| 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 | 48.4 | Very low | 55.3 | Low | 244 Ų | 244 | 117.6 Ų | 117.6 | 100% | 1.202 | 75% | 0.75 | S | S | * | * | 0 | 105.6 | 0 | -73.8 | -177.9 | 84.4 | 0 | 0 | 107.3 | |||||
| 2 | A | 50.1 | Low | 55.8 | Low | 107 Ų | 107 | 117.8 Ų | 117.8 | 88% | 0.884 | 74% | 0.74 | S | S | * | * | trans | -86.3 | 114.8 | 173.4 | 0 | 0 | 0 | 0 | 0 | 107.4 | D4 | A2-D4 PolarHBondContact O-N 3.12Š| ||
| 3 | G | 50.8 | Low | 56 | Low | 71 Ų | 71 | 115 Ų | 115 | 73% | 0.732 | 73% | 0.727 | S | S | * | * | trans | -76.6 | 112.1 | 171.5 | 0 | 0 | 0 | 0 | 0 | 108.7 | V5 | G3-V5 PolarHBondContact O-N 3.36Š| ||
| 4 | D | 51.9 | Low | 56.6 | Low | 155 Ų | 155 | 111.7 Ų | 111.7 | 83% | 0.829 | 70% | 0.698 | S | S | * | * | trans | -65.9 | 98.2 | 170.3 | -168.3 | 82.9 | 0 | 0 | 0 | 108.4 | A2 G6 | A2-D4 PolarHBondContact O-N 3.12Å; D4-G6 PolarHBondContact O-N 3.23Å; D4-G6 VanDerWaalsContact O-N 3.07Å | ||
| 5 | V | 54.6 | Low | 57.1 | Low | 147 Ų | 147 | 107.9 Ų | 107.9 | 89% | 0.891 | 67% | 0.671 | S | S | * | * | trans | -80.7 | 77.2 | 168.1 | -112.8 | 0 | 0 | 0 | 0 | 107 | G3 G7 | G3-V5 PolarHBondContact O-N 3.36Å; V5-G7 PolarHBondContact O-N 2.85Å | ||
| 6 | G | 50 | Low | 57.9 | Low | 55 Ų | 55 | 106 Ų | 106 | 57% | 0.567 | 65% | 0.654 | S | S | * | * | trans | -62.3 | 87.4 | 166.7 | 0 | 0 | 0 | 0 | 0 | 109.3 | D4 R8 | D4-G6 PolarHBondContact O-N 3.23Å; D4-G6 VanDerWaalsContact O-N 3.07Å; G6-R8 PolarHBondContact O-N 3.17Å | ||
| 7 | G | 58 | Low | 58.8 | Low | 75 Ų | 75 | 107.1 Ų | 107.1 | 77% | 0.773 | 65% | 0.654 | S | S | * | * | trans | -64.1 | 85.4 | 171.5 | 0 | 0 | 0 | 0 | 0 | 109.6 | V5 S9 | V5-G7 PolarHBondContact O-N 2.85Å; G7-S9 PolarHBondContact O-N 3.07Å | ||
| 8 | R | 64.2 | Low | 60.3 | Low | 195 Ų | 195 | 107.2 Ų | 107.2 | 74% | 0.736 | 65% | 0.646 | S | S | * | * | trans | -57.3 | 110.4 | 159.9 | -84.7 | 175.9 | 122.4 | -109.8 | 4.3 | 106.1 | G6 C10 E14 | G6-R8 PolarHBondContact O-N 3.17Å; R8-C10 PolarHBondContact O-N 3.06Å; R8-E14 IonicContact NH1-OE1 3.09Å; R8-E14 PolarHBondContact NH1-OE1 3.41Å; R8-E14 VanDerWaalsContact NH1-OE1 3.09Å; R8-E14 IonicContact NH1-OE2 3.83Å | ||
| 9 | S | 61 | Low | 61.7 | Low | 108 Ų | 108 | 102.2 Ų | 102.2 | 76% | 0.755 | 62% | 0.616 | S | S | * | * | trans | -61.7 | 92.7 | 162.6 | 52.6 | 0 | 0 | 0 | 0 | 106.8 | G7 T11 | G7-S9 PolarHBondContact O-N 3.07Å; S9-T11 PolarHBondContact O-N 3.06Å; S9-T11 VanDerWaalsContact O-N 3.11Å | ||
| 10 | C | 57.9 | Low | 63.1 | Low | 57 Ų | 57 | 101.7 Ų | 101.7 | 39% | 0.385 | 61% | 0.607 | S | S | . | * | trans | -58.8 | 114.6 | 173.6 | -163.6 | 0 | 0 | 0 | 0 | 106.4 | R8 L15 | R8-C10 PolarHBondContact O-N 3.06Å; C10-L15 HydrophobicContact CB-CD2 4.1Å; C10-L15 HydrophobicContact CB-CG 4.17Å; C10-L15 WeakPolarHBondContact SG-CD2 3.18Å | ||
| 11 | T | 60.9 | Low | 64.5 | Low | 80 Ų | 80 | 103.3 Ų | 103.3 | 49% | 0.491 | 61% | 0.612 | S | S | . | * | trans | -64.7 | 145.1 | -179.3 | 58.2 | 0 | 0 | 0 | 0 | 108.5 | S9 S13 E14 L15 | S9-T11 PolarHBondContact O-N 3.06Å; S9-T11 VanDerWaalsContact O-N 3.11Å; T11-S13 PolarHBondContact O-N 3.25Å; T11-E14 WeakPolarHBondContact O-CA 3.32Å; T11-E14 WeakPolarHBondContact O-CB 3.34Å; T11-E14 PolarHBondContact O-N 3.44Å; T11-E14 WeakPolarHBondContact OG1-CB 3.25Å; T11-L15 PolarHBondContact O-N 3.09Å | ||
| 12 | D | 61.6 | Low | 66.4 | Low | 119 Ų | 119 | 92.2 Ų | 92.2 | 64% | 0.636 | 56% | 0.557 | S | S | * | * | H | α-helix | trans | -51.4 | -35.2 | -177.9 | -130.6 | 15.4 | 0 | 0 | 0 | 111.4 | E14 L15 L16 | D12-E14 PolarHBondContact O-N 3.24Å; D12-L15 PolarHBondContact O-N 3.4Å; D12-L16 VanDerWaalsContact O-CG 3.23Å; D12-L16 WeakPolarHBondContact O-CG 3.34Å; D12-L16 PolarHBondContact O-N 2.8Å; D12-L16 VanDerWaalsContact O-N 3.13Å |
| 13 | S | 58.3 | Low | 68.4 | Low | 82 Ų | 82 | 90.6 Ų | 90.6 | 57% | 0.573 | 54% | 0.539 | S | S | * | . | H | α-helix | trans | -64.8 | -33.3 | 174.4 | -41.4 | 0 | 0 | 0 | 0 | 114.4 | T11 L17 | T11-S13 PolarHBondContact O-N 3.25Å; S13-L17 WeakPolarHBondContact O-CG 3.04Å; S13-L17 PolarHBondContact O-N 2.78Å |
| 14 | E | 64.3 | Low | 70.4 | Confident | 69 Ų | 69 | 90.2 Ų | 90.2 | 32% | 0.322 | 52% | 0.519 | S | S | . | . | H | α-helix | trans | -75.4 | -31.7 | 178.4 | -161.9 | 174.8 | -170 | 0 | 0 | 111.3 | R8 T11 D12 L17 | R8-E14 IonicContact NH1-OE1 3.09Å; R8-E14 PolarHBondContact NH1-OE1 3.41Å; R8-E14 VanDerWaalsContact NH1-OE1 3.09Å; R8-E14 IonicContact NH1-OE2 3.83Å; T11-E14 WeakPolarHBondContact O-CA 3.32Å; T11-E14 WeakPolarHBondContact O-CB 3.34Å; T11-E14 PolarHBondContact O-N 3.44Å; T11-E14 WeakPolarHBondContact OG1-CB 3.25Å; D12-E14 PolarHBondContact O-N 3.24Å; E14-L17 PolarHBondContact O-N 2.9Å |
| 15 | L | 65.1 | Low | 72.4 | Confident | 55 Ų | 55 | 89.3 Ų | 89.3 | 29% | 0.288 | 51% | 0.509 | S | S | . | . | H | α-helix | trans | -69.9 | -38.5 | 171.1 | -67.1 | 174.7 | 0 | 0 | 0 | 112.3 | C10 T11 D12 L17 H18 L22 | C10-L15 HydrophobicContact CB-CD2 4.1Å; C10-L15 HydrophobicContact CB-CG 4.17Å; C10-L15 WeakPolarHBondContact SG-CD2 3.18Å; T11-L15 PolarHBondContact O-N 3.09Å; D12-L15 PolarHBondContact O-N 3.4Å; L15-L17 PolarHBondContact O-N 3.32Å; L15-H18 CarbonylContact O-C 3.51Å; L15-H18 PolarHBondContact O-N 3.26Å; L15-L22 HydrophobicContact CB-CD2 4.14Å |
| 16 | L | 68.6 | Low | 74.2 | Confident | 77 Ų | 77 | 85.9 Ų | 85.9 | 40% | 0.403 | 48% | 0.482 | S | S | . | . | H | α-helix | trans | -67.3 | -19.5 | 176.9 | -66.5 | 172.7 | 0 | 0 | 0 | 113.6 | D12 H18 Y53 | D12-L16 VanDerWaalsContact O-CG 3.23Å; D12-L16 WeakPolarHBondContact O-CG 3.34Å; D12-L16 PolarHBondContact O-N 2.8Å; D12-L16 VanDerWaalsContact O-N 3.13Å; L16-H18 VanDerWaalsContact C-N 3.33Å; L16-Y53 WeakPolarHBondContact CD2-OH 3.38Å |
| 17 | L | 74.2 | Confident | 76.2 | Confident | 124 Ų | 124 | 83.2 Ų | 83.2 | 65% | 0.649 | 46% | 0.455 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -74.8 | -24.1 | 175.3 | -76.9 | 164.6 | 0 | 0 | 0 | 112.6 | S13 E14 L15 | S13-L17 WeakPolarHBondContact O-CG 3.04Å; S13-L17 PolarHBondContact O-N 2.78Å; E14-L17 PolarHBondContact O-N 2.9Å; L15-L17 PolarHBondContact O-N 3.32Å |
| 18 | H | 85 | Confident | 77.9 | Confident | 110 Ų | 110 | 80.9 Ų | 80.9 | 51% | 0.509 | 43% | 0.425 | S | S | . | . | trans | -133.6 | 77.3 | -175.2 | -63.2 | -54.3 | 0 | 0 | 0 | 111.3 | L15 L16 E20 L21 | L15-H18 CarbonylContact O-C 3.51Å; L15-H18 PolarHBondContact O-N 3.26Å; L16-H18 VanDerWaalsContact C-N 3.33Å; H18-E20 PolarHBondContact O-N 3.11Å; H18-E20 VanDerWaalsContact O-N 3.15Å; H18-L21 HydrophobicContact CB-CD1 3.78Å; H18-L21 HydrophobicContact CB-CG 4.01Å; H18-L21 WeakPolarHBondContact O-CB 3.35Å; H18-L21 PolarHBondContact O-N 2.76Å | ||
| 19 | P | 87.3 | Confident | 79.2 | Confident | 12 Ų | 12 | 76.4 Ų | 76.4 | 8% | 0.078 | 42% | 0.415 | C | S | . | . | G | 310 helix | trans | -66.5 | -20.1 | -174.8 | 29.4 | -36.2 | 0 | 0 | 0 | 113 | L21 L22 T50 Y53 V54 I58 | P19-L21 PolarHBondContact O-N 2.72Å; P19-L22 HydrophobicContact CB-CD1 4.1Å; P19-L22 VanDerWaalsContact O-CB 3.24Å; P19-L22 WeakPolarHBondContact O-CB 3.42Å; P19-L22 WeakPolarHBondContact O-CG 3.43Å; P19-L22 PolarHBondContact O-N 3.42Å; P19-T50 HydrophobicContact CB-CG2 3.73Å; P19-T50 HydrophobicContact CG-CG2 3.85Å; P19-Y53 HydrophobicContact CB-CD1 3.63Å; P19-Y53 HydrophobicContact CB-CE1 3.84Å; P19-Y53 HydrophobicContact CG-CD1 4.47Å; P19-V54 HydrophobicContact CB-CG2 4.44Å; P19-V54 HydrophobicContact CG-CG2 3.53Å; P19-I58 HydrophobicContact CG-CD1 4.4Å |
| 20 | E | 90.4 | Very high | 80.7 | Confident | 91 Ų | 91 | 72.1 Ų | 72.1 | 43% | 0.425 | 38% | 0.384 | S | S | . | . | G | 310 helix | trans | -62.7 | -24.6 | 173.3 | -56.9 | -55.1 | 151.1 | 0 | 0 | 114.1 | H18 L22 K46 T50 | H18-E20 PolarHBondContact O-N 3.11Å; H18-E20 VanDerWaalsContact O-N 3.15Å; E20-L22 VanDerWaalsContact C-N 3.29Å; E20-K46 PolarHBondContact O-NZ 2.96Å; E20-T50 VanDerWaalsContact CD-CG2 3.45Å; E20-T50 HydrophobicContact CG-CG2 4.39Å; E20-T50 WeakPolarHBondContact OE1-CG2 3.45Å |
| 21 | L | 91.3 | Very high | 82.2 | Confident | 137 Ų | 137 | 69.4 Ų | 69.4 | 72% | 0.717 | 37% | 0.366 | S | S | * | . | G | 310 helix | trans | -83 | -11.2 | 177.6 | -59.9 | -179.7 | 0 | 0 | 0 | 112.2 | H18 P19 | H18-L21 HydrophobicContact CB-CD1 3.78Å; H18-L21 HydrophobicContact CB-CG 4.01Å; H18-L21 WeakPolarHBondContact O-CB 3.35Å; H18-L21 PolarHBondContact O-N 2.76Å; P19-L21 PolarHBondContact O-N 2.72Å |
