78.1 | 167.2 | 160.6 | -178.4 | 0 | 110.7 | ||||
| 346 | S | 40.3 | Very low | 37.4 | Very low | 114 Ų | 114 | 158.4 Ų | 158.4 | 80% | 0.797 | 81% | 0.811 | S | S | * | * | -178.2 | 107.8 | 128.8 | 51.7 | 0 | 0 | 0 | 0 | 107.3 | |||||
| 347 | S | 36.3 | Very low | 37.4 | Very low | 107 Ų | 107 | 156.8 Ų | 156.8 | 75% | 0.748 | 81% | 0.805 | S | S | * | * | 64.9 | 96.3 | 60.7 | -169.7 | 0 | 0 | 0 | 0 | 113 | |||||
| 348 | I | 41.8 | Very low | 39 | Very low | 166 Ų | 166 | 156.7 Ų | 156.7 | 85% | 0.851 | 80% | 0.802 | S | S | * | * | -168.2 | 123.5 | 116.1 | -107.5 | 160.6 | 0 | 0 | 0 | 111.5 | |||||
| 349 | D | 37.4 | Very low | 38.1 | Very low | 147 Ų | 147 | 159.6 Ų | 159.6 | 79% | 0.786 | 81% | 0.81 | S | S | * | * | trans | -70.5 | 155.4 | 167.8 | -72 | -55.6 | 0 | 0 | 0 | 111.6 | ||||
| 350 | S | 36.9 | Very low | 37.8 | Very low | 112 Ų | 112 | 155.3 Ų | 155.3 | 78% | 0.783 | 80% | 0.8 | S | S | * | * | 169.1 | 125.1 | 101.3 | -171.3 | 0 | 0 | 0 | 0 | 113.1 | |||||
| 351 | Y | 38.1 | Very low | 37.8 | Very low | 206 Ų | 206 | 154.3 Ų | 154.3 | 81% | 0.808 | 80% | 0.804 | S | S | * | * | trans | -46.4 | 150.1 | 159 | -77.7 | -105.9 | 0 | 0 | 0 | 114.4 | ||||
| 352 | R | 35.6 | Very low | 37.7 | Very low | 247 Ų | 247 | 150.4 Ų | 150.4 | 93% | 0.932 | 80% | 0.801 | S | S | * | * | -151.7 | 123.6 | 125.4 | -114.9 | -175.9 | -168.6 | -165.5 | 4 | 112.7 | |||||
| 353 | K | 36.9 | Very low | 37.6 | Very low | 160 Ų | 160 | 145.1 Ų | 145.1 | 70% | 0.696 | 80% | 0.8 | S | S | * | * | trans | -96.8 | 131.7 | 172.4 | 173.5 | 178.4 | -175.5 | 175.1 | 0 | 107.4 | H355 | K353-H355 WeakPolarHBondContact CE-NE2 3.29Š| ||
| 354 | T | 40.2 | Very low | 37.6 | Very low | 139 Ų | 139 | 140.6 Ų | 140.6 | 85% | 0.853 | 79% | 0.792 | S | S | * | * | trans | -146.4 | 118.3 | 157.4 | 40.8 | 0 | 0 | 0 | 0 | 110 | ||||
| 355 | H | 41.4 | Very low | 37.3 | Very low | 147 Ų | 147 | 143.8 Ų | 143.8 | 68% | 0.681 | 79% | 0.788 | S | S | * | * | trans | -70.8 | 154.2 | 160.8 | -71.8 | -102.3 | 0 | 0 | 0 | 110.2 | K353 | K353-H355 WeakPolarHBondContact CE-NE2 3.29Š| ||
| 356 | L | 33.1 | Very low | 37 | Very low | 175 Ų | 175 | 142 Ų | 142 | 92% | 0.916 | 79% | 0.791 | S | S | * | * | 177.8 | 137.1 | 125.9 | -91.6 | 153.7 | 0 | 0 | 0 | 110.3 | |||||
| 357 | S | 32.7 | Very low | 36.7 | Very low | 110 Ų | 110 | 147.4 Ų | 147.4 | 77% | 0.769 | 79% | 0.794 | S | S | * | * | trans | -101.5 | -157 | 177.9 | -54.6 | 0 | 0 | 0 | 0 | 110.3 | ||||
| 358 | P | 65.4 | Low | 36.7 | Very low | 116 Ų | 116 | 148.7 Ų | 148.7 | 75% | 0.753 | 80% | 0.797 | S | S | * | * | -122 | -172 | -102.9 | 37.4 | -17.1 | 0 | 0 | 0 | 112.9 | |||||
| 359 | L | 31.9 | Very low | 36.6 | Very low | 173 Ų | 173 | 147 Ų | 147 | 91% | 0.906 | 79% | 0.794 | S | S | * | * | trans | 147.6 | 151.6 | 159.5 | -82.3 | 152 | 0 | 0 | 0 | 106.7 | ||||
| 360 | A | 33.1 | Very low | 36.2 | Very low | 82 Ų | 82 | 143.7 Ų | 143.7 | 68% | 0.678 | 79% | 0.794 | S | S | * | * | cis | 172.7 | 175.6 | -9.2 | 0 | 0 | 0 | 0 | 0 | 105.5 | ||||
| 361 | S | 31.8 | Very low | 35.9 | Very low | 128 Ų | 128 | 142 Ų | 142 | 90% | 0.895 | 80% | 0.795 | S | S | * | * | trans | 86.4 | 124.8 | 167.6 | -150.1 | 0 | 0 | 0 | 0 | 114.8 | ||||
| 362 | G | 32.5 | Very low | 35.8 | Very low | 61 Ų | 61 | 136.6 Ų | 136.6 | 63% | 0.629 | 79% | 0.793 | S | S | * | * | cis | 131.5 | 151.6 | 18.7 | 0 | 0 | 0 | 0 | 0 | 109.2 | ||||
| 363 | S | 35.4 | Very low | 35.8 | Very low | 125 Ų | 125 | 134.4 Ų | 134.4 | 87% | 0.874 | 79% | 0.793 | S | S | * | * | trans | 94.3 | 113.3 | 175.3 | -30.4 | 0 | 0 | 0 | 0 | 114.9 | ||||
| 364 | N | 32.9 | Very low | 35.7 | Very low | 123 Ų | 123 | 132 Ų | 132 | 66% | 0.658 | 80% | 0.797 | S | S | * | * | cis | 96.2 | 136.8 | 28.8 | -151.1 | 11.3 | 0 | 0 | 0 | 115.1 | ||||
| 365 | W | 30.9 | Very low | 35.5 | Very low | 215 Ų | 215 | 131 Ų | 131 | 81% | 0.814 | 80% | 0.795 | S | S | * | * | trans | 79 | 134.2 | 173.2 | -45.4 | 100.4 | 0 | 0 | 0 | 116.5 | ||||
| 366 | V | 33.3 | Very low | 35.4 | Very low | 128 Ų | 128 | 130.5 Ų | 130.5 | 78% | 0.776 | 80% | 0.802 | S | S | * | * | -158.6 | 141.4 | 51.7 | 166.6 | 0 | 0 | 0 | 0 | 111.9 | V368 | V366-V368 HydrophobicContact CG1-CG2 4.3Š| |||
| 367 | R | 33.5 | Very low | 35.6 | Very low | 228 Ų | 228 | 129.9 Ų | 129.9 | 86% | 0.86 | 80% | 0.798 | S | S | * | * | trans | -84.4 | 131.3 | 171 | 177.9 | -171.2 | -82.8 | 179.7 | -7.3 | 109.7 | ||||
| 368 | V | 36.7 | Very low | 35.5 | Very low | 134 Ų | 134 | 127.8 Ų | 127.8 | 81% | 0.812 | 79% | 0.794 | S | S | * | * | trans | -123.7 | 130.9 | 165.5 | 175.9 | 0 | 0 | 0 | 0 | 110.2 | V366 | V366-V368 HydrophobicContact CG1-CG2 4.3Š| ||
| 369 | V | 38 | Very low | 34.1 | Very low | 132 Ų | 132 | 127.7 Ų | 127.7 | 80% | 0.8 | 80% | 0.796 | S | S | * | * | trans | -98.7 | 143.1 | 179.1 | 168 | 0 | 0 | 0 | 0 | 109.1 | ||||
| 370 | G | 30.7 | Very low | 34.5 | Very low | 76 Ų | 76 | 128.3 Ų | 128.3 | 78% | 0.784 | 79% | 0.794 | S | S | * | * | trans | 168.7 | 131.1 | 162.3 | 0 | 0 | 0 | 0 | 0 | 107.5 | ||||
| 371 | G | 30.4 | Very low | 35.3 | Very low | 77 Ų | 77 | 132.8 Ų | 132.8 | 79% | 0.794 | 80% | 0.801 | S | S | * | * | cis | 143.4 | 130.1 | 22.7 | 0 | 0 | 0 | 0 | 0 | 105.2 | ||||
| 372 | A | 36.1 | Very low | 36.3 | Very low | 93 Ų | 93 | 132.8 Ų | 132.8 | 77% | 0.769 | 80% | 0.798 | S | S | * | * | trans | -53.5 | 159.2 | -165.5 | 0 | 0 | 0 | 0 | 0 | 117.2 | ||||
| 373 | Q | 36 | Very low | 36.5 | Very low | 201 Ų | 201 | 135.6 Ų | 135.6 | 94% | 0.939 | 81% | 0.807 | S | S | * | * | -168.6 | 142.7 | 118.9 | -101.4 | 171.1 | 62.3 | 0 | 0 | 114.3 | |||||
| 374 | S | 34.6 | Very low | 36.5 | Very low | 110 Ų | 110 | 132.9 Ų | 132.9 | 77% | 0.769 | 80% | 0.8 | S | S | * | * | trans | -62.6 | 156.5 | -178.4 | -55.3 | 0 | 0 | 0 | 0 | 115.2 | ||||
| 375 | S | 34.7 | Very low | 36.8 | Very low | 117 Ų | 117 | 133.9 Ų | 133.9 | 82% | 0.818 | 81% | 0.81 | S | S | * | * | trans | -150.3 | 123.2 | 137.7 | 46.1 | 0 | 0 | 0 | 0 | 111.1 | ||||
| 376 | T | 39.5 | Very low | 37.5 | Very low | 136 Ų | 136 | 130 Ų | 130 | 83% | 0.834 | 81% | 0.81 | S | S | * | * | trans | -94.2 | 124.1 | 178.3 | -42.8 | 0 | 0 | 0 | 0 | 107.6 | ||||
| 377 | I | 36.7 | Very low | 38.5 | Very low | 163 Ų | 163 | 129 Ų | 129 | 84% | 0.836 | 81% | 0.807 | S | S | * | * | trans | -131.1 | 121.6 | 166.2 | -63.1 | -179.4 | 0 | 0 | 0 | 108.3 | ||||
| 378 | G | 31.6 | Very low | 39.5 | Very low | 65 Ų | 65 | 123.6 Ų | 123.6 | 67% | 0.67 | 80% | 0.8 | S | S | * | * | P | Polyproline II helix | trans | -70.9 | 137.9 | -172.5 | 0 | 0 | 0 | 0 | 0 | 113.7 | ||
| 379 | S | 35.8 | Very low | 40.3 | Very low | 114 Ų | 114 | 122.9 Ų | 122.9 | 80% | 0.797 | 80% | 0.799 | S | S | * | * | P | Polyproline II helix | trans | -85.2 | 116.9 | 168.3 | 72.3 | 0 | 0 | 0 | 0 | 109.9 | ||
| 380 | H | 40.2 | Very low | 40.8 | Very low | 187 Ų | 187 | 124.9 Ų | 124.9 | 87% | 0.866 | 80% | 0.804 | S | S | * | * | P | Polyproline II helix | trans | -79.5 | 121.2 | 160.6 | -78.3 | -88.4 | 0 | 0 | 0 | 109.2 | ||