| 22 | L | 89.3 | Confident | 83.7 | Confident | 11 Ų | 11 | 72.6 Ų | 72.6 | 6% | 0.058 | 38% | 0.375 | C | S | . | . | S | Bend | trans | -73.9 | 146.4 | 176.9 | -58.3 | 172.6 | 0 | 0 | 0 | 110.1 | L15 P19 E20 F26 L27 Y53 | L15-L22 HydrophobicContact CB-CD2 4.14Å; P19-L22 HydrophobicContact CB-CD1 4.1Å; P19-L22 VanDerWaalsContact O-CB 3.24Å; P19-L22 WeakPolarHBondContact O-CB 3.42Å; P19-L22 WeakPolarHBondContact O-CG 3.43Å; P19-L22 PolarHBondContact O-N 3.42Å; E20-L22 VanDerWaalsContact C-N 3.29Å; L22-F26 HydrophobicContact CB-CD1 3.87Å; L22-F26 HydrophobicContact CD1-CD1 3.72Å; L22-F26 HydrophobicContact CD1-CE1 3.66Å; L22-F26 HydrophobicContact CD2-CD1 3.65Å; L22-F26 HydrophobicContact CD2-CE1 3.63Å; L22-F26 HydrophobicContact CD2-CG 4.49Å; L22-F26 HydrophobicContact CD2-CZ 4.47Å; L22-F26 HydrophobicContact CG-CD1 3.93Å; L22-F26 HydrophobicContact CG-CE1 4.13Å; L22-L27 HydrophobicContact CB-CD2 3.96Å; L22-L27 HydrophobicContact CB-CG 4.02Å; L22-L27 HydrophobicContact CD1-CD2 3.74Å; L22-L27 HydrophobicContact CG-CD2 4.48Å; L22-Y53 HydrophobicContact CD1-CE1 4.17Å; L22-Y53 HydrophobicContact CD1-CE2 4.38Å |
| 23 | S | 92 | Very high | 85.1 | Confident | 72 Ų | 72 | 74.5 Ų | 74.5 | 50% | 0.503 | 38% | 0.381 | S | S | . | . | trans | -69.1 | 151.9 | 172.7 | 68.3 | 0 | 0 | 0 | 0 | 110 | E25 F26 L27 | S23-E25 PolarHBondContact O-N 3.22Å; S23-F26 WeakPolarHBondContact O-CB 3.42Å; S23-F26 PolarHBondContact O-N 3.43Å; S23-F26 VanDerWaalsContact OG-CB 3.27Å; S23-F26 WeakPolarHBondContact OG-CB 3.49Å; S23-F26 PolarHBondContact OG-N 2.88Å; S23-L27 PolarHBondContact O-N 2.82Å | ||
| 24 | Q | 93.3 | Very high | 86.4 | Confident | 64 Ų | 64 | 76 Ų | 76 | 30% | 0.299 | 38% | 0.377 | S | S | . | . | H | α-helix | trans | -56.2 | -40.9 | 176.8 | -175 | 162.2 | -0.1 | 0 | 0 | 112.1 | F26 L27 L28 R43 V44 L49 | Q24-F26 PolarHBondContact O-N 2.96Å; Q24-L27 PolarHBondContact O-N 3.09Å; Q24-L28 HydrophobicContact CG-CD1 4.37Å; Q24-L28 WeakPolarHBondContact O-CG 3.48Å; Q24-L28 PolarHBondContact O-N 3.25Å; Q24-R43 PolarHBondContact NE2-O 3.11Å; Q24-V44 PolarHBondContact NE2-O 2.83Å; Q24-L49 HydrophobicContact CG-CD1 3.85Å |
| 25 | E | 93.5 | Very high | 87.6 | Confident | 136 Ų | 136 | 80 Ų | 80 | 64% | 0.636 | 40% | 0.4 | S | S | * | . | H | α-helix | trans | -63.1 | -39.6 | 175.3 | -61.3 | -57.8 | 113.9 | 0 | 0 | 112.4 | S23 L28 L29 | S23-E25 PolarHBondContact O-N 3.22Å; E25-L28 PolarHBondContact O-N 2.96Å; E25-L29 VanDerWaalsContact O-CB 3.28Å; E25-L29 WeakPolarHBondContact O-CB 3.24Å; E25-L29 PolarHBondContact O-N 3.16Å |
| 26 | F | 92.4 | Very high | 88.6 | Confident | 74 Ų | 74 | 79 Ų | 79 | 33% | 0.325 | 40% | 0.395 | S | S | . | . | H | α-helix | trans | -68.4 | -40.1 | 178.1 | -179.2 | -90.3 | 0 | 0 | 0 | 111.9 | L22 S23 Q24 L29 T30 | L22-F26 HydrophobicContact CB-CD1 3.87Å; L22-F26 HydrophobicContact CD1-CD1 3.72Å; L22-F26 HydrophobicContact CD1-CE1 3.66Å; L22-F26 HydrophobicContact CD2-CD1 3.65Å; L22-F26 HydrophobicContact CD2-CE1 3.63Å; L22-F26 HydrophobicContact CD2-CG 4.49Å; L22-F26 HydrophobicContact CD2-CZ 4.47Å; L22-F26 HydrophobicContact CG-CD1 3.93Å; L22-F26 HydrophobicContact CG-CE1 4.13Å; S23-F26 WeakPolarHBondContact O-CB 3.42Å; S23-F26 PolarHBondContact O-N 3.43Å; S23-F26 VanDerWaalsContact OG-CB 3.27Å; S23-F26 WeakPolarHBondContact OG-CB 3.49Å; S23-F26 PolarHBondContact OG-N 2.88Å; Q24-F26 PolarHBondContact O-N 2.96Å; F26-L29 PolarHBondContact O-N 2.83Å; F26-T30 WeakPolarHBondContact O-CB 3.34Å; F26-T30 PolarHBondContact O-N 3.15Å; F26-T30 PolarHBondContact O-OG1 3.37Å |
| 27 | L | 92.3 | Very high | 89.4 | Confident | 0 Ų | 0 | 79.5 Ų | 79.5 | 0% | 0 | 41% | 0.41 | C | S | . | . | H | α-helix | trans | -60.3 | -48.4 | 173.8 | -68.1 | 172.4 | 0 | 0 | 0 | 110.5 | L22 S23 Q24 T30 L31 L49 T50 Y53 | L22-L27 HydrophobicContact CB-CD2 3.96Å; L22-L27 HydrophobicContact CB-CG 4.02Å; L22-L27 HydrophobicContact CD1-CD2 3.74Å; L22-L27 HydrophobicContact CG-CD2 4.48Å; S23-L27 PolarHBondContact O-N 2.82Å; Q24-L27 PolarHBondContact O-N 3.09Å; L27-T30 PolarHBondContact O-N 3.06Å; L27-L31 WeakPolarHBondContact O-CB 3.49Å; L27-L31 WeakPolarHBondContact O-CD1 3.4Å; L27-L31 WeakPolarHBondContact O-CG 3.28Å; L27-L31 PolarHBondContact O-N 3.06Å; L27-L49 HydrophobicContact CB-CD2 4.48Å; L27-L49 HydrophobicContact CD1-CB 4.44Å; L27-T50 WeakPolarHBondContact CD1-OG1 3.43Å; L27-Y53 HydrophobicContact CD2-CD1 4.14Å; L27-Y53 HydrophobicContact CD2-CD2 3.56Å; L27-Y53 HydrophobicContact CD2-CE2 4.07Å; L27-Y53 HydrophobicContact CD2-CG 3.59Å |
| 28 | L | 92.9 | Very high | 90 | Very high | 26 Ų | 26 | 75 Ų | 75 | 14% | 0.136 | 39% | 0.388 | C | S | . | . | H | α-helix | trans | -59 | -48.9 | 177 | -77.1 | 166.6 | 0 | 0 | 0 | 112.3 | Q24 E25 T30 L31 E32 V38 R43 L49 | Q24-L28 HydrophobicContact CG-CD1 4.37Å; Q24-L28 WeakPolarHBondContact O-CG 3.48Å; Q24-L28 PolarHBondContact O-N 3.25Å; E25-L28 PolarHBondContact O-N 2.96Å; L28-T30 VanDerWaalsContact C-N 3.31Å; L28-T30 PolarHBondContact O-N 3.19Å; L28-L31 PolarHBondContact O-N 3.31Å; L28-E32 WeakPolarHBondContact O-CB 3.39Å; L28-E32 PolarHBondContact O-N 3.42Å; L28-V38 HydrophobicContact CD2-CG1 4.2Å; L28-R43 HydrophobicContact CD2-CB 4.28Å; L28-R43 HydrophobicContact CD2-CG 3.87Å; L28-L49 HydrophobicContact CD1-CD1 4.45Å; L28-L49 HydrophobicContact CD2-CD1 4.13Å; L28-L49 HydrophobicContact CD2-CD2 3.66Å; L28-L49 HydrophobicContact CD2-CG 4.48Å; L28-L49 HydrophobicContact CG-CD1 4.04Å; L28-L49 HydrophobicContact CG-CD2 3.95Å |
| 29 | L | 92.8 | Very high | 90 | Very high | 100 Ų | 100 | 76.1 Ų | 76.1 | 52% | 0.524 | 39% | 0.393 | S | S | . | . | H | α-helix | trans | -57.1 | -45.6 | 178 | 178.2 | 65.5 | 0 | 0 | 0 | 111.5 | E25 F26 E32 Q33 | E25-L29 VanDerWaalsContact O-CB 3.28Å; E25-L29 WeakPolarHBondContact O-CB 3.24Å; E25-L29 PolarHBondContact O-N 3.16Å; F26-L29 PolarHBondContact O-N 2.83Å; L29-E32 PolarHBondContact O-N 2.99Å; L29-Q33 WeakPolarHBondContact O-CB 3.27Å; L29-Q33 PolarHBondContact O-N 3.19Å |
| 30 | T | 90.7 | Very high | 90 | Very high | 18 Ų | 18 | 80 Ų | 80 | 11% | 0.11 | 42% | 0.417 | C | S | . | . | H | α-helix | trans | -68 | -39.4 | -178.8 | -51.8 | 0 | 0 | 0 | 0 | 111.5 | F26 L27 L28 Q33 K34 Y53 | F26-T30 WeakPolarHBondContact O-CB 3.34Å; F26-T30 PolarHBondContact O-N 3.15Å; F26-T30 PolarHBondContact O-OG1 3.37Å; L27-T30 PolarHBondContact O-N 3.06Å; L28-T30 VanDerWaalsContact C-N 3.31Å; L28-T30 PolarHBondContact O-N 3.19Å; T30-Q33 PolarHBondContact O-N 3.01Å; T30-K34 HydrophobicContact CG2-CG 4.42Å; T30-K34 WeakPolarHBondContact O-CB 3.37Å; T30-K34 WeakPolarHBondContact O-CG 3.4Å; T30-K34 PolarHBondContact O-N 2.96Å; T30-Y53 HydrophobicContact CG2-CD2 4.32Å; T30-Y53 HydrophobicContact CG2-CE2 3.54Å |
| 31 | L | 91 | Very high | 89.4 | Confident | 0 Ų | 0 | 81.6 Ų | 81.6 | 0% | 0 | 43% | 0.428 | C | S | . | . | H | α-helix | trans | -66.9 | -40.4 | 178.5 | -71.4 | 169.7 | 0 | 0 | 0 | 112.1 | L27 L28 K34 N35 I36 V38 L49 L52 Y53 | L27-L31 WeakPolarHBondContact O-CB 3.49Å; L27-L31 WeakPolarHBondContact O-CD1 3.4Å; L27-L31 WeakPolarHBondContact O-CG 3.28Å; L27-L31 PolarHBondContact O-N 3.06Å; L28-L31 PolarHBondContact O-N 3.31Å; L31-K34 CarbonylContact O-C 3.44Å; L31-K34 PolarHBondContact O-N 3.29Å; L31-N35 PolarHBondContact O-N 3.49Å; L31-I36 HydrophobicContact CD2-CB 4.42Å; L31-I36 HydrophobicContact CD2-CD1 3.48Å; L31-I36 VanDerWaalsContact CD2-CD1 3.48Å; L31-I36 PolarHBondContact O-N 2.88Å; L31-V38 HydrophobicContact CB-CG2 3.97Å; L31-V38 HydrophobicContact CD1-CG2 3.94Å; L31-L49 HydrophobicContact CD1-CD2 3.41Å; L31-L49 VanDerWaalsContact CD1-CD2 3.41Å; L31-L52 HydrophobicContact CD1-CD2 3.76Å; L31-L52 HydrophobicContact CD2-CD2 3.3Å; L31-L52 HydrophobicContact CG-CD2 4.09Å; L31-Y53 HydrophobicContact CG-CD2 4.49Å |
| 32 | E | 91.5 | Very high | 88.9 | Confident | 148 Ų | 148 | 76.9 Ų | 76.9 | 69% | 0.692 | 41% | 0.405 | S | S | * | . | H | α-helix | trans | -62.1 | -46 | 172.8 | -176.8 | 176.3 | -165 | 0 | 0 | 111.1 | L28 L29 K34 N35 | L28-E32 WeakPolarHBondContact O-CB 3.39Å; L28-E32 PolarHBondContact O-N 3.42Å; L29-E32 PolarHBondContact O-N 2.99Å; E32-K34 PolarHBondContact O-N 3.47Å; E32-N35 WeakPolarHBondContact O-CA 3.45Å; E32-N35 PolarHBondContact O-N 2.82Å |
| 33 | Q | 91.6 | Very high | 88.7 | Confident | 159 Ų | 159 | 82.5 Ų | 82.5 | 74% | 0.743 | 43% | 0.426 | S | S | * | . | H | α-helix | trans | -60.4 | -30.3 | 175.6 | -175.4 | 180 | -19.4 | 0 | 0 | 112.5 | L29 T30 N35 | L29-Q33 WeakPolarHBondContact O-CB 3.27Å; L29-Q33 PolarHBondContact O-N 3.19Å; T30-Q33 PolarHBondContact O-N 3.01Å; Q33-N35 VanDerWaalsContact C-N 3.26Å |