| 381 | Q | 49.8 | Very low | 41.2 | Very low | 176 Ų | 176 | 127.9 Ų | 127.9 | 82% | 0.822 | 80% | 0.802 | S | S | * | * | P | Polyproline II helix | trans | -72.2 | 155.8 | 159.7 | -74.2 | -167.6 | -34.1 | 0 | 0 | 110 | ||
| 382 | P | 52.4 | Low | 41.5 | Very low | 128 Ų | 128 | 130.9 Ų | 130.9 | 83% | 0.831 | 80% | 0.8 | S | S | * | * | trans | -127.4 | 147 | 131 | 29.3 | -17 | 0 | 0 | 0 | 114 | ||||
| 383 | S | 37.8 | Very low | 41.5 | Very low | 119 Ų | 119 | 134.2 Ų | 134.2 | 83% | 0.832 | 80% | 0.8 | S | S | * | * | trans | -46 | 145.7 | 179.8 | -55.7 | 0 | 0 | 0 | 0 | 115.8 | ||||
| 384 | G | 35.9 | Very low | 41.7 | Very low | 69 Ų | 69 | 130.8 Ų | 130.8 | 71% | 0.711 | 79% | 0.787 | S | S | * | * | trans | -74.5 | 171.3 | 174.6 | 0 | 0 | 0 | 0 | 0 | 114.3 | ||||
| 385 | T | 38.4 | Very low | 41.7 | Very low | 144 Ų | 144 | 133.1 Ų | 133.1 | 88% | 0.883 | 79% | 0.786 | S | S | * | * | trans | -153.8 | 124.2 | 151.5 | -54.7 | 0 | 0 | 0 | 0 | 107.8 | ||||
| 386 | V | 45 | Very low | 41.9 | Very low | 132 Ų | 132 | 134 Ų | 134 | 80% | 0.8 | 78% | 0.78 | S | S | * | * | P | Polyproline II helix | trans | -85 | 135.7 | 175.7 | 172.8 | 0 | 0 | 0 | 0 | 108.5 | ||
| 387 | P | 54.1 | Low | 41.6 | Very low | 109 Ų | 109 | 133.8 Ų | 133.8 | 71% | 0.708 | 77% | 0.774 | S | S | * | * | P | Polyproline II helix | trans | -92.4 | 148.7 | 163.9 | 32.9 | -27.1 | 0 | 0 | 0 | 111.7 | ||
| 388 | P | 56 | Low | 42.1 | Very low | 113 Ų | 113 | 131.8 Ų | 131.8 | 73% | 0.734 | 78% | 0.775 | S | S | * | * | P | Polyproline II helix | trans | -81.4 | 166.5 | -173.8 | 35.2 | -35.2 | 0 | 0 | 0 | 112.6 | ||
| 389 | P | 52.7 | Low | 42.7 | Very low | 120 Ų | 120 | 136.8 Ų | 136.8 | 78% | 0.779 | 78% | 0.781 | S | S | * | * | P | Polyproline II helix | trans | -84.4 | 140.9 | 178.2 | 34.7 | -30.5 | 0 | 0 | 0 | 110.5 | ||
| 390 | L | 48 | Very low | 43.1 | Very low | 173 Ų | 173 | 136 Ų | 136 | 91% | 0.906 | 78% | 0.775 | S | S | * | * | trans | -127.3 | 128.7 | 163.6 | -82 | 172 | 0 | 0 | 0 | 110 | ||||
| 391 | N | 39.3 | Very low | 43.3 | Very low | 140 Ų | 140 | 133 Ų | 133 | 75% | 0.749 | 77% | 0.765 | S | S | * | * | trans | -79.7 | 158.5 | 173.3 | -82.4 | -9.9 | 0 | 0 | 0 | 111.8 | ||||
| 392 | D | 38.2 | Very low | 43.1 | Very low | 139 Ų | 139 | 128.8 Ų | 128.8 | 74% | 0.743 | 76% | 0.756 | S | S | * | * | trans | 72.8 | 123.3 | 144.4 | -63 | -27.4 | 0 | 0 | 0 | 123.1 | ||||
| 393 | E | 35 | Very low | 42.9 | Very low | 163 Ų | 163 | 126.8 Ų | 126.8 | 76% | 0.762 | 75% | 0.745 | S | S | * | * | trans | 84.6 | 118.5 | 136 | -86.3 | -168.7 | 115.8 | 0 | 0 | 123 | ||||
| 394 | L | 40.6 | Very low | 43.4 | Very low | 130 Ų | 130 | 129.9 Ų | 129.9 | 68% | 0.681 | 74% | 0.738 | S | S | * | * | trans | 92.9 | 123.1 | 133.7 | -73.4 | 165.9 | 0 | 0 | 0 | 121 | ||||
| 395 | Q | 34.8 | Very low | 44.1 | Very low | 158 Ų | 158 | 136.1 Ų | 136.1 | 74% | 0.738 | 74% | 0.74 | S | S | * | * | trans | 90.9 | 117.1 | 139.1 | -77.9 | 179 | 4.9 | 0 | 0 | 120.8 | ||||
| 396 | L | 38.6 | Very low | 44.5 | Very low | 135 Ų | 135 | 135.7 Ų | 135.7 | 71% | 0.707 | 73% | 0.728 | S | S | * | * | trans | 60.1 | 116 | 140.2 | -73.2 | 144.8 | 0 | 0 | 0 | 116.2 | ||||
| 397 | D | 32.8 | Very low | 44.5 | Very low | 132 Ų | 132 | 135.7 Ų | 135.7 | 71% | 0.706 | 72% | 0.719 | S | S | * | * | -162.6 | 143.2 | 81.6 | -87.8 | -37 | 0 | 0 | 0 | 114.7 | Q399 | D397-Q399 PolarHBondContact O-N 3.43Š| |||
| 398 | S | 47.8 | Very low | 44.4 | Very low | 121 Ų | 121 | 134.1 Ų | 134.1 | 85% | 0.846 | 71% | 0.707 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -77.5 | 31 | -179.3 | -65.4 | 0 | 0 | 0 | 0 | 114.7 | ||
| 399 | Q | 43.1 | Very low | 43.9 | Very low | 171 Ų | 171 | 132.2 Ų | 132.2 | 80% | 0.799 | 70% | 0.697 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -102.1 | -3.7 | -177.1 | -73.8 | -169.8 | 6.5 | 0 | 0 | 115.5 | D397 | D397-Q399 PolarHBondContact O-N 3.43Š|
| 400 | S | 46.1 | Very low | 43.7 | Very low | 96 Ų | 96 | 133.6 Ų | 133.6 | 67% | 0.671 | 69% | 0.694 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -86.4 | -6.5 | -176.2 | -85.5 | 0 | 0 | 0 | 0 | 116.7 | ||
| 401 | N | 42.8 | Very low | 43.4 | Very low | 124 Ų | 124 | 132.4 Ų | 132.4 | 66% | 0.663 | 69% | 0.686 | S | S | * | * | H | α-helix | trans | -82.2 | -14.9 | -175.5 | -77.5 | -16.2 | 0 | 0 | 0 | 114.6 | ||
| 402 | S | 45.4 | Very low | 43.7 | Very low | 89 Ų | 89 | 131.5 Ų | 131.5 | 62% | 0.622 | 68% | 0.681 | S | S | * | * | H | α-helix | trans | -79.4 | -31.9 | 176.9 | 165.8 | 0 | 0 | 0 | 0 | 112.9 | R404 | S402-R404 VanDerWaalsContact C-N 3.32Å; S402-R404 PolarHBondContact O-N 3.47Å |
| 403 | S | 48.8 | Very low | 43.8 | Very low | 85 Ų | 85 | 129.6 Ų | 129.6 | 59% | 0.594 | 68% | 0.678 | S | S | * | * | H | α-helix | trans | -71.3 | -26.7 | -179 | -171.7 | 0 | 0 | 0 | 0 | 113.2 | E407 | S403-E407 PolarHBondContact O-N 3.42Å |
| 404 | R | 48.5 | Very low | 44.4 | Very low | 185 Ų | 185 | 131.8 Ų | 131.8 | 70% | 0.698 | 68% | 0.68 | S | S | * | * | H | α-helix | trans | -77.6 | -26.7 | -173.7 | -147.9 | 173.8 | 178.5 | -171.7 | -1.3 | 113.3 | S402 V408 | S402-R404 VanDerWaalsContact C-N 3.32Å; S402-R404 PolarHBondContact O-N 3.47Å; R404-V408 WeakPolarHBondContact O-CG2 3.31Å; R404-V408 PolarHBondContact O-N 3.31Å |
| 405 | W | 50.4 | Low | 44.4 | Very low | 200 Ų | 200 | 134.7 Ų | 134.7 | 76% | 0.758 | 69% | 0.687 | S | S | * | * | H | α-helix | trans | -78.9 | -31.5 | 175.6 | -71.6 | 103.8 | 0 | 0 | 0 | 113 | E407 S409 | W405-E407 VanDerWaalsContact C-N 3.32Å; W405-S409 WeakPolarHBondContact O-CB 3.48Å; W405-S409 PolarHBondContact O-N 3.27Å; W405-S409 VanDerWaalsContact O-N 3.08Å |
| 406 | H | 47.6 | Very low | 44.9 | Very low | 135 Ų | 135 | 131 Ų | 131 | 63% | 0.625 | 69% | 0.691 | S | S | * | * | H | α-helix | trans | -67.9 | -32.8 | 173.3 | -90.2 | -57.3 | 0 | 0 | 0 | 112.6 | S409 M410 | H406-S409 PolarHBondContact O-N 3.37Å; H406-M410 PolarHBondContact O-N 3.41Å |
| 407 | E | 45.3 | Very low | 45.2 | Very low | 132 Ų | 132 | 129.3 Ų | 129.3 | 62% | 0.617 | 70% | 0.697 | S | S | * | * | H | α-helix | trans | -71.6 | -38.9 | 177.7 | -156 | 169.9 | -162.1 | 0 | 0 | 112.3 | S403 W405 M410 | S403-E407 PolarHBondContact O-N 3.42Å; W405-E407 VanDerWaalsContact C-N 3.32Å; E407-M410 PolarHBondContact O-N 3.1Å |
| 408 | V | 50.5 | Low | 45.8 | Very low | 75 Ų | 75 | 127.4 Ų | 127.4 | 46% | 0.455 | 70% | 0.699 | S | S | . | * | H | α-helix | trans | -67.8 | -36.2 | 173.3 | 176.8 | 0 | 0 | 0 | 0 | 111.6 | R404 M410 M411 L412 | R404-V408 WeakPolarHBondContact O-CG2 3.31Å; R404-V408 PolarHBondContact O-N 3.31Å; V408-M410 VanDerWaalsContact C-N 3.33Å; V408-M410 PolarHBondContact O-N 3.07Å; V408-M411 PolarHBondContact O-N 3.2Å; V408-L412 HydrophobicContact CG1-CD1 4.06Å |
| 409 | S | 46.4 | Very low | 45.5 | Very low | 73 Ų | 73 | 127.2 Ų | 127.2 | 51% | 0.51 | 70% | 0.698 | S | S | . | * | H | α-helix | trans | -69.4 | -26.1 | 179.4 | -169.4 | 0 | 0 | 0 | 0 | 113.8 | W405 H406 | W405-S409 WeakPolarHBondContact O-CB 3.48Å; W405-S409 PolarHBondContact O-N 3.27Å; W405-S409 VanDerWaalsContact O-N 3.08Å; H406-S409 PolarHBondContact O-N 3.37Å |