| 34 | K | 85.8 | Confident | 88.3 | Confident | 113 Ų | 113 | 83.9 Ų | 83.9 | 49% | 0.491 | 43% | 0.431 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -85.4 | 4.9 | 176.2 | -65.8 | -80.2 | 179.6 | 149.3 | 0 | 113.1 | T30 L31 E32 I36 | T30-K34 HydrophobicContact CG2-CG 4.42Å; T30-K34 WeakPolarHBondContact O-CB 3.37Å; T30-K34 WeakPolarHBondContact O-CG 3.4Å; T30-K34 PolarHBondContact O-N 2.96Å; L31-K34 CarbonylContact O-C 3.44Å; L31-K34 PolarHBondContact O-N 3.29Å; E32-K34 PolarHBondContact O-N 3.47Å; K34-I36 VanDerWaalsContact C-N 3.3Å; K34-I36 HydrophobicContact CB-CD1 3.61Å; K34-I36 HydrophobicContact CB-CG1 4.02Å; K34-I36 PolarHBondContact O-N 3.23Å |
| 35 | N | 87.8 | Confident | 88.2 | Confident | 153 Ų | 153 | 85.3 Ų | 85.3 | 82% | 0.818 | 44% | 0.44 | S | S | * | . | T | Hydrogen-bonded Turn | trans | 54.7 | 42 | -177.7 | -166.1 | 26 | 0 | 0 | 0 | 113.2 | L31 E32 Q33 | L31-N35 PolarHBondContact O-N 3.49Å; E32-N35 WeakPolarHBondContact O-CA 3.45Å; E32-N35 PolarHBondContact O-N 2.82Å; Q33-N35 VanDerWaalsContact C-N 3.26Å |
| 36 | I | 87.4 | Confident | 88.2 | Confident | 33 Ų | 33 | 82.7 Ų | 82.7 | 17% | 0.169 | 43% | 0.427 | C | S | . | . | trans | -102.7 | 119.9 | 176.1 | -53.4 | 154.6 | 0 | 0 | 0 | 108 | L31 K34 V38 L52 H56 | L31-I36 HydrophobicContact CD2-CB 4.42Å; L31-I36 HydrophobicContact CD2-CD1 3.48Å; L31-I36 VanDerWaalsContact CD2-CD1 3.48Å; L31-I36 PolarHBondContact O-N 2.88Å; K34-I36 VanDerWaalsContact C-N 3.3Å; K34-I36 HydrophobicContact CB-CD1 3.61Å; K34-I36 HydrophobicContact CB-CG1 4.02Å; K34-I36 PolarHBondContact O-N 3.23Å; I36-V38 PolarHBondContact O-N 2.94Å; I36-L52 HydrophobicContact CB-CD2 4.39Å; I36-L52 HydrophobicContact CG2-CD2 3.52Å; I36-L52 HydrophobicContact CG2-CG 4.46Å; I36-H56 HydrophobicContact CD1-CB 3.31Å; I36-H56 HydrophobicContact CG1-CB 4.21Å | ||
| 37 | A | 85.9 | Confident | 88.2 | Confident | 88 Ų | 88 | 84.7 Ų | 84.7 | 73% | 0.727 | 44% | 0.441 | S | S | * | . | trans | -68.6 | 122.9 | 178.1 | 0 | 0 | 0 | 0 | 0 | 110.3 | ||||
| 38 | V | 85.4 | Confident | 88.2 | Confident | 31 Ų | 31 | 86.5 Ų | 86.5 | 19% | 0.188 | 45% | 0.453 | C | S | . | . | trans | -109.5 | 116.4 | 178 | -172.3 | 0 | 0 | 0 | 0 | 109.2 | L28 L31 I36 V42 R43 L49 | L28-V38 HydrophobicContact CD2-CG1 4.2Å; L31-V38 HydrophobicContact CB-CG2 3.97Å; L31-V38 HydrophobicContact CD1-CG2 3.94Å; I36-V38 PolarHBondContact O-N 2.94Å; V38-V42 HydrophobicContact CG1-CB 4.03Å; V38-V42 HydrophobicContact CG1-CG1 3.9Å; V38-R43 HydrophobicContact CB-CG 4.2Å; V38-R43 HydrophobicContact CG1-CG 3.59Å; V38-L49 HydrophobicContact CG1-CD2 4.05Å | ||
| 39 | E | 86.4 | Confident | 88.2 | Confident | 133 Ų | 133 | 85.2 Ų | 85.2 | 62% | 0.621 | 45% | 0.447 | S | S | * | . | trans | -70.4 | 149.7 | 178.1 | -65.6 | -59.9 | 173 | 0 | 0 | 112.7 | D41 V42 R43 | E39-D41 VanDerWaalsContact C-N 3.26Å; E39-D41 PolarHBondContact O-N 3.43Å; E39-D41 VanDerWaalsContact O-N 3.16Å; E39-V42 HydrophobicContact CB-CG2 4.28Å; E39-V42 WeakPolarHBondContact O-CA 3.26Å; E39-V42 WeakPolarHBondContact O-CB 3.45Å; E39-V42 PolarHBondContact O-N 3.46Å; E39-R43 WeakPolarHBondContact O-CG 3.48Å; E39-R43 PolarHBondContact O-N 3.49Å | ||
| 40 | T | 85.4 | Confident | 88.2 | Confident | 92 Ų | 92 | 80.5 Ų | 80.5 | 56% | 0.564 | 42% | 0.422 | S | S | * | . | H | α-helix | trans | -55.3 | -38.8 | -172.9 | -45.8 | 0 | 0 | 0 | 0 | 113.4 | V42 R43 | T40-V42 VanDerWaalsContact C-N 3.29Å; T40-V42 PolarHBondContact O-N 3.18Å; T40-R43 WeakPolarHBondContact O-CB 3.36Å; T40-R43 PolarHBondContact O-N 3.04Å |
| 41 | D | 78.9 | Confident | 88.2 | Confident | 126 Ų | 126 | 84.8 Ų | 84.8 | 67% | 0.674 | 44% | 0.444 | S | S | * | . | H | α-helix | trans | -69.8 | -27.2 | 178.1 | -59.5 | -29.4 | 0 | 0 | 0 | 112.6 | E39 V44 N45 | E39-D41 VanDerWaalsContact C-N 3.26Å; E39-D41 PolarHBondContact O-N 3.43Å; E39-D41 VanDerWaalsContact O-N 3.16Å; D41-V44 VanDerWaalsContact O-CG2 3.25Å; D41-V44 WeakPolarHBondContact O-CG2 3.41Å; D41-N45 PolarHBondContact O-ND2 3.39Å |
| 42 | V | 81.5 | Confident | 88.2 | Confident | 37 Ų | 37 | 86.5 Ų | 86.5 | 22% | 0.224 | 45% | 0.453 | C | S | . | . | H | α-helix | trans | -79.2 | -34.8 | 174.9 | -179.5 | 0 | 0 | 0 | 0 | 109.7 | V38 E39 T40 V44 N45 S48 L49 L52 | V38-V42 HydrophobicContact CG1-CB 4.03Å; V38-V42 HydrophobicContact CG1-CG1 3.9Å; E39-V42 HydrophobicContact CB-CG2 4.28Å; E39-V42 WeakPolarHBondContact O-CA 3.26Å; E39-V42 WeakPolarHBondContact O-CB 3.45Å; E39-V42 PolarHBondContact O-N 3.46Å; T40-V42 VanDerWaalsContact C-N 3.29Å; T40-V42 PolarHBondContact O-N 3.18Å; V42-V44 PolarHBondContact O-N 3.08Å; V42-N45 PolarHBondContact O-N 3.4Å; V42-N45 VanDerWaalsContact O-N 3.12Å; V42-S48 WeakPolarHBondContact CG1-OG 3.45Å; V42-S48 PolarHBondContact O-OG 3.38Å; V42-L49 HydrophobicContact CG1-CG 4.39Å; V42-L49 WeakPolarHBondContact O-CG 3.38Å; V42-L52 HydrophobicContact CG1-CD1 4.35Å |
| 43 | R | 83.3 | Confident | 88.2 | Confident | 130 Ų | 130 | 79.6 Ų | 79.6 | 49% | 0.491 | 42% | 0.421 | S | S | . | . | H | α-helix | trans | -59.2 | -31.9 | 179.5 | -65.9 | 178.7 | 65.7 | -153.9 | 0.4 | 113.5 | Q24 L28 V38 E39 T40 L49 | Q24-R43 PolarHBondContact NE2-O 3.11Å; L28-R43 HydrophobicContact CD2-CB 4.28Å; L28-R43 HydrophobicContact CD2-CG 3.87Å; V38-R43 HydrophobicContact CB-CG 4.2Å; V38-R43 HydrophobicContact CG1-CG 3.59Å; E39-R43 WeakPolarHBondContact O-CG 3.48Å; E39-R43 PolarHBondContact O-N 3.49Å; T40-R43 WeakPolarHBondContact O-CB 3.36Å; T40-R43 PolarHBondContact O-N 3.04Å; R43-L49 WeakPolarHBondContact O-CD1 3.18Å |
| 44 | V | 84.6 | Confident | 88.1 | Confident | 101 Ų | 101 | 75.1 Ų | 75.1 | 61% | 0.612 | 40% | 0.404 | S | S | * | . | H | α-helix | trans | -84.7 | -24.7 | 178.3 | -74.4 | 0 | 0 | 0 | 0 | 113.2 | Q24 D41 V42 | Q24-V44 PolarHBondContact NE2-O 2.83Å; D41-V44 VanDerWaalsContact O-CG2 3.25Å; D41-V44 WeakPolarHBondContact O-CG2 3.41Å; V42-V44 PolarHBondContact O-N 3.08Å |
| 45 | N | 91.8 | Very high | 88.2 | Confident | 94 Ų | 94 | 76.1 Ų | 76.1 | 50% | 0.503 | 41% | 0.411 | S | S | . | . | trans | -96.8 | 102.1 | -174.7 | -72.4 | -38.9 | 0 | 0 | 0 | 110.9 | D41 V42 D47 S48 L49 | D41-N45 PolarHBondContact O-ND2 3.39Å; V42-N45 PolarHBondContact O-N 3.4Å; V42-N45 VanDerWaalsContact O-N 3.12Å; N45-D47 PolarHBondContact O-N 2.76Å; N45-S48 WeakPolarHBondContact CB-OG 3.48Å; N45-S48 PolarHBondContact O-N 2.81Å; N45-S48 PolarHBondContact O-OG 3.22Å; N45-L49 PolarHBondContact O-N 3.32Å; N45-L49 VanDerWaalsContact O-N 3.11Å | ||
| 46 | K | 93.1 | Very high | 88 | Confident | 81 Ų | 81 | 73.4 Ų | 73.4 | 35% | 0.352 | 39% | 0.393 | S | S | . | . | H | α-helix | trans | -54.5 | -45.9 | -176.1 | -172.3 | -175.2 | 173.4 | -164.3 | 0 | 113.3 | E20 S48 L49 T50 | E20-K46 PolarHBondContact O-NZ 2.96Å; K46-S48 PolarHBondContact O-N 2.96Å; K46-L49 WeakPolarHBondContact O-CB 3.16Å; K46-L49 PolarHBondContact O-N 3.48Å; K46-T50 PolarHBondContact O-N 3.48Å; K46-T50 PolarHBondContact O-OG1 3.29Å |
| 47 | D | 91.9 | Very high | 87.8 | Confident | 116 Ų | 116 | 72.3 Ų | 72.3 | 62% | 0.62 | 39% | 0.389 | S | S | * | . | H | α-helix | trans | -62.8 | -43.8 | -177.2 | -57.2 | -17.7 | 0 | 0 | 0 | 111 | N45 L49 T50 D51 | N45-D47 PolarHBondContact O-N 2.76Å; D47-L49 VanDerWaalsContact C-N 3.33Å; D47-L49 PolarHBondContact O-N 3.47Å; D47-T50 PolarHBondContact O-N 3.01Å; D47-T50 VanDerWaalsContact O-N 3.09Å; D47-D51 PolarHBondContact O-N 3.29Å |
| 48 | S | 92.9 | Very high | 87.5 | Confident | 37 Ų | 37 | 70.9 Ų | 70.9 | 26% | 0.259 | 37% | 0.368 | S | S | . | . | H | α-helix | trans | -66.5 | -33.6 | 178.4 | 68.5 | 0 | 0 | 0 | 0 | 113.5 | V42 N45 K46 T50 L52 | V42-S48 WeakPolarHBondContact CG1-OG 3.45Å; V42-S48 PolarHBondContact O-OG 3.38Å; N45-S48 WeakPolarHBondContact CB-OG 3.48Å; N45-S48 PolarHBondContact O-N 2.81Å; N45-S48 PolarHBondContact O-OG 3.22Å; K46-S48 PolarHBondContact O-N 2.96Å; S48-T50 VanDerWaalsContact C-N 3.32Å; S48-L52 WeakPolarHBondContact O-CB 2.92Å; S48-L52 PolarHBondContact O-N 2.75Å |
| 49 | L | 92.3 | Very high | 86.8 | Confident | 0 Ų | 0 | 74.9 Ų | 74.9 | 0% | 0 | 40% | 0.395 | C | S | . | . | H | α-helix | trans | -64.2 | -40.5 | 171.2 | -101.7 | 163 | 0 | 0 | 0 | 111.2 | Q24 L27 L28 L31 V38 V42 R43 N45 K46 D47 L52 Y53 | Q24-L49 HydrophobicContact CG-CD1 3.85Å; L27-L49 HydrophobicContact CB-CD2 4.48Å; L27-L49 HydrophobicContact CD1-CB 4.44Å; L28-L49 HydrophobicContact CD1-CD1 4.45Å; L28-L49 HydrophobicContact CD2-CD1 4.13Å; L28-L49 HydrophobicContact CD2-CD2 3.66Å; L28-L49 HydrophobicContact CD2-CG 4.48Å; L28-L49 HydrophobicContact CG-CD1 4.04Å; L28-L49 HydrophobicContact CG-CD2 3.95Å; L31-L49 HydrophobicContact CD1-CD2 3.41Å; L31-L49 VanDerWaalsContact CD1-CD2 3.41Å; V38-L49 HydrophobicContact CG1-CD2 4.05Å; V42-L49 HydrophobicContact CG1-CG 4.39Å; V42-L49 WeakPolarHBondContact O-CG 3.38Å; R43-L49 WeakPolarHBondContact O-CD1 3.18Å; N45-L49 PolarHBondContact O-N 3.32Å; N45-L49 VanDerWaalsContact O-N 3.11Å; K46-L49 WeakPolarHBondContact O-CB 3.16Å; K46-L49 PolarHBondContact O-N 3.48Å; D47-L49 VanDerWaalsContact C-N 3.33Å; D47-L49 PolarHBondContact O-N 3.47Å; L49-L52 PolarHBondContact O-N 3.34Å; L49-Y53 WeakPolarHBondContact O-CB 3.4Å; L49-Y53 PolarHBondContact O-N 3.49Å |