| 410 | M | 48 | Very low | 45.4 | Very low | 149 Ų | 149 | 127 Ų | 127 | 73% | 0.734 | 70% | 0.702 | S | S | * | * | H | α-helix | trans | -80.1 | -21.5 | 175.2 | -68.3 | -149.7 | -59.2 | 0 | 0 | 113.1 | H406 E407 V408 | H406-M410 PolarHBondContact O-N 3.41Å; E407-M410 PolarHBondContact O-N 3.1Å; V408-M410 VanDerWaalsContact C-N 3.33Å; V408-M410 PolarHBondContact O-N 3.07Å |
| 411 | M | 41.8 | Very low | 45.3 | Very low | 149 Ų | 149 | 129.6 Ų | 129.6 | 73% | 0.734 | 71% | 0.707 | S | S | * | * | H | α-helix | trans | -81.1 | -18.2 | 176.3 | -75.7 | -167 | 52.6 | 0 | 0 | 114.2 | V408 | V408-M411 PolarHBondContact O-N 3.2Å |
| 412 | L | 44.5 | Very low | 45.2 | Very low | 121 Ų | 121 | 129.1 Ų | 129.1 | 63% | 0.634 | 71% | 0.711 | S | S | * | * | G | 310 helix | trans | -85.4 | -10.2 | -176.2 | -80.3 | 155.6 | 0 | 0 | 0 | 114.5 | V408 W414 | V408-L412 HydrophobicContact CG1-CD1 4.06Å; L412-W414 PolarHBondContact O-N 3.05Å |
| 413 | S | 41.6 | Very low | 45.1 | Very low | 98 Ų | 98 | 130.2 Ų | 130.2 | 69% | 0.685 | 71% | 0.714 | S | S | * | * | G | 310 helix | trans | -75.7 | 0.5 | -180 | -66 | 0 | 0 | 0 | 0 | 114.6 | ||
| 414 | W | 47.4 | Very low | 44.9 | Very low | 210 Ų | 210 | 133.9 Ų | 133.9 | 80% | 0.795 | 73% | 0.727 | S | S | * | * | G | 310 helix | trans | -105 | 1.2 | -173.6 | -76.5 | 15.5 | 0 | 0 | 0 | 115.3 | L412 | L412-W414 PolarHBondContact O-N 3.05Š|
| 415 | F | 40.5 | Very low | 44.5 | Very low | 191 Ų | 191 | 135 Ų | 135 | 84% | 0.838 | 73% | 0.732 | S | S | * | * | S | Bend | trans | -94.7 | 5.1 | 179.9 | -90.2 | -83 | 0 | 0 | 0 | 115.3 | ||
| 416 | G | 45.6 | Very low | 44 | Very low | 80 Ų | 80 | 130 Ų | 130 | 83% | 0.825 | 73% | 0.734 | S | S | * | * | S | Bend | trans | -91.2 | 3.5 | -172.2 | 0 | 0 | 0 | 0 | 0 | 117.5 | ||
| 417 | A | 44 | Very low | 43.8 | Very low | 99 Ų | 99 | 131.7 Ų | 131.7 | 82% | 0.818 | 75% | 0.748 | S | S | * | * | S | Bend | trans | -137.8 | 63.4 | -169.4 | 0 | 0 | 0 | 0 | 0 | 113.3 | ||
| 418 | A | 45.9 | Very low | 44.1 | Very low | 92 Ų | 92 | 129.5 Ų | 129.5 | 76% | 0.76 | 75% | 0.752 | S | S | * | * | trans | -160.3 | 91.5 | 160 | 0 | 0 | 0 | 0 | 0 | 109.7 | ||||
| 419 | S | 41.4 | Very low | 44.6 | Very low | 118 Ų | 118 | 131.5 Ų | 131.5 | 83% | 0.825 | 77% | 0.767 | S | S | * | * | trans | -146 | 73.5 | 165.4 | -57.5 | 0 | 0 | 0 | 0 | 108.2 | ||||
| 420 | D | 40.5 | Very low | 45.2 | Very low | 166 Ų | 166 | 133.6 Ų | 133.6 | 89% | 0.888 | 78% | 0.779 | S | S | * | * | trans | -149.6 | 86.5 | 161 | -83.6 | -36.2 | 0 | 0 | 0 | 106.7 | ||||
| 421 | I | 44.3 | Very low | 45.4 | Very low | 150 Ų | 150 | 132.2 Ų | 132.2 | 77% | 0.769 | 78% | 0.781 | S | S | * | * | trans | -118.6 | 126.5 | 164.2 | -62.7 | 175.2 | 0 | 0 | 0 | 106.1 | T423 | I421-T423 PolarHBondContact O-N 2.93Š| ||
| 422 | P | 41.7 | Very low | 45.3 | Very low | 115 Ų | 115 | 134.2 Ų | 134.2 | 75% | 0.747 | 79% | 0.788 | S | S | * | * | trans | -70 | 124.3 | 176.5 | 28.9 | -30.8 | 0 | 0 | 0 | 109.1 | D424 | P422-D424 PolarHBondContact O-N 3.49Š| ||
| 423 | T | 43.3 | Very low | 45.6 | Very low | 111 Ų | 111 | 134.8 Ų | 134.8 | 68% | 0.681 | 80% | 0.796 | S | S | * | * | trans | -93.2 | 94.1 | 176.4 | -33.5 | 0 | 0 | 0 | 0 | 108.8 | I421 Y425 | I421-T423 PolarHBondContact O-N 2.93Å; T423-Y425 HydrophobicContact CG2-CD2 3.43Å; T423-Y425 VanDerWaalsContact CG2-CD2 3.43Å; T423-Y425 HydrophobicContact CG2-CE2 3.67Å; T423-Y425 PolarHBondContact O-N 2.96Å | ||
| 424 | D | 44.1 | Very low | 45.7 | Very low | 162 Ų | 162 | 136 Ų | 136 | 87% | 0.866 | 80% | 0.802 | S | S | * | * | trans | -81.5 | 99.4 | 162.9 | -85 | -32.4 | 0 | 0 | 0 | 108.3 | P422 | P422-D424 PolarHBondContact O-N 3.49Š| ||
| 425 | Y | 39.9 | Very low | 45.6 | Very low | 208 Ų | 208 | 131.2 Ų | 131.2 | 82% | 0.816 | 80% | 0.801 | S | S | * | * | trans | -106.3 | 123.5 | 161.7 | -93.6 | -78 | 0 | 0 | 0 | 108.7 | T423 | T423-Y425 HydrophobicContact CG2-CD2 3.43Å; T423-Y425 VanDerWaalsContact CG2-CD2 3.43Å; T423-Y425 HydrophobicContact CG2-CE2 3.67Å; T423-Y425 PolarHBondContact O-N 2.96Å | ||
| 426 | A | 39.7 | Very low | 45.5 | Very low | 97 Ų | 97 | 129.4 Ų | 129.4 | 80% | 0.802 | 79% | 0.794 | S | S | * | * | trans | -68.1 | 129 | 165.5 | 0 | 0 | 0 | 0 | 0 | 109.7 | A428 | A426-A428 PolarHBondContact O-N 3.47Å; A426-A428 VanDerWaalsContact O-N 3.16Å | ||
| 427 | D | 42.4 | Very low | 45 | Very low | 170 Ų | 170 | 136.5 Ų | 136.5 | 91% | 0.909 | 80% | 0.798 | S | S | * | * | trans | -58.4 | 110.4 | 173.4 | -101.2 | -29.2 | 0 | 0 | 0 | 110 | ||||
| 428 | A | 52.9 | Low | 44.7 | Very low | 86 Ų | 86 | 138.2 Ų | 138.2 | 71% | 0.711 | 79% | 0.794 | S | S | * | * | P | Polyproline II helix | trans | -81.7 | 135.2 | 160.9 | 0 | 0 | 0 | 0 | 0 | 109 | A426 | A426-A428 PolarHBondContact O-N 3.47Å; A426-A428 VanDerWaalsContact O-N 3.16Å |
| 429 | P | 60.8 | Low | 44.2 | Very low | 117 Ų | 117 | 139.7 Ų | 139.7 | 76% | 0.76 | 80% | 0.797 | S | S | * | * | P | Polyproline II helix | trans | -69.6 | 149.4 | 178.5 | 28.6 | -33.2 | 0 | 0 | 0 | 111.4 | ||
| 430 | P | 59 | Low | 43.8 | Very low | 117 Ų | 117 | 141.3 Ų | 141.3 | 76% | 0.76 | 80% | 0.796 | S | S | * | * | P | Polyproline II helix | trans | -70.8 | 148.6 | -176.6 | 28.8 | -33.7 | 0 | 0 | 0 | 111.9 | ||
| 431 | P | 51.5 | Low | 43.9 | Very low | 119 Ų | 119 | 139.3 Ų | 139.3 | 77% | 0.773 | 80% | 0.795 | S | S | * | * | P | Polyproline II helix | trans | -70 | 135 | 174.5 | 28.7 | -32.2 | 0 | 0 | 0 | 110.8 | ||
| 432 | E | 41.2 | Very low | 43.5 | Very low | 191 Ų | 191 | 139.6 Ų | 139.6 | 89% | 0.893 | 80% | 0.797 | S | S | * | * | P | Polyproline II helix | trans | -63.2 | 132.1 | 172.8 | -64.4 | -174.9 | 164.3 | 0 | 0 | 110.7 | ||
| 433 | V | 48.9 | Very low | 43.4 | Very low | 133 Ų | 133 | 139.6 Ų | 139.6 | 81% | 0.806 | 80% | 0.799 | S | S | * | * | P | Polyproline II helix | trans | -96.6 | 124.1 | 175.7 | -171 | 0 | 0 | 0 | 0 | 108.4 | S435 | V433-S435 PolarHBondContact O-N 3.35Š|
| 434 | P | 44.5 | Very low | 43.2 | Very low | 123 Ų | 123 | 141.7 Ų | 141.7 | 80% | 0.799 | 81% | 0.807 | S | S | * | * | P | Polyproline II helix | trans | -68.7 | 116.5 | 173.4 | -19.3 | 32.3 | 0 | 0 | 0 | 111.3 | ||
| 435 | S | 44.7 | Very low | 42.9 | Very low | 110 Ų | 110 | 138.8 Ų | 138.8 | 77% | 0.769 | 81% | 0.805 | S | S | * | * | trans | -85 | 103.2 | 167.9 | 157.7 | 0 | 0 | 0 | 0 | 109.3 | V433 | V433-S435 PolarHBondContact O-N 3.35Š| ||
| 436 | H | 39.3 | Very low | 42.9 | Very low | 153 Ų | 153 | 136.3 Ų | 136.3 | 71% | 0.708 | 81% | 0.806 | S | S | * | * | trans | -162.2 | 117.3 | 156.1 | -105.4 | -69.9 | 0 | 0 | 0 | 109.2 | ||||
| 437 | Y | 35.2 | Very low | 42.9 | Very low | 229 Ų | 229 | 139.5 Ų | 139.5 | 90% | 0.898 | 81% | 0.809 | S | S | * | * | trans | -163.9 | 104.3 | 133.4 | -90.8 | -66.3 | 0 | 0 | 0 | 108.2 | ||||
| 438 | D | 37.5 | Very low | 42.9 | Very low | 136 Ų | 136 | 139.5 Ų | 139.5 | 73% | 0.727 | 81% | 0.806 | S | S | * | * | trans | -65.8 | 135.9 | 152.6 | -67.8 | -56.9 | 0 | 0 | 0 | 108.6 | ||||
| 439 | C | 34.5 | Very low | 42.9 | Very low | 122 Ų | 122 | 140.7 Ų | 140.7 | 82% | 0.824 | 81% | 0.807 | S | S | * | * | trans | -148.1 | 85.9 | 159.6 | -93.5 | 0 | 0 | 0 | 0 | 108.5 | ||||