| 50 | T | 92.4 | Very high | 86.1 | Confident | 0 Ų | 0 | 75 Ų | 75 | 0% | 0 | 40% | 0.399 | C | S | . | . | H | α-helix | trans | -71.6 | -40.5 | -178.5 | -48 | 0 | 0 | 0 | 0 | 111.3 | P19 E20 L27 K46 D47 S48 L52 Y53 V54 | P19-T50 HydrophobicContact CB-CG2 3.73Å; P19-T50 HydrophobicContact CG-CG2 3.85Å; E20-T50 VanDerWaalsContact CD-CG2 3.45Å; E20-T50 HydrophobicContact CG-CG2 4.39Å; E20-T50 WeakPolarHBondContact OE1-CG2 3.45Å; L27-T50 WeakPolarHBondContact CD1-OG1 3.43Å; K46-T50 PolarHBondContact O-N 3.48Å; K46-T50 PolarHBondContact O-OG1 3.29Å; D47-T50 PolarHBondContact O-N 3.01Å; D47-T50 VanDerWaalsContact O-N 3.09Å; S48-T50 VanDerWaalsContact C-N 3.32Å; T50-L52 VanDerWaalsContact C-N 3.33Å; T50-L52 PolarHBondContact O-N 2.97Å; T50-Y53 WeakPolarHBondContact O-CB 3.5Å; T50-Y53 PolarHBondContact O-N 2.94Å; T50-V54 WeakPolarHBondContact O-CG2 3.42Å; T50-V54 PolarHBondContact O-N 2.98Å |
| 51 | D | 91.2 | Very high | 85 | Confident | 109 Ų | 109 | 76.7 Ų | 76.7 | 58% | 0.583 | 41% | 0.412 | S | S | * | . | H | α-helix | trans | -58.2 | -45.9 | 172.4 | -78.3 | -24.8 | 0 | 0 | 0 | 111.8 | D47 Y53 V54 Q55 | D47-D51 PolarHBondContact O-N 3.29Å; D51-Y53 VanDerWaalsContact C-N 3.32Å; D51-Y53 PolarHBondContact O-N 3.16Å; D51-V54 PolarHBondContact O-N 3.29Å; D51-Q55 WeakPolarHBondContact O-CB 3.47Å; D51-Q55 PolarHBondContact O-N 3.48Å |
| 52 | L | 91.9 | Very high | 84.8 | Confident | 35 Ų | 35 | 76.3 Ų | 76.3 | 18% | 0.183 | 41% | 0.406 | C | S | . | . | H | α-helix | trans | -66 | -37.5 | 179.4 | -166.3 | 155.4 | 0 | 0 | 0 | 111 | L31 I36 V42 S48 L49 T50 Q55 H56 | L31-L52 HydrophobicContact CD1-CD2 3.76Å; L31-L52 HydrophobicContact CD2-CD2 3.3Å; L31-L52 HydrophobicContact CG-CD2 4.09Å; I36-L52 HydrophobicContact CB-CD2 4.39Å; I36-L52 HydrophobicContact CG2-CD2 3.52Å; I36-L52 HydrophobicContact CG2-CG 4.46Å; V42-L52 HydrophobicContact CG1-CD1 4.35Å; S48-L52 WeakPolarHBondContact O-CB 2.92Å; S48-L52 PolarHBondContact O-N 2.75Å; L49-L52 PolarHBondContact O-N 3.34Å; T50-L52 VanDerWaalsContact C-N 3.33Å; T50-L52 PolarHBondContact O-N 2.97Å; L52-Q55 PolarHBondContact O-N 3.34Å; L52-H56 PolarHBondContact O-CD2 3.25Å; L52-H56 PolarHBondContact O-N 3.24Å; L52-H56 VanDerWaalsContact O-N 3.16Å |
| 53 | Y | 90.8 | Very high | 84.8 | Confident | 4 Ų | 4 | 83 Ų | 83 | 2% | 0.016 | 43% | 0.427 | C | S | . | . | H | α-helix | trans | -62.4 | -49.6 | 170.5 | -177.2 | -83.6 | 0 | 0 | 0 | 112.5 | L16 P19 L22 L27 T30 L31 L49 T50 D51 Q55 H56 A57 I58 | L16-Y53 WeakPolarHBondContact CD2-OH 3.38Å; P19-Y53 HydrophobicContact CB-CD1 3.63Å; P19-Y53 HydrophobicContact CB-CE1 3.84Å; P19-Y53 HydrophobicContact CG-CD1 4.47Å; L22-Y53 HydrophobicContact CD1-CE1 4.17Å; L22-Y53 HydrophobicContact CD1-CE2 4.38Å; L27-Y53 HydrophobicContact CD2-CD1 4.14Å; L27-Y53 HydrophobicContact CD2-CD2 3.56Å; L27-Y53 HydrophobicContact CD2-CE2 4.07Å; L27-Y53 HydrophobicContact CD2-CG 3.59Å; T30-Y53 HydrophobicContact CG2-CD2 4.32Å; T30-Y53 HydrophobicContact CG2-CE2 3.54Å; L31-Y53 HydrophobicContact CG-CD2 4.49Å; L49-Y53 WeakPolarHBondContact O-CB 3.4Å; L49-Y53 PolarHBondContact O-N 3.49Å; T50-Y53 WeakPolarHBondContact O-CB 3.5Å; T50-Y53 PolarHBondContact O-N 2.94Å; D51-Y53 VanDerWaalsContact C-N 3.32Å; D51-Y53 PolarHBondContact O-N 3.16Å; Y53-Q55 PolarHBondContact O-N 3Å; Y53-H56 PolarHBondContact O-N 3.17Å; Y53-A57 HydrophobicContact CD1-CB 3.98Å; Y53-A57 HydrophobicContact CD2-CB 3.66Å; Y53-A57 HydrophobicContact CE1-CB 3.89Å; Y53-A57 HydrophobicContact CE2-CB 3.61Å; Y53-A57 HydrophobicContact CG-CB 3.85Å; Y53-A57 WeakPolarHBondContact O-CA 3.23Å; Y53-A57 WeakPolarHBondContact O-CB 3.13Å; Y53-A57 PolarHBondContact O-N 3.42Å; Y53-I58 HydrophobicContact CD1-CG1 4.39Å; Y53-I58 HydrophobicContact CE1-CD1 4.43Å; Y53-I58 HydrophobicContact CE1-CG1 4.11Å |
| 54 | V | 89.4 | Confident | 84.9 | Confident | 65 Ų | 65 | 83.9 Ų | 83.9 | 39% | 0.394 | 44% | 0.441 | S | S | . | . | H | α-helix | trans | -57.4 | -41.5 | 178.1 | 168.9 | 0 | 0 | 0 | 0 | 110.9 | P19 T50 D51 I58 | P19-V54 HydrophobicContact CB-CG2 4.44Å; P19-V54 HydrophobicContact CG-CG2 3.53Å; T50-V54 WeakPolarHBondContact O-CG2 3.42Å; T50-V54 PolarHBondContact O-N 2.98Å; D51-V54 PolarHBondContact O-N 3.29Å; V54-I58 HydrophobicContact CB-CD1 4.36Å; V54-I58 HydrophobicContact CG1-CD1 4.42Å; V54-I58 HydrophobicContact CG2-CD1 4.09Å |
| 55 | Q | 87.1 | Confident | 85 | Confident | 134 Ų | 134 | 80.2 Ų | 80.2 | 63% | 0.626 | 42% | 0.418 | S | S | * | . | H | α-helix | trans | -67.5 | -38.6 | -177.4 | -174.4 | 175.7 | -52.8 | 0 | 0 | 113.2 | D51 L52 Y53 | D51-Q55 WeakPolarHBondContact O-CB 3.47Å; D51-Q55 PolarHBondContact O-N 3.48Å; L52-Q55 PolarHBondContact O-N 3.34Å; Y53-Q55 PolarHBondContact O-N 3Å |
| 56 | H | 83.7 | Confident | 85 | Confident | 96 Ų | 96 | 78.5 Ų | 78.5 | 44% | 0.444 | 41% | 0.412 | S | S | . | . | H | α-helix | trans | -116.1 | -27.6 | -167.9 | -67.3 | -75.8 | 0 | 0 | 0 | 114.9 | I36 L52 Y53 | I36-H56 HydrophobicContact CD1-CB 3.31Å; I36-H56 HydrophobicContact CG1-CB 4.21Å; L52-H56 PolarHBondContact O-CD2 3.25Å; L52-H56 PolarHBondContact O-N 3.24Å; L52-H56 VanDerWaalsContact O-N 3.16Å; Y53-H56 PolarHBondContact O-N 3.17Å |
| 57 | A | 83.4 | Confident | 84.9 | Confident | 10 Ų | 10 | 84.5 Ų | 84.5 | 8% | 0.083 | 44% | 0.438 | C | S | . | . | H | α-helix | trans | -90 | -28.1 | -178.6 | 0 | 0 | 0 | 0 | 0 | 112.6 | Y53 P59 | Y53-A57 HydrophobicContact CD1-CB 3.98Å; Y53-A57 HydrophobicContact CD2-CB 3.66Å; Y53-A57 HydrophobicContact CE1-CB 3.89Å; Y53-A57 HydrophobicContact CE2-CB 3.61Å; Y53-A57 HydrophobicContact CG-CB 3.85Å; Y53-A57 WeakPolarHBondContact O-CA 3.23Å; Y53-A57 WeakPolarHBondContact O-CB 3.13Å; Y53-A57 PolarHBondContact O-N 3.42Å; A57-P59 WeakPolarHBondContact O-CD 3.43Å |
| 58 | I | 79.3 | Confident | 85.1 | Confident | 58 Ų | 58 | 82.7 Ų | 82.7 | 30% | 0.297 | 43% | 0.428 | S | S | . | . | S | Bend | trans | -94.1 | 111.2 | 179 | -52.5 | -179.5 | 0 | 0 | 0 | 109 | P19 Y53 V54 L60 | P19-I58 HydrophobicContact CG-CD1 4.4Å; Y53-I58 HydrophobicContact CD1-CG1 4.39Å; Y53-I58 HydrophobicContact CE1-CD1 4.43Å; Y53-I58 HydrophobicContact CE1-CG1 4.11Å; V54-I58 HydrophobicContact CB-CD1 4.36Å; V54-I58 HydrophobicContact CG1-CD1 4.42Å; V54-I58 HydrophobicContact CG2-CD1 4.09Å; I58-L60 PolarHBondContact O-N 3.48Å; I58-L60 VanDerWaalsContact O-N 3.11Å |
| 59 | P | 71.1 | Confident | 85.1 | Confident | 114 Ų | 114 | 91.5 Ų | 91.5 | 74% | 0.74 | 46% | 0.456 | S | S | * | . | trans | -63 | 119.9 | 176.4 | 24.5 | -30.7 | 0 | 0 | 0 | 109.3 | A57 | A57-P59 WeakPolarHBondContact O-CD 3.43Š| ||
| 60 | L | 71.9 | Confident | 85.1 | Confident | 136 Ų | 136 | 98 Ų | 98 | 71% | 0.712 | 48% | 0.481 | S | S | * | . | trans | -52.6 | 136.4 | 170.7 | -80.4 | 152.2 | 0 | 0 | 0 | 108.4 | I58 Q62 | I58-L60 PolarHBondContact O-N 3.48Å; I58-L60 VanDerWaalsContact O-N 3.11Å; L60-Q62 VanDerWaalsContact C-N 3.29Å; L60-Q62 PolarHBondContact O-N 3.5Å | ||
| 61 | P | 63.4 | Low | 85.2 | Confident | 128 Ų | 128 | 98 Ų | 98 | 83% | 0.831 | 48% | 0.481 | S | S | * | . | trans | -61.2 | 94.3 | 176.4 | 22.5 | -31.3 | 0 | 0 | 0 | 109.7 | R63 | P61-R63 PolarHBondContact O-N 2.86Å; P61-R63 VanDerWaalsContact O-N 3.17Å | ||
| 62 | Q | 73.3 | Confident | 85.3 | Confident | 117 Ų | 117 | 99.4 Ų | 99.4 | 55% | 0.547 | 48% | 0.482 | S | S | . | . | trans | -87 | 86 | 179 | -79.5 | -171.1 | -0.3 | 0 | 0 | 107.7 | L60 D64 R78 | L60-Q62 VanDerWaalsContact C-N 3.29Å; L60-Q62 PolarHBondContact O-N 3.5Å; Q62-D64 PolarHBondContact O-N 3.37Å; Q62-R78 VanDerWaalsContact CB-NH1 3.32Å | ||
| 63 | R | 81.6 | Confident | 85.3 | Confident | 179 Ų | 179 | 103.1 Ų | 103.1 | 68% | 0.675 | 50% | 0.499 | S | S | * | . | P | Polyproline II helix | trans | -65.2 | 132.4 | 172.8 | -164.1 | 170.4 | 72.3 | 101.4 | -2.7 | 109.5 | P61 L65 R78 | P61-R63 PolarHBondContact O-N 2.86Å; P61-R63 VanDerWaalsContact O-N 3.17Å; R63-L65 PolarHBondContact O-N 3.48Å; R63-R78 PolarHBondContact O-NH2 3.36Å |
| 64 | D | 85.7 | Confident | 85.1 | Confident | 147 Ų | 147 | 105.6 Ų | 105.6 | 79% | 0.786 | 51% | 0.512 | S | S | * | . | P | Polyproline II helix | trans | -58.4 | 127.4 | 169.8 | -71.1 | -31.8 | 0 | 0 | 0 | 109.2 | Q62 | Q62-D64 PolarHBondContact O-N 3.37Š|
| 65 | L | 86.9 | Confident | 85.1 | Confident | 25 Ų | 25 | 106.1 Ų | 106.1 | 13% | 0.131 | 51% | 0.51 | C | S | . | . | P | Polyproline II helix | trans | -77.1 | 143 | 175 | -73.1 | 164.6 | 0 | 0 | 0 | 108.6 | R63 W70 M74 E75 | R63-L65 PolarHBondContact O-N 3.48Å; L65-W70 HydrophobicContact CD2-CE3 4.47Å; L65-W70 HydrophobicContact CD2-CH2 4.22Å; L65-W70 HydrophobicContact CD2-CZ3 3.68Å; L65-M74 HydrophobicContact CD1-CB 3.52Å; L65-M74 HydrophobicContact CD2-CB 4.3Å; L65-E75 HydrophobicContact CB-CG 4.2Å; L65-E75 HydrophobicContact CD1-CG 3.74Å |
| 66 | P | 91.3 | Very high | 85.1 | Confident | 57 Ų | 57 | 106.5 Ų | 106.5 | 37% | 0.37 | 51% | 0.509 | S | S | . | . | P | Polyproline II helix | trans | -60.4 | 143.3 | 176.5 | 24.2 | -32.6 | 0 | 0 | 0 | 110.1 | N68 G71 | P66-N68 PolarHBondContact O-N 3.4Å; P66-G71 WeakPolarHBondContact O-CA 3.46Å |
| 67 | K | 92.4 | Very high | 85 | Confident | 208 Ų | 208 | 107.2 Ų | 107.2 | 90% | 0.904 | 51% | 0.511 | S | S | * | . | S | Bend | trans | -71.7 | 41.6 | -177.4 | -59.6 | -177.3 | -179.1 | -179.5 | 0 | 114.3 | ||
| 68 | N | 94.4 | Very high | 84.8 | Confident | 77 Ų | 77 | 110.8 Ų | 110.8 | 41% | 0.412 | 52% | 0.522 | S | S | . | . | S | Bend | trans | -106.4 | 175.8 | 176.9 | 69.3 | 22.6 | 0 | 0 | 0 | 110.9 | P66 W70 G71 K72 | P66-N68 PolarHBondContact O-N 3.4Å; N68-W70 PolarHBondContact O-N 3.4Å; N68-W70 WeakPolarHBondContact OD1-CA 3.25Å; N68-W70 WeakPolarHBondContact OD1-CB 3.34Å; N68-W70 PolarHBondContact OD1-N 3.13Å; N68-G71 PolarHBondContact O-N 3.11Å; N68-G71 PolarHBondContact OD1-N 3Å; N68-K72 PolarHBondContact O-N 3.4Å |
| 69 | R | 93.6 | Very high | 84.4 | Confident | 223 Ų | 223 | 113.8 Ų | 113.8 | 84% | 0.842 | 54% | 0.535 | S | S | * | . | H | α-helix | trans | -58.3 | -31.4 | 179.1 | -72 | -163.8 | -69.9 | -116.5 | 2.2 | 113.2 | M73 | R69-M73 VanDerWaalsContact O-CB 3.32Å; R69-M73 WeakPolarHBondContact O-CB 3.14Å; R69-M73 PolarHBondContact O-N 3.43Å; R69-M73 VanDerWaalsContact O-N 3.12Å |
| 70 | W | 92.8 | Very high | 84 | Confident | 136 Ų | 136 | 112.8 Ų | 112.8 | 52% | 0.515 | 52% | 0.521 | S | S | . | . | H | α-helix | trans | -73.5 | -43.9 | 178.2 | -177.9 | 85.7 | 0 | 0 | 0 | 111.6 | L65 N68 M73 M74 | L65-W70 HydrophobicContact CD2-CE3 4.47Å; L65-W70 HydrophobicContact CD2-CH2 4.22Å; L65-W70 HydrophobicContact CD2-CZ3 3.68Å; N68-W70 PolarHBondContact O-N 3.4Å; N68-W70 WeakPolarHBondContact OD1-CA 3.25Å; N68-W70 WeakPolarHBondContact OD1-CB 3.34Å; N68-W70 PolarHBondContact OD1-N 3.13Å; W70-M73 PolarHBondContact O-N 3.17Å; W70-M74 HydrophobicContact CD2-CG 3.88Å; W70-M74 HydrophobicContact CE3-CG 4.19Å; W70-M74 HydrophobicContact CG-CG 4.45Å; W70-M74 HydrophobicContact CH2-CG 4.08Å; W70-M74 HydrophobicContact CZ2-CG 3.74Å; W70-M74 HydrophobicContact CZ2-SD 4.23Å; W70-M74 HydrophobicContact CZ3-CG 4.29Å; W70-M74 WeakPolarHBondContact O-CB 3.15Å; W70-M74 VanDerWaalsContact O-CG 3.28Å; W70-M74 WeakPolarHBondContact O-CG 3.48Å; W70-M74 PolarHBondContact O-N 2.71Å |
| 71 | G | 94.1 | Very high | 83.4 | Confident | 0 Ų | 0 | 111 Ų | 111 | 0% | 0 | 51% | 0.508 | C | S | . | . | H | α-helix | trans | -61.9 | -46.1 | 175.3 | 0 | 0 | 0 | 0 | 0 | 111.7 | P66 N68 M73 M74 E75 | P66-G71 WeakPolarHBondContact O-CA 3.46Å; N68-G71 PolarHBondContact O-N 3.11Å; N68-G71 PolarHBondContact OD1-N 3Å; G71-M73 VanDerWaalsContact C-N 3.31Å; G71-M73 PolarHBondContact O-N 3.21Å; G71-M74 CarbonylContact O-C 3.58Å; G71-M74 PolarHBondContact O-N 3.22Å; G71-M74 VanDerWaalsContact O-N 3.16Å; G71-E75 WeakPolarHBondContact O-CB 3.4Å; G71-E75 WeakPolarHBondContact O-CG 3.36Å; G71-E75 PolarHBondContact O-N 2.95Å |
| 72 | K | 92.7 | Very high | 83.2 | Confident | 139 Ų | 139 | 110.6 Ų | 110.6 | 60% | 0.604 | 50% | 0.495 | S | S | * | . | H | α-helix | trans | -59.3 | -39.4 | 173.9 | -68.5 | -171.1 | 177.2 | -167.7 | 0 | 113.1 | N68 K76 | N68-K72 PolarHBondContact O-N 3.4Å; K72-K76 WeakPolarHBondContact O-CB 3.49Å; K72-K76 PolarHBondContact O-N 3.41Å |
| 73 | M | 91.9 | Very high | 82.3 | Confident | 113 Ų | 113 | 111.3 Ų | 111.3 | 56% | 0.557 | 50% | 0.502 | S | S | * | . | H | α-helix | trans | -68.9 | -39.6 | 177 | -172.6 | -165.1 | -44.8 | 0 | 0 | 111.9 | R69 W70 G71 K77 | R69-M73 VanDerWaalsContact O-CB 3.32Å; R69-M73 WeakPolarHBondContact O-CB 3.14Å; R69-M73 PolarHBondContact O-N 3.43Å; R69-M73 VanDerWaalsContact O-N 3.12Å; W70-M73 PolarHBondContact O-N 3.17Å; G71-M73 VanDerWaalsContact C-N 3.31Å; G71-M73 PolarHBondContact O-N 3.21Å; M73-K77 PolarHBondContact O-N 3.48Å |
| 74 | M | 87.8 | Confident | 80.8 | Confident | 55 Ų | 55 | 108.5 Ų | 108.5 | 27% | 0.271 | 50% | 0.495 | S | S | . | . | H | α-helix | trans | -73.3 | -33.8 | 177.4 | -70.8 | -62.5 | 106 | 0 | 0 | 112.1 | L65 W70 G71 K77 R78 | L65-M74 HydrophobicContact CD1-CB 3.52Å; L65-M74 HydrophobicContact CD2-CB 4.3Å; W70-M74 HydrophobicContact CD2-CG 3.88Å; W70-M74 HydrophobicContact CE3-CG 4.19Å; W70-M74 HydrophobicContact CG-CG 4.45Å; W70-M74 HydrophobicContact CH2-CG 4.08Å; W70-M74 HydrophobicContact CZ2-CG 3.74Å; W70-M74 HydrophobicContact CZ2-SD 4.23Å; W70-M74 HydrophobicContact CZ3-CG 4.29Å; W70-M74 WeakPolarHBondContact O-CB 3.15Å; W70-M74 VanDerWaalsContact O-CG 3.28Å; W70-M74 WeakPolarHBondContact O-CG 3.48Å; W70-M74 PolarHBondContact O-N 2.71Å; G71-M74 CarbonylContact O-C 3.58Å; G71-M74 PolarHBondContact O-N 3.22Å; G71-M74 VanDerWaalsContact O-N 3.16Å; M74-K77 PolarHBondContact O-N 2.92Å; M74-R78 WeakPolarHBondContact O-CB 3.28Å; M74-R78 PolarHBondContact O-N 3.15Å |
| 75 | E | 89 | Confident | 79 | Confident | 77 Ų | 77 | 107.3 Ų | 107.3 | 36% | 0.36 | 49% | 0.488 | S | S | . | . | H | α-helix | trans | -61.4 | -51.1 | 170.2 | -79 | 169.9 | 175.4 | 0 | 0 | 110.1 | L65 G71 K77 R78 E79 | L65-E75 HydrophobicContact CB-CG 4.2Å; L65-E75 HydrophobicContact CD1-CG 3.74Å; G71-E75 WeakPolarHBondContact O-CB 3.4Å; G71-E75 WeakPolarHBondContact O-CG 3.36Å; G71-E75 PolarHBondContact O-N 2.95Å; E75-K77 PolarHBondContact O-N 3.04Å; E75-R78 WeakPolarHBondContact O-CA 3.37Å; E75-R78 WeakPolarHBondContact O-CB 3.3Å; E75-R78 PolarHBondContact O-N 3.49Å; E75-E79 PolarHBondContact O-N 3.33Å |
| 76 | K | 87 | Confident | 77.1 | Confident | 142 Ų | 142 | 114.8 Ų | 114.8 | 62% | 0.617 | 52% | 0.522 | S | S | * | . | H | α-helix | trans | -58 | -32.8 | 175 | -174.3 | 171.9 | -177.1 | 173.4 | 0 | 112.9 | K72 | K72-K76 WeakPolarHBondContact O-CB 3.49Å; K72-K76 PolarHBondContact O-N 3.41Å |
| 77 | K | 81.1 | Confident | 74.5 | Confident | 110 Ų | 110 | 117.4 Ų | 117.4 | 48% | 0.478 | 54% | 0.538 | S | S | . | . | H | α-helix | trans | -73.9 | -39.7 | 173.5 | -170.9 | -178.5 | 174.8 | -176.7 | 0 | 111.6 | M73 M74 E75 Q80 H81 | M73-K77 PolarHBondContact O-N 3.48Å; M74-K77 PolarHBondContact O-N 2.92Å; E75-K77 PolarHBondContact O-N 3.04Å; K77-Q80 WeakPolarHBondContact O-CB 3.45Å; K77-Q80 PolarHBondContact O-N 3.29Å; K77-H81 VanDerWaalsContact CE-NE2 3.25Å; K77-H81 WeakPolarHBondContact CE-NE2 3.3Å; K77-H81 PolarHBondContact O-CD2 3.31Å; K77-H81 PolarHBondContact O-N 3.14Å |
| 78 | R | 78.8 | Confident | 72.6 | Confident | 85 Ų | 85 | 116.4 Ų | 116.4 | 32% | 0.321 | 53% | 0.533 | S | S | . | . | H | α-helix | trans | -58.3 | -48.5 | 178.9 | -176 | -172.5 | -65.1 | -158.6 | 4.9 | 111.3 | Q62 R63 M74 E75 Q80 H81 E82 | Q62-R78 VanDerWaalsContact CB-NH1 3.32Å; R63-R78 PolarHBondContact O-NH2 3.36Å; M74-R78 WeakPolarHBondContact O-CB 3.28Å; M74-R78 PolarHBondContact O-N 3.15Å; E75-R78 WeakPolarHBondContact O-CA 3.37Å; E75-R78 WeakPolarHBondContact O-CB 3.3Å; E75-R78 PolarHBondContact O-N 3.49Å; R78-Q80 PolarHBondContact O-N 3.14Å; R78-Q80 VanDerWaalsContact O-N 3.17Å; R78-H81 PolarHBondContact O-N 3.15Å; R78-E82 PolarHBondContact O-N 3.39Å |
| 79 | E | 71 | Confident | 70.4 | Confident | 122 Ų | 122 | 124 Ų | 124 | 57% | 0.57 | 56% | 0.556 | S | S | * | * | H | α-helix | trans | -55.3 | -35 | 177.7 | -68.9 | 168.3 | -174 | 0 | 0 | 112 | E75 H81 I83 | E75-E79 PolarHBondContact O-N 3.33Å; E79-H81 PolarHBondContact O-N 3.31Å; E79-I83 VanDerWaalsContact O-CD1 3.3Å; E79-I83 WeakPolarHBondContact O-CD1 3.37Å; E79-I83 WeakPolarHBondContact O-CG1 3.36Å |
| 80 | Q | 63.2 | Low | 68.2 | Low | 93 Ų | 93 | 118.3 Ų | 118.3 | 44% | 0.435 | 55% | 0.55 | S | S | . | * | H | α-helix | trans | -72.3 | -25.4 | 177.4 | -69.2 | -168.2 | 13.2 | 0 | 0 | 114.5 | K77 R78 K84 | K77-Q80 WeakPolarHBondContact O-CB 3.45Å; K77-Q80 PolarHBondContact O-N 3.29Å; R78-Q80 PolarHBondContact O-N 3.14Å; R78-Q80 VanDerWaalsContact O-N 3.17Å; Q80-K84 WeakPolarHBondContact O-CD 3.34Å; Q80-K84 WeakPolarHBondContact O-CE 3.4Å; Q80-K84 WeakPolarHBondContact O-CG 3.43Å |