| 440 | D | 33.7 | Very low | 42 | Very low | 153 Ų | 153 | 141.3 Ų | 141.3 | 82% | 0.818 | 81% | 0.808 | S | S | * | * | trans | -66 | 128.4 | 149.1 | -79 | -41 | 0 | 0 | 0 | 108.8 | ||||
| 441 | S | 42.3 | Very low | 41.6 | Very low | 123 Ų | 123 | 140.9 Ų | 140.9 | 86% | 0.86 | 81% | 0.806 | S | S | * | * | trans | -163.3 | 104.4 | 145.6 | -85.1 | 0 | 0 | 0 | 0 | 111 | ||||
| 442 | I | 37.3 | Very low | 40.7 | Very low | 157 Ų | 157 | 141 Ų | 141 | 81% | 0.805 | 80% | 0.804 | S | S | * | * | trans | -66.8 | 130.7 | 163.1 | -68.1 | 158.8 | 0 | 0 | 0 | 108.7 | ||||
| 443 | S | 38.6 | Very low | 40.6 | Very low | 115 Ų | 115 | 137.7 Ų | 137.7 | 80% | 0.804 | 80% | 0.797 | S | S | * | * | trans | -151.8 | 120.8 | 149.9 | 70.4 | 0 | 0 | 0 | 0 | 111.8 | ||||
| 444 | N | 39 | Very low | 39.9 | Very low | 155 Ų | 155 | 138.1 Ų | 138.1 | 83% | 0.829 | 80% | 0.804 | S | S | * | * | trans | -53.5 | 144.8 | 171.2 | -64.3 | -44.6 | 0 | 0 | 0 | 113.5 | ||||
| 445 | A | 37.1 | Very low | 39.4 | Very low | 101 Ų | 101 | 143.6 Ų | 143.6 | 84% | 0.835 | 81% | 0.809 | S | S | * | * | trans | -163 | 105.5 | 142.2 | 0 | 0 | 0 | 0 | 0 | 109.9 | ||||
| 446 | D | 41.4 | Very low | 38.8 | Very low | 156 Ų | 156 | 148.8 Ų | 148.8 | 83% | 0.834 | 81% | 0.812 | S | S | * | * | trans | -68.6 | 135.5 | 153.2 | -78 | -53.7 | 0 | 0 | 0 | 109 | ||||
| 447 | D | 39.9 | Very low | 38.7 | Very low | 164 Ų | 164 | 149 Ų | 149 | 88% | 0.877 | 81% | 0.813 | S | S | * | * | 167.2 | 129.8 | 124.5 | -94.9 | -30.9 | 0 | 0 | 0 | 112.8 | |||||
| 448 | M | 41.1 | Very low | 38.7 | Very low | 169 Ų | 169 | 148.3 Ų | 148.3 | 83% | 0.833 | 81% | 0.809 | S | S | * | * | trans | -62.2 | 174.7 | 168.3 | -81.4 | -79.8 | -164.2 | 0 | 0 | 112.1 | ||||
| 449 | P | 52.8 | Low | 39 | Very low | 112 Ų | 112 | 150.7 Ų | 150.7 | 73% | 0.727 | 82% | 0.818 | S | S | * | * | cis | -142.5 | 179.3 | 21.6 | 36.3 | -12.7 | 0 | 0 | 0 | 117.4 | ||||
| 450 | T | 42.5 | Very low | 39.2 | Very low | 129 Ų | 129 | 152.2 Ų | 152.2 | 79% | 0.791 | 81% | 0.811 | S | S | * | * | trans | -61.4 | 150.4 | 168.4 | 12.1 | 0 | 0 | 0 | 0 | 113.7 | ||||
| 451 | P | 51 | Low | 39.6 | Very low | 109 Ų | 109 | 149.9 Ų | 149.9 | 71% | 0.708 | 81% | 0.812 | S | S | * | * | -142.9 | 136.2 | 117.4 | 28.7 | -9.4 | 0 | 0 | 0 | 113.4 | |||||
| 452 | T | 33 | Very low | 39.4 | Very low | 120 Ų | 120 | 152.2 Ų | 152.2 | 74% | 0.736 | 81% | 0.81 | S | S | * | * | 76.2 | 107.8 | 95.4 | -39.5 | 0 | 0 | 0 | 0 | 115.4 | |||||
| 453 | V | 38 | Very low | 39.4 | Very low | 122 Ų | 122 | 153.7 Ų | 153.7 | 74% | 0.739 | 81% | 0.813 | S | S | * | * | trans | 54.6 | 113.6 | 139.6 | -174.8 | 0 | 0 | 0 | 0 | 118.7 | ||||
| 454 | C | 33.6 | Very low | 40 | Very low | 143 Ų | 143 | 153.2 Ų | 153.2 | 97% | 0.966 | 81% | 0.807 | S | S | * | * | trans | -148.7 | 136.5 | 135 | -103.1 | 0 | 0 | 0 | 0 | 112.8 | ||||
| 455 | R | 34.8 | Very low | 40.5 | Very low | 237 Ų | 237 | 151.9 Ų | 151.9 | 89% | 0.894 | 81% | 0.81 | S | S | * | * | trans | -114.8 | 132 | -170.1 | 171.1 | -168.7 | -174.9 | -174.2 | 3 | 107.3 | ||||
| 456 | R | 32.4 | Very low | 40.7 | Very low | 220 Ų | 220 | 154.8 Ų | 154.8 | 83% | 0.83 | 81% | 0.812 | S | S | * | * | trans | -165.2 | 109.8 | 153.9 | -115.7 | -179 | 174.7 | -176.6 | -0.2 | 110.5 | ||||
| 457 | Q | 36 | Very low | 41 | Very low | 158 Ų | 158 | 152.1 Ų | 152.1 | 74% | 0.738 | 81% | 0.811 | S | S | * | * | 65.8 | 102.9 | 107.9 | -70 | 179.7 | 0.8 | 0 | 0 | 112.4 | |||||
| 458 | R | 35.8 | Very low | 40.9 | Very low | 213 Ų | 213 | 148.7 Ų | 148.7 | 80% | 0.804 | 81% | 0.806 | S | S | * | * | 48.3 | 98.1 | 64.7 | -121.5 | -167.9 | -159.3 | -176.5 | 6.6 | 113.1 | |||||
| 459 | M | 44.3 | Very low | 41.1 | Very low | 186 Ų | 186 | 147.8 Ų | 147.8 | 92% | 0.916 | 81% | 0.81 | S | S | * | * | trans | -132.2 | 123.5 | 154.6 | -78.8 | -82.2 | -78.8 | 0 | 0 | 107.2 | ||||
| 460 | F | 39.4 | Very low | 40.5 | Very low | 155 Ų | 155 | 151.6 Ų | 151.6 | 68% | 0.68 | 82% | 0.818 | S | S | * | * | trans | -76.2 | 151.5 | 170.9 | -83.4 | -100.8 | 0 | 0 | 0 | 110.3 | ||||
| 461 | A | 41.3 | Very low | 40.8 | Very low | 103 Ų | 103 | 150 Ų | 150 | 85% | 0.851 | 82% | 0.819 | S | S | * | * | trans | -160 | 111.7 | 136.2 | 0 | 0 | 0 | 0 | 0 | 109.3 | ||||
| 462 | E | 37.7 | Very low | 40.6 | Very low | 172 Ų | 172 | 153.8 Ų | 153.8 | 80% | 0.804 | 83% | 0.827 | S | S | * | * | trans | -70.7 | 148.2 | 163.2 | -65.5 | 168.7 | 135.8 | 0 | 0 | 110.1 | ||||
| 463 | Q | 37.4 | Very low | 41.9 | Very low | 188 Ų | 188 | 157 Ų | 157 | 88% | 0.879 | 83% | 0.833 | S | S | * | * | -166.9 | 141.8 | 116.7 | -107.9 | -170.2 | 3.6 | 0 | 0 | 112 | |||||
| 464 | P | 52.1 | Low | 42.4 | Very low | 105 Ų | 105 | 159.4 Ų | 159.4 | 68% | 0.682 | 84% | 0.837 | S | S | * | * | trans | -96.6 | 154.1 | 175.4 | 37.5 | -30.1 | 0 | 0 | 0 | 111.6 | ||||
| 465 | S | 48.3 | Very low | 44 | Very low | 128 Ų | 128 | 157.5 Ų | 157.5 | 90% | 0.895 | 82% | 0.822 | S | S | * | * | trans | -126.3 | 106.8 | 162.7 | -67.3 | 0 | 0 | 0 | 0 | 110 | ||||
| 466 | D | 42 | Very low | 44.8 | Very low | 161 Ų | 161 | 159.4 Ų | 159.4 | 86% | 0.861 | 84% | 0.837 | S | S | * | * | trans | -61.7 | 136.5 | 157.7 | -76.2 | -46.3 | 0 | 0 | 0 | 110.4 | ||||
| 467 | A | 47.6 | Very low | 45.4 | Very low | 100 Ų | 100 | 156.4 Ų | 156.4 | 83% | 0.826 | 84% | 0.838 | S | S | * | * | trans | -144.4 | 106 | 150.7 | 0 | 0 | 0 | 0 | 0 | 108.2 | ||||
| 468 | A | 38.1 | Very low | 45.9 | Very low | 93 Ų | 93 | 156.3 Ų | 156.3 | 77% | 0.769 | 84% | 0.843 | S | S | * | * | trans | -63.5 | 146.6 | 173.9 | 0 | 0 | 0 | 0 | 0 | 111.6 | ||||
| 469 | T | 44.3 | Very low | 46.4 | Very low | 150 Ų | 150 | 153.1 Ų | 153.1 | 92% | 0.92 | 85% | 0.845 | S | S | * | * | trans | -141.6 | 106.4 | 144.4 | -12 | 0 | 0 | 0 | 0 | 108.7 | ||||
| 470 | Q | 40.5 | Very low | 46.6 | Very low | 191 Ų | 191 | 151.2 Ų | 151.2 | 89% | 0.893 | 84% | 0.841 | S | S | * | * | trans | -85 | 130 | 171.4 | -148.2 | 176.4 | 9.5 | 0 | 0 | 107 | ||||
| 471 | A | 49.4 | Very low | 47 | Very low | 97 Ų | 97 | 150.9 Ų | 150.9 | 80% | 0.802 | 85% | 0.851 | S | S | * | * | trans | -162.6 | 86.6 | 158.2 | 0 | 0 | 0 | 0 | 0 | 106.3 | ||||
| 472 | Q | 46.9 | Very low | 47.4 | Very low | 188 Ų | 188 | 154.1 Ų | 154.1 | 88% | 0.879 | 85% | 0.851 | S | S | * | * | 77.9 | 99.9 | 89.1 | -159.1 | 174.1 | 13.9 | 0 | 0 | 111.4 | |||||
| 473 | E | 59 | Low | 48.1 | Very low | 187 Ų | 187 | 152.9 Ų | 152.9 | 87% | 0.874 | 86% | 0.855 | S | S | * | * | trans | -62.3 | 141.4 | 157.9 | -64.6 | 175.5 | 144.9 | 0 | 0 | 109.7 | ||||
| 474 | E | 49.5 | Very low | 48.9 | Very low | 173 Ų | 173 | 150.2 Ų | 150.2 | 81% | 0.808 | 85% | 0.853 | S | S | * | * | -154.9 | 151 | 126.1 | -106.3 | -149.8 | 172.7 | 0 | 0 | 111.6 | |||||
| 475 | P | 66.5 | Low | 48.6 | Very low | 102 Ų | 102 | 153.9 Ų | 153.9 | 66% | 0.662 | 87% | 0.867 | S | S | * | * | trans | -101.3 | 149.1 | 178.6 | 37.7 | -28.8 | 0 | 0 | 0 | 112.7 | ||||
| 476 | F | 51.5 | Low | 48.7 | Very low | 277 Ų | 277 | 156.3 Ų | 156.3 | 100% | 1.215 | 86% | 0.864 | S | S | * | * | trans | -153.6 | 0 | 145 | -94.9 | -71.9 | 0 | 0 | 0 | 110.1 |
Retrieved 476 of 476 residues in 465.3 ms
(Link to these results)