| 81 | H | 59.9 | Low | 66.2 | Low | 97 Ų | 97 | 117.8 Ų | 117.8 | 45% | 0.449 | 57% | 0.568 | S | S | . | * | H | α-helix | trans | -82.1 | -30.7 | -179.9 | -76 | -78 | 0 | 0 | 0 | 111.7 | K77 R78 E79 I83 K84 N85 | K77-H81 VanDerWaalsContact CE-NE2 3.25Å; K77-H81 WeakPolarHBondContact CE-NE2 3.3Å; K77-H81 PolarHBondContact O-CD2 3.31Å; K77-H81 PolarHBondContact O-N 3.14Å; R78-H81 PolarHBondContact O-N 3.15Å; E79-H81 PolarHBondContact O-N 3.31Å; H81-I83 PolarHBondContact O-N 3.29Å; H81-K84 PolarHBondContact O-N 3.01Å; H81-N85 PolarHBondContact O-ND2 3.18Å; H81-N85 PolarHBondContact O-OD1 3.17Å |
| 82 | E | 58.9 | Low | 64.1 | Low | 120 Ų | 120 | 123.9 Ų | 123.9 | 56% | 0.561 | 61% | 0.605 | S | S | * | * | H | α-helix | trans | -64.9 | -40.5 | -179.7 | -151.9 | 160.8 | -161.6 | 0 | 0 | 111.5 | R78 K84 | R78-E82 PolarHBondContact O-N 3.39Å; E82-K84 VanDerWaalsContact C-N 3.29Å; E82-K84 PolarHBondContact O-N 2.75Å |
| 83 | I | 55.3 | Low | 62.2 | Low | 132 Ų | 132 | 123.5 Ų | 123.5 | 68% | 0.677 | 61% | 0.614 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -77.3 | -12.7 | -179.5 | -44.1 | 157.2 | 0 | 0 | 0 | 112.4 | E79 H81 | E79-I83 VanDerWaalsContact O-CD1 3.3Å; E79-I83 WeakPolarHBondContact O-CD1 3.37Å; E79-I83 WeakPolarHBondContact O-CG1 3.36Å; H81-I83 PolarHBondContact O-N 3.29Å |
| 84 | K | 48.7 | Very low | 59.9 | Low | 121 Ų | 121 | 125.5 Ų | 125.5 | 53% | 0.526 | 63% | 0.627 | S | S | . | * | T | Hydrogen-bonded Turn | trans | -97.4 | -9.1 | -174.5 | -73.2 | 177 | -170.4 | 177.1 | 0 | 114.2 | Q80 H81 E82 E86 T87 | Q80-K84 WeakPolarHBondContact O-CD 3.34Å; Q80-K84 WeakPolarHBondContact O-CE 3.4Å; Q80-K84 WeakPolarHBondContact O-CG 3.43Å; H81-K84 PolarHBondContact O-N 3.01Å; E82-K84 VanDerWaalsContact C-N 3.29Å; E82-K84 PolarHBondContact O-N 2.75Å; K84-E86 VanDerWaalsContact C-N 3.32Å; K84-E86 PolarHBondContact O-N 2.84Å; K84-T87 PolarHBondContact O-N 3.06Å |
| 85 | N | 49.2 | Very low | 58.7 | Low | 121 Ų | 121 | 125.8 Ų | 125.8 | 65% | 0.647 | 64% | 0.644 | S | S | * | * | S | Bend | trans | -79.6 | -16.8 | -174.7 | -60 | -31.9 | 0 | 0 | 0 | 113 | H81 | H81-N85 PolarHBondContact O-ND2 3.18Å; H81-N85 PolarHBondContact O-OD1 3.17Å |
| 86 | E | 45.8 | Very low | 57.3 | Low | 182 Ų | 182 | 130.4 Ų | 130.4 | 85% | 0.85 | 67% | 0.67 | S | S | * | * | S | Bend | trans | -85.5 | -19.3 | 175.5 | -57.7 | -177.6 | -162.8 | 0 | 0 | 112.6 | K84 | K84-E86 VanDerWaalsContact C-N 3.32Å; K84-E86 PolarHBondContact O-N 2.84Å |
| 87 | T | 37.5 | Very low | 56.1 | Low | 113 Ų | 113 | 132.4 Ų | 132.4 | 69% | 0.693 | 67% | 0.674 | S | S | * | * | trans | -111 | 83.1 | -178.1 | -56.7 | 0 | 0 | 0 | 0 | 110.7 | K84 R89 | K84-T87 PolarHBondContact O-N 3.06Å; T87-R89 PolarHBondContact O-N 3.18Å | ||
| 88 | K | 53.1 | Low | 55.6 | Low | 186 Ų | 186 | 137.7 Ų | 137.7 | 81% | 0.809 | 70% | 0.697 | S | S | * | * | trans | -71.4 | 120.8 | 159.8 | -72.9 | -169.8 | 178.6 | 178.2 | 0 | 108.8 | ||||
| 89 | R | 47.5 | Very low | 54.9 | Low | 238 Ų | 238 | 143.8 Ų | 143.8 | 90% | 0.898 | 72% | 0.72 | S | S | * | * | 158.3 | 142.4 | 121.5 | -81.3 | 158.9 | -165.9 | 177 | 6.2 | 111.9 | T87 | T87-R89 PolarHBondContact O-N 3.18Š| |||
| 90 | S | 47.2 | Very low | 55 | Low | 102 Ų | 102 | 143.4 Ų | 143.4 | 71% | 0.713 | 73% | 0.728 | S | S | * | * | trans | 80.6 | 87.5 | 159.7 | 175.3 | 0 | 0 | 0 | 0 | 118.3 | ||||
| 91 | S | 50.7 | Low | 55.3 | Low | 126 Ų | 126 | 144.1 Ų | 144.1 | 88% | 0.881 | 73% | 0.734 | S | S | * | * | trans | -112.6 | 77.7 | 142.6 | 70.9 | 0 | 0 | 0 | 0 | 109.4 | ||||
| 92 | T | 50.2 | Low | 55.7 | Low | 127 Ų | 127 | 146.8 Ų | 146.8 | 78% | 0.779 | 75% | 0.75 | S | S | * | * | trans | -85.8 | 100.4 | 161.6 | 44.7 | 0 | 0 | 0 | 0 | 108.8 | ||||
| 93 | V | 53.1 | Low | 56.1 | Low | 132 Ų | 132 | 146 Ų | 146 | 80% | 0.8 | 75% | 0.753 | S | S | * | * | trans | -154.1 | 115.5 | 140.1 | 60.2 | 0 | 0 | 0 | 0 | 109.4 | ||||
| 94 | D | 42.4 | Very low | 56.4 | Low | 154 Ų | 154 | 145.4 Ų | 145.4 | 82% | 0.824 | 75% | 0.746 | S | S | * | * | trans | 32.3 | 116.1 | 157.4 | -87 | -67.1 | 0 | 0 | 0 | 120.9 | ||||
| 95 | G | 63.7 | Low | 57.1 | Low | 61 Ų | 61 | 144.2 Ų | 144.2 | 63% | 0.629 | 75% | 0.745 | S | S | * | * | trans | -73.7 | -177.5 | 159 | 0 | 0 | 0 | 0 | 0 | 113.7 | ||||
| 96 | L | 59.4 | Low | 57.5 | Low | 174 Ų | 174 | 141.7 Ų | 141.7 | 91% | 0.911 | 75% | 0.748 | S | S | * | * | trans | 94.1 | 33.5 | 159.5 | -44.8 | -173.7 | 0 | 0 | 0 | 119 | ||||
| 97 | R | 61.7 | Low | 58.2 | Low | 184 Ų | 184 | 137.3 Ų | 137.3 | 69% | 0.694 | 74% | 0.737 | S | S | * | * | trans | -129.2 | 115.5 | 153.4 | -62 | -170.2 | -99.9 | -145.9 | -1.1 | 111.1 | R99 | R97-R99 VanDerWaalsContact CB-O 3.26Å; R97-R99 WeakPolarHBondContact CB-O 3.32Å; R97-R99 PolarHBondContact O-N 3.06Å | ||
| 98 | K | 70 | Confident | 59.2 | Low | 222 Ų | 222 | 136.9 Ų | 136.9 | 97% | 0.965 | 74% | 0.739 | S | S | * | * | S | Bend | trans | -62.6 | 0.3 | 174.7 | -74.9 | -80.5 | -176.6 | 177.1 | 0 | 113.6 | ||
| 99 | R | 64.6 | Low | 59.3 | Low | 212 Ų | 212 | 131.5 Ų | 131.5 | 80% | 0.8 | 72% | 0.722 | S | S | * | * | S | Bend | trans | -144.5 | 138.3 | 164.8 | -61.2 | -174.3 | 175 | 121.9 | 0.3 | 108.1 | R97 | R97-R99 VanDerWaalsContact CB-O 3.26Å; R97-R99 WeakPolarHBondContact CB-O 3.32Å; R97-R99 PolarHBondContact O-N 3.06Å |
| 100 | P | 73.9 | Confident | 59.9 | Low | 114 Ų | 114 | 126.7 Ų | 126.7 | 74% | 0.74 | 72% | 0.724 | S | S | * | * | trans | -57.8 | 144.7 | 173.3 | 25.2 | -33.2 | 0 | 0 | 0 | 110.1 | I102 | P100-I102 PolarHBondContact O-N 2.96Å; P100-I102 VanDerWaalsContact O-N 3.08Å | ||
| 101 | L | 69.6 | Low | 60.4 | Low | 109 Ų | 109 | 126 Ų | 126 | 57% | 0.571 | 72% | 0.716 | S | S | * | * | trans | -61.6 | 113.6 | 172.3 | -175.6 | 65.8 | 0 | 0 | 0 | 107.2 | V103 | L101-V103 HydrophobicContact CB-CG2 4.41Å; L101-V103 HydrophobicContact CD2-CG2 3.82Å; L101-V103 HydrophobicContact CG-CG2 3.89Å; L101-V103 PolarHBondContact O-N 2.94Å | ||
| 102 | I | 67.9 | Low | 60.9 | Low | 152 Ų | 152 | 125.6 Ų | 125.6 | 78% | 0.779 | 71% | 0.713 | S | S | * | * | trans | -70.9 | 88.5 | 171.8 | -57 | 173.2 | 0 | 0 | 0 | 105.9 | P100 F104 | P100-I102 PolarHBondContact O-N 2.96Å; P100-I102 VanDerWaalsContact O-N 3.08Å; I102-F104 PolarHBondContact O-N 3.18Å | ||
| 103 | V | 67.8 | Low | 61.6 | Low | 103 Ų | 103 | 126 Ų | 126 | 62% | 0.624 | 71% | 0.709 | S | S | * | * | trans | -79.2 | 107.1 | 166.8 | -176.1 | 0 | 0 | 0 | 0 | 105.4 | L101 D105 | L101-V103 HydrophobicContact CB-CG2 4.41Å; L101-V103 HydrophobicContact CD2-CG2 3.82Å; L101-V103 HydrophobicContact CG-CG2 3.89Å; L101-V103 PolarHBondContact O-N 2.94Å; V103-D105 VanDerWaalsContact C-N 3.29Å; V103-D105 PolarHBondContact O-N 2.68Å; V103-D105 VanDerWaalsContact O-N 3.15Å | ||
| 104 | F | 60.1 | Low | 62 | Low | 121 Ų | 121 | 129.2 Ų | 129.2 | 53% | 0.531 | 71% | 0.713 | S | S | . | * | trans | -81.4 | 85 | 169.6 | -161.9 | -91.7 | 0 | 0 | 0 | 106.9 | I102 G106 T109 | I102-F104 PolarHBondContact O-N 3.18Å; F104-G106 PolarHBondContact O-N 2.64Å; F104-T109 HydrophobicContact CE2-CG2 4.35Å | ||
| 105 | D | 63.7 | Low | 63 | Low | 96 Ų | 96 | 128 Ų | 128 | 51% | 0.513 | 71% | 0.71 | S | S | . | * | trans | -69.8 | 113.6 | 159.4 | 71.7 | -45.1 | 0 | 0 | 0 | 105.3 | V103 S107 | V103-D105 VanDerWaalsContact C-N 3.29Å; V103-D105 PolarHBondContact O-N 2.68Å; V103-D105 VanDerWaalsContact O-N 3.15Å; D105-S107 VanDerWaalsContact CG-OG 3.26Å; D105-S107 PolarHBondContact O-N 3.36Å; D105-S107 PolarHBondContact OD2-OG 3.26Å | ||
| 106 | G | 58.8 | Low | 63 | Low | 68 Ų | 68 | 133.9 Ų | 133.9 | 70% | 0.701 | 72% | 0.718 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -62 | 12.7 | -174.2 | 0 | 0 | 0 | 0 | 0 | 115.3 | F104 | F104-G106 PolarHBondContact O-N 2.64Š|
| 107 | S | 58.6 | Low | 62.9 | Low | 90 Ų | 90 | 134.2 Ų | 134.2 | 63% | 0.629 | 71% | 0.712 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -80.1 | -19.4 | -173.8 | -4 | 0 | 0 | 0 | 0 | 114.6 | D105 | D105-S107 VanDerWaalsContact CG-OG 3.26Å; D105-S107 PolarHBondContact O-N 3.36Å; D105-S107 PolarHBondContact OD2-OG 3.26Å |
| 108 | S | 60.3 | Low | 62.5 | Low | 104 Ų | 104 | 130.4 Ų | 130.4 | 73% | 0.727 | 71% | 0.71 | S | S | * | * | S | Bend | trans | -140.7 | 5.2 | -167.5 | -82.9 | 0 | 0 | 0 | 0 | 118.9 | ||
| 109 | T | 54.7 | Low | 61.8 | Low | 73 Ų | 73 | 126.5 Ų | 126.5 | 45% | 0.448 | 70% | 0.695 | S | S | . | * | trans | -128.7 | 96.1 | 178.6 | -47.5 | 0 | 0 | 0 | 0 | 112.7 | F104 T111 | F104-T109 HydrophobicContact CE2-CG2 4.35Å; T109-T111 HydrophobicContact CG2-CG2 3.7Å; T109-T111 VanDerWaalsContact CG2-OG1 3.3Å; T109-T111 WeakPolarHBondContact CG2-OG1 3.39Å; T109-T111 PolarHBondContact O-N 2.73Å | ||
| 110 | S | 59.4 | Low | 60.7 | Low | 136 Ų | 136 | 123 Ų | 123 | 95% | 0.951 | 69% | 0.692 | S | S | * | * | trans | -74.7 | 55.4 | 167.6 | -59.9 | 0 | 0 | 0 | 0 | 112 | ||||
| 111 | T | 57.9 | Low | 59.3 | Low | 88 Ų | 88 | 121.3 Ų | 121.3 | 54% | 0.54 | 70% | 0.695 | S | S | . | * | trans | -112.5 | 109.3 | 170.1 | 64.2 | 0 | 0 | 0 | 0 | 109.6 | T109 I113 | T109-T111 HydrophobicContact CG2-CG2 3.7Å; T109-T111 VanDerWaalsContact CG2-OG1 3.3Å; T109-T111 WeakPolarHBondContact CG2-OG1 3.39Å; T109-T111 PolarHBondContact O-N 2.73Å; T111-I113 PolarHBondContact O-N 2.99Å | ||
| 112 | S | 60.9 | Low | 58.3 | Low | 117 Ų | 117 | 122.9 Ų | 122.9 | 82% | 0.818 | 70% | 0.704 | S | S | * | * | trans | -74.4 | 103.3 | 177.5 | 45.8 | 0 | 0 | 0 | 0 | 110.7 | K114 | S112-K114 PolarHBondContact O-N 2.75Å; S112-K114 VanDerWaalsContact O-N 3.14Å | ||
| 113 | I | 64.2 | Low | 57.2 | Low | 135 Ų | 135 | 122 Ų | 122 | 69% | 0.692 | 70% | 0.701 | S | S | * | * | trans | -76 | 101.1 | 173.3 | -57.9 | 172.3 | 0 | 0 | 0 | 107.9 | T111 V115 | T111-I113 PolarHBondContact O-N 2.99Å; I113-V115 HydrophobicContact CG2-CG1 4.43Å; I113-V115 PolarHBondContact O-N 3.23Å; I113-V115 VanDerWaalsContact O-N 3.14Å | ||
| 114 | K | 63.3 | Low | 56.4 | Low | 201 Ų | 201 | 123.6 Ų | 123.6 | 87% | 0.874 | 71% | 0.706 | S | S | * | * | trans | -77.6 | 91.6 | 170.8 | -82.9 | 179.3 | 64.3 | 161.3 | 0 | 110 | S112 | S112-K114 PolarHBondContact O-N 2.75Å; S112-K114 VanDerWaalsContact O-N 3.14Å | ||
| 115 | V | 62.8 | Low | 55.9 | Low | 127 Ų | 127 | 128 Ų | 128 | 77% | 0.77 | 72% | 0.719 | S | S | * | * | trans | -76.4 | 120.8 | 160.9 | -84.9 | 0 | 0 | 0 | 0 | 109 | I113 K117 | I113-V115 HydrophobicContact CG2-CG1 4.43Å; I113-V115 PolarHBondContact O-N 3.23Å; I113-V115 VanDerWaalsContact O-N 3.14Å; V115-K117 PolarHBondContact O-N 3.24Å | ||
| 116 | K | 63.4 | Low | 55.4 | Low | 185 Ų | 185 | 131.9 Ų | 131.9 | 80% | 0.804 | 74% | 0.739 | S | S | * | * | trans | -70.6 | 121.6 | 166.4 | 76.6 | -179 | -176.3 | 170.8 | 0 | 107.4 | T118 | K116-T118 PolarHBondContact O-N 2.85Š| ||
| 117 | K | 56.3 | Low | 55.4 | Low | 181 Ų | 181 | 138.1 Ų | 138.1 | 79% | 0.787 | 75% | 0.747 | S | S | * | * | trans | -84.8 | 100.5 | 167.1 | -177.8 | 164.9 | 163.1 | 178.9 | 0 | 106.8 | V115 E119 | V115-K117 PolarHBondContact O-N 3.24Å; K117-E119 PolarHBondContact O-N 3.01Å | ||
| 118 | T | 53.3 | Low | 55.2 | Low | 104 Ų | 104 | 139 Ų | 139 | 64% | 0.638 | 75% | 0.751 | S | S | * | * | trans | -92.7 | 87.8 | 162.8 | -62.9 | 0 | 0 | 0 | 0 | 106.1 | K116 N120 | K116-T118 PolarHBondContact O-N 2.85Å; T118-N120 PolarHBondContact O-N 3.21Å | ||
| 119 | E | 56.8 | Low | 54.7 | Low | 140 Ų | 140 | 139.5 Ų | 139.5 | 65% | 0.654 | 75% | 0.751 | S | S | * | * | trans | -70.4 | 112.2 | 154.4 | 149.6 | -179.5 | 166.9 | 0 | 0 | 105.4 | K117 | K117-E119 PolarHBondContact O-N 3.01Š| ||
| 120 | N | 41.2 | Very low | 54.6 | Low | 140 Ų | 140 | 141.6 Ų | 141.6 | 75% | 0.749 | 77% | 0.766 | S | S | * | * | trans | 163.5 | 131.9 | 143.7 | -76 | -6.7 | 0 | 0 | 0 | 109.3 | T118 | T118-N120 PolarHBondContact O-N 3.21Š| ||
| 121 | G | 44.3 | Very low | 54 | Low | 78 Ų | 78 | 143.3 Ų | 143.3 | 80% | 0.804 | 76% | 0.759 | S | S | * | * | trans | -78.5 | -178.6 | -164.3 | 0 | 0 | 0 | 0 | 0 | 116.3 | ||||
| 122 | D | 48.3 | Very low | 53.4 | Low | 142 Ų | 142 | 146.8 Ų | 146.8 | 76% | 0.759 | 77% | 0.774 | S | S | * | * | trans | 85.3 | 126.8 | 152.8 | -147.5 | 16.9 | 0 | 0 | 0 | 119.1 | ||||
| 123 | N | 45.6 | Very low | 53 | Low | 132 Ų | 132 | 148.4 Ų | 148.4 | 71% | 0.706 | 77% | 0.769 | S | S | * | * | trans | 70.5 | 115.6 | 161.1 | -66.7 | -52.9 | 0 | 0 | 0 | 123.4 | ||||
| 124 | D | 50.4 | Low | 51.9 | Low | 137 Ų | 137 | 149.1 Ų | 149.1 | 73% | 0.733 | 77% | 0.774 | S | S | * | * | 96.5 | 127 | 120.9 | -157.9 | 31.1 | 0 | 0 | 0 | 120.3 | |||||
| 125 | R | 49.1 | Very low | 51.2 | Low | 213 Ų | 213 | 147.3 Ų | 147.3 | 80% | 0.804 | 77% | 0.773 | S | S | * | * | trans | 68.3 | 88.3 | 151.2 | -117.1 | 166.3 | 162.3 | -166.1 | -2.4 | 120.2 | K127 | R125-K127 PolarHBondContact O-N 3.16Å; R125-K127 VanDerWaalsContact O-N 3.17Å | ||
| 126 | L | 52.9 | Low | 50.2 | Low | 179 Ų | 179 | 147.7 Ų | 147.7 | 94% | 0.937 | 78% | 0.776 | S | S | * | * | trans | -59.7 | 112.1 | 153.1 | -61 | 175.4 | 0 | 0 | 0 | 110 | ||||
| 127 | K | 59.2 | Low | 49.3 | Very low | 198 Ų | 198 | 147.7 Ų | 147.7 | 86% | 0.861 | 78% | 0.779 | S | S | * | * | P | Polyproline II helix | trans | -91 | 118 | 167.7 | -131 | 171.5 | -175.3 | 174.7 | 0 | 108.4 | R125 | R125-K127 PolarHBondContact O-N 3.16Å; R125-K127 VanDerWaalsContact O-N 3.17Å |
| 128 | P | 54 | Low | 48.4 | Very low | 109 Ų | 109 | 150.3 Ų | 150.3 | 71% | 0.708 | 78% | 0.783 | S | S | * | * | P | Polyproline II helix | trans | -71.6 | 152.4 | 170.6 | 28.2 | -31.6 | 0 | 0 | 0 | 110.9 | ||
| 129 | P | 50.1 | Low | 47.7 | Very low | 114 Ų | 114 | 153.8 Ų | 153.8 | 74% | 0.74 | 79% | 0.79 | S | S | * | * | P | Polyproline II helix | trans | -67.6 | 144.7 | -179.6 | 27 | -32.9 | 0 | 0 | 0 | 111.7 | Q131 | P129-Q131 PolarHBondContact O-N 3.33Š|
| 130 | P | 52.9 | Low | 46.8 | Very low | 118 Ų | 118 | 152.2 Ų | 152.2 | 77% | 0.766 | 79% | 0.794 | S | S | * | * | P | Polyproline II helix | trans | -68.6 | 124 | -177.9 | 26.4 | -32.2 | 0 | 0 | 0 | 111.6 | ||
| 131 | Q | 47.6 | Very low | 47.3 | Very low | 172 Ų | 172 | 151.4 Ų | 151.4 | 80% | 0.804 | 80% | 0.797 | S | S | * | * | trans | -80 | 110.7 | 168.2 | -68.4 | -179.3 | -46.2 | 0 | 0 | 108.9 | P129 | P129-Q131 PolarHBondContact O-N 3.33Š| ||
| 132 | N | 44.2 | Very low | 46.7 | Very low | 160 Ų | 160 | 154 Ų | 154 | 86% | 0.856 | 80% | 0.802 | S | S | * | * | trans | -96.2 | 93.6 | 164.4 | -85.2 | -59.2 | 0 | 0 | 0 | 108.5 | ||||
| 133 | H | 53 | Low | 46 | Very low | 151 Ų | 151 | 150.5 Ų | 150.5 | 70% | 0.699 | 80% | 0.8 | S | S | * | * | trans | -96.1 | 125.4 | 149.7 | 58.9 | -78.4 | 0 | 0 | 0 | 105.4 | ||||
| 134 | D | 42 | Very low | 46 | Very low | 151 Ų | 151 | 150.1 Ų | 150.1 | 81% | 0.807 | 81% | 0.805 | S | S | * | * | trans | -151.9 | 118 | 148.2 | -129.5 | -14.9 | 0 | 0 | 0 | 111.2 | ||||
| 135 | L | 47.8 | Very low | 45.3 | Very low | 162 Ų | 162 | 150.7 Ų | 150.7 | 85% | 0.848 | 81% | 0.813 | S | S | * | * | trans | -88.6 | 128 | 166.4 | -69.5 | 161.8 | 0 | 0 | 0 | 105.6 | ||||
| 136 | T | 42.7 | Very low | 45 | Very low | 136 Ų | 136 | 150.8 Ų | 150.8 | 83% | 0.834 | 82% | 0.819 | S | S | * | * | trans | -173 | 120.2 | 144.1 | 24.7 | 0 | 0 | 0 | 0 | 111.6 | ||||
| 137 | H | 44.6 | Very low | 44.5 | Very low | 185 Ų | 185 | 147.7 Ų | 147.7 | 86% | 0.856 | 81% | 0.812 | S | S | * | * | trans | -62 | 141 | 157.5 | -65.9 | -96.9 | 0 | 0 | 0 | 110 | ||||
| 138 | R | 36 | Very low | 44 | Very low | 235 Ų | 235 | 143.9 Ų | 143.9 | 89% | 0.887 | 81% | 0.808 | S | S | * | * | -172.2 | 151.4 | 126.8 | -104.3 | -171.4 | 161.6 | -88.8 | -7.2 | 115.3 | |||||
| 139 | K | 39.6 | Very low | 43.7 | Very low | 178 Ų | 178 | 144.5 Ų | 144.5 | 77% | 0.774 | 81% | 0.812 | S | S | * | * | trans | -71.4 | 139.4 | -167.3 | -83.8 | 155.8 | 162 | 179.1 | 0 | 117.1 | ||||
| 140 | S | 37.4 | Very low | 43.2 | Very low | 107 Ų | 107 | 147.1 Ų | 147.1 | 75% | 0.748 | 82% | 0.819 | S | S | * | * | 62.8 | 165.6 | 127.1 | -52.3 | 0 | 0 | 0 | 0 | 121.6 | |||||
| 141 | P | 51.8 | Low | 42.7 | Very low | 123 Ų | 123 | 146.4 Ų | 146.4 | 80% | 0.799 | 82% | 0.816 | S | S | * | * | cis | -139.5 | 178.4 | -32.3 | 35.5 | -15.4 | 0 | 0 | 0 | 116 | ||||
| 142 | S | 32.4 | Very low | 42.7 | Very low | 131 Ų | 131 | 144.5 Ų | 144.5 | 92% | 0.916 | 82% | 0.819 | S | S | * | * | trans | 98.8 | 129 | 148.7 | -159.2 | 0 | 0 | 0 | 0 | 121.5 | ||||
| 143 | G | 33.1 | Very low | 42.4 | Very low | 69 Ų | 69 | 143.2 Ų | 143.2 | 71% | 0.711 | 82% | 0.817 | S | S | * | * | trans | 144.9 | 113.2 | 159 | 0 | 0 | 0 | 0 | 0 | 115.5 | ||||
| 144 | P | 45.9 | Very low | 42 | Very low | 125 Ų | 125 | 139.5 Ų | 139.5 | 81% | 0.812 | 82% | 0.819 | S | S | * | * | trans | -103.3 | 125.9 | -178 | 35.3 | -24.8 | 0 | 0 | 0 | 112.3 | ||||
| 145 | V | 35.5 | Very low | 42.1 | Very low | 148 Ų | 148 | 138.6 Ų | 138.6 | 90% | 0.897 | 82% | 0.819 | S | S | * | * | trans | -139.7 | 121.5 | 161.9 | -75.6 | 0 | 0 | 0 | 0 | 110.6 | ||||
| 146 | K | 42.8 | Very low | 42 | Very low | 216 Ų | 216 | 136.8 Ų | 136.8 | 94% | 0.939 | 82% | 0.815 | S | S | * | * | trans | -76.9 | 136.7 | 173.6 | -70.5 | 172.4 | 175.3 | 175 | 0 | 109.2 | ||||
| 147 | S | 42.3 | Very low | 42.2 | Very low | 113 Ų | 113 | 136.4 Ų | 136.4 | 79% | 0.79 | 82% | 0.815 | S | S | * | * | trans | -146 | 148.1 | 159.1 | 54.4 | 0 | 0 | 0 | 0 | 111.7 | ||||
| 148 | P | 48 | Very low | 41.9 | Very low | 119 Ų | 119 | 133.7 Ų | 133.7 | 77% | 0.773 | 81% | 0.811 | S | S | * | * | trans | -87.6 | 166.9 | -170.4 | 17.8 | -0.6 | 0 | 0 | 0 | 113.3 | ||||
| 149 | P | 47.1 | Very low | 42.4 | Very low | 121 Ų | 121 | 131.9 Ų | 131.9 | 79% | 0.786 | 81% | 0.809 | S | S | * | * | trans | -91.2 | 138.5 | -170.3 | 35.3 | -30.6 | 0 | 0 | 0 | 112.3 | ||||
| 150 | L | 40 | Very low | 42.6 | Very low | 170 Ų | 170 | 131.9 Ų | 131.9 | 89% | 0.89 | 82% | 0.817 | S | S | * | * | trans | -138.8 | 120.2 | 164.6 | -70.4 | 176 | 0 | 0 | 0 | 111.2 | ||||
| 151 | S | 43.9 | Very low | 42.9 | Very low | 102 Ų | 102 | 136.7 Ų | 136.7 | 71% | 0.713 | 82% | 0.824 | S | S | * | * | trans | 19.1 | 134.6 | 158 | 57.2 | 0 | 0 | 0 | 0 | 121.9 | ||||
| 152 | P | 47.4 | Very low | 42.4 | Very low | 132 Ų | 132 | 142.1 Ų | 142.1 | 86% | 0.857 | 83% | 0.829 | S | S | * | * | P | Polyproline II helix | trans | -81 | 127.6 | 168.1 | 31.9 | -29.8 | 0 | 0 | 0 | 112.5 | ||
| 153 | V | 38.1 | Very low | 42.5 | Very low | 134 Ų | 134 | 140.3 Ų | 140.3 | 81% | 0.812 | 82% | 0.822 | S | S | * | * | P | Polyproline II helix | trans | -62.4 | 130.5 | 173.7 | 166.3 | 0 | 0 | 0 | 0 | 111.2 | ||
| 154 | G | 43.3 | Very low | 42.6 | Very low | 72 Ų | 72 | 141 Ų | 141 | 74% | 0.742 | 82% | 0.821 | S | S | * | * | P | Polyproline II helix | trans | -78.7 | 136.5 | 172.5 | 0 | 0 | 0 | 0 | 0 | 112.2 | ||
| 155 | T | 43.5 | Very low | 42.1 | Very low | 132 Ų | 132 | 141.6 Ų | 141.6 | 81% | 0.81 | 83% | 0.825 | S | S | * | * | trans | -125.9 | 122.4 | 165.4 | 50.8 | 0 | 0 | 0 | 0 | 109.5 | ||||
| 156 | T | 47.5 | Very low | 42.7 | Very low | 124 Ų | 124 | 144.2 Ų | 144.2 | 76% | 0.761 | 82% | 0.824 | S | S | * | * | P | Polyproline II helix | trans | -63.7 | 143 | -174.9 | 53.5 | 0 | 0 | 0 | 0 | 114.3 | ||
| 157 | P | 46.1 | Very low | 42.4 | Very low | 129 Ų | 129 | 142.7 Ų | 142.7 | 84% | 0.838 | 82% | 0.82 | S | S | * | * | P | Polyproline II helix | trans | -86.1 | 121.3 | 157.8 | 30.8 | -28.8 | 0 | 0 | 0 | 111.1 | ||
| 158 | V | 38.8 | Very low | 42.5 | Very low | 127 Ų | 127 | 146.3 Ų | 146.3 | 77% | 0.77 | 83% | 0.825 | S | S | * | * | P | Polyproline II helix | trans | -67 | 131.8 | 175.7 | 169.7 | 0 | 0 | 0 | 0 | 110.9 | ||
| 159 | K | 47 | Very low | 42.1 | Very low | 198 Ų | 198 | 145.5 Ų | 145.5 | 86% | 0.861 | 83% | 0.828 | S | S | * | * | P | Polyproline II helix | trans | -65.8 | 126.5 | 174.1 | -78.6 | -175.5 | 170.4 | 173 | 0 | 111.4 | ||
| 160 | L | 43.1 | Very low | 42 | Very low | 177 Ų | 177 | 149.4 Ų | 149.4 | 93% | 0.927 | 84% | 0.836 | S | S | * | * | P | Polyproline II helix | trans | -103.8 | 116.8 | 158.1 | -70.8 | 176.4 | 0 | 0 | 0 | 109.7 | ||
| 161 | K | 43.3 | Very low | 42.1 | Very low | 209 Ų | 209 | 145.8 Ų | 145.8 | 91% | 0.909 | 83% | 0.831 | S | S | * | * | P | Polyproline II helix | trans | -75.7 | 130.2 | 176.6 | -175.5 | 168.7 | 176.5 | 179.9 | 0 | 109.2 | ||
| 162 | R | 40.8 | Very low | 41.9 | Very low | 236 Ų | 236 | 149.2 Ų | 149.2 | 89% | 0.891 | 84% | 0.837 | S | S | * | * | trans | -118.8 | 126.8 | 164.6 | -171.1 | 176.9 | -72.3 | 129.2 | -1.9 | 108.2 | ||||
| 163 | A | 34.8 | Very low | 41.8 | Very low | 93 Ų | 93 | 149.6 Ų | 149.6 | 77% | 0.769 | 83% | 0.832 | S | S | * | * | trans | -73.5 | 150.6 | 175 | 0 | 0 | 0 | 0 | 0 | 111.3 | ||||
| 164 | A | 36.4 | Very low | 42.2 | Very low | 85 Ų | 85 | 150 Ų | 150 | 70% | 0.702 | 83% | 0.83 | S | S | * | * | trans | -71.8 | 164.5 | -171.2 | 0 | 0 | 0 | 0 | 0 | 114.5 | ||||
| 165 | P | 34.8 | Very low | 42.4 | Very low | 136 Ų | 136 | 155 Ų | 155 | 88% | 0.883 | 84% | 0.839 | S | S | * | * | -113 | 141.5 | 113.1 | -6.1 | 24.9 | 0 | 0 | 0 | 111.7 | |||||
| 166 | K | 47 | Very low | 42.9 | Very low | 203 Ų | 203 | 157.8 Ų | 157.8 | 88% | 0.883 | 84% | 0.84 | S | S | * | * | trans | -86 | 141.8 | 175.7 | -71.7 | -166.5 | 171.9 | -169 | 0 | 110.9 | ||||
| 167 | E | 37.1 | Very low | 43.4 | Very low | 185 Ų | 185 | 157 Ų | 157 | 86% | 0.864 | 84% | 0.836 | S | S | * | * | trans | 179.2 | 91.5 | 135.6 | -151.1 | 178.2 | 128.9 | 0 | 0 | 106.2 | ||||
| 168 | E | 44.2 | Very low | 43.7 | Very low | 189 Ų | 189 | 156.6 Ų | 156.6 | 88% | 0.883 | 83% | 0.834 | S | S | * | * | 61.8 | 93.3 | 93.1 | -154.4 | 174.7 | -175.8 | 0 | 0 | 115.1 | |||||
| 169 | A | 39.1 | Very low | 44.4 | Very low | 101 Ų | 101 | 158.7 Ų | 158.7 | 84% | 0.835 | 84% | 0.835 | S | S | * | * | trans | -168.7 | 128.4 | 141.7 | 0 | 0 | 0 | 0 | 0 | 109.7 | ||||
| 170 | E | 46.2 | Very low | 44.8 | Very low | 203 Ų | 203 | 153.2 Ų | 153.2 | 95% | 0.949 | 83% | 0.827 | S | S | * | * | trans | -61.8 | 138.6 | 178.9 | -67.8 | -173.5 | 110 | 0 | 0 | 113.8 | ||||
| 171 | A | 41.7 | Very low | 45.8 | Very low | 95 Ų | 95 | 153.7 Ų | 153.7 | 79% | 0.785 | 82% | 0.821 | S | S | * | * | trans | -178.2 | 114.9 | 132.3 | 0 | 0 | 0 | 0 | 0 | 110.6 | N173 | A171-N173 PolarHBondContact O-N 3.12Š| ||
| 172 | M | 39.8 | Very low | 47.2 | Very low | 173 Ų | 173 | 154.4 Ų | 154.4 | 85% | 0.852 | 82% | 0.818 | S | S | * | * | trans | 4.9 | 97.8 | 162.2 | -144.4 | 83 | -177.7 | 0 | 0 | 117.7 | ||||
| 173 | N | 44.7 | Very low | 48.8 | Very low | 140 Ų | 140 | 152.6 Ų | 152.6 | 75% | 0.749 | 82% | 0.817 | S | S | * | * | trans | -70 | 118.1 | 167.2 | 49.3 | -67.2 | 0 | 0 | 0 | 112.6 | A171 | A171-N173 PolarHBondContact O-N 3.12Š| ||
| 174 | N | 46.7 | Very low | 50.7 | Low | 142 Ų | 142 | 155 Ų | 155 | 76% | 0.759 | 82% | 0.815 | S | S | * | * | trans | -150.7 | 72 | 153.4 | -83.4 | -57.2 | 0 | 0 | 0 | 110.9 | ||||
| 175 | L | 48.4 | Very low | 52.7 | Low | 178 Ų | 178 | 159.3 Ų | 159.3 | 93% | 0.932 | 82% | 0.821 | S | S | * | * | trans | -106 | 87.9 | 166.2 | -68 | 176.5 | 0 | 0 | 0 | 109.5 | ||||
| 176 | K | 54.6 | Low | 54.7 | Low | 191 Ų | 191 | 161.4 Ų | 161.4 | 83% | 0.83 | 82% | 0.819 | S | S | * | * | P | Polyproline II helix | trans | -98.8 | 121.3 | 159.4 | -170.3 | 172 | -173.4 | 176.6 | 0 | 107.5 | ||
| 177 | P | 56.5 | Low | 56.4 | Low | 107 Ų | 107 | 156.8 Ų | 156.8 | 70% | 0.695 | 81% | 0.807 | S | S | * | * | P | Polyproline II helix | trans | -68.2 | 128.1 | 170.1 | 26.1 | -30.1 | 0 | 0 | 0 | 108.8 | Q179 | P177-Q179 PolarHBondContact O-N 3.04Š|
| 178 | P | 53.8 | Low | 58.5 | Low | 120 Ų | 120 | 154.1 Ų | 154.1 | 78% | 0.779 | 80% | 0.804 | S | S | * | * | P | Polyproline II helix | trans | -67.8 | 119.3 | 172.6 | 25.4 | -29.9 | 0 | 0 | 0 | 109 | A180 | P178-A180 VanDerWaalsContact C-N 3.28Å; P178-A180 PolarHBondContact O-N 3.4Å |
| 179 | Q | 52.4 | Low | 59.7 | Low | 172 Ų | 172 | 155.5 Ų | 155.5 | 80% | 0.804 | 80% | 0.801 | S | S | * | * | trans | -64.7 | 89.2 | 166.6 | -80 | -163.7 | -3.1 | 0 | 0 | 109.1 | P177 K181 | P177-Q179 PolarHBondContact O-N 3.04Å; Q179-K181 VanDerWaalsContact C-N 3.32Å; Q179-K181 PolarHBondContact O-N 3.04Å; Q179-K181 VanDerWaalsContact O-N 3.07Å | ||
| 180 | A | 56.5 | Low | 61.2 | Low | 82 Ų | 82 | 159.8 Ų | 159.8 | 68% | 0.678 | 82% | 0.82 | S | S | * | * | trans | -81.4 | 78.4 | 171.8 | 0 | 0 | 0 | 0 | 0 | 110 | P178 R182 | P178-A180 VanDerWaalsContact C-N 3.28Å; P178-A180 PolarHBondContact O-N 3.4Å; A180-R182 VanDerWaalsContact C-N 3.32Å; A180-R182 PolarHBondContact O-N 3.07Å | ||
| 181 | K | 62.5 | Low | 62 | Low | 187 Ų | 187 | 157.7 Ų | 157.7 | 81% | 0.813 | 81% | 0.814 | S | S | * | * | trans | -73.2 | 90 | 163.4 | -73.6 | -171.3 | 177.7 | 179.6 | 0 | 108.4 | Q179 K183 | Q179-K181 VanDerWaalsContact C-N 3.32Å; Q179-K181 PolarHBondContact O-N 3.04Å; Q179-K181 VanDerWaalsContact O-N 3.07Å; K181-K183 PolarHBondContact O-N 2.88Å | ||
| 182 | R | 73.4 | Confident | 63 | Low | 224 Ų | 224 | 160.9 Ų | 160.9 | 85% | 0.845 | 82% | 0.815 | S | S | * | * | trans | -78.7 | 113.5 | 171.3 | -63.3 | -178.9 | 70.4 | 164.9 | 1.1 | 108.4 | A180 I184 | A180-R182 VanDerWaalsContact C-N 3.32Å; A180-R182 PolarHBondContact O-N 3.07Å; R182-I184 PolarHBondContact O-N 3.22Å | ||
| 183 | K | 74.2 | Confident | 64.3 | Low | 198 Ų | 198 | 160.3 Ų | 160.3 | 86% | 0.861 | 81% | 0.813 | S | S | * | * | trans | -62.8 | 115 | 168.1 | -174.3 | 92.2 | 163.4 | -174.1 | 0 | 107.3 | K181 Q185 | K181-K183 PolarHBondContact O-N 2.88Å; K183-Q185 PolarHBondContact O-N 3.35Å | ||
| 184 | I | 75.7 | Confident | 65.5 | Low | 145 Ų | 145 | 161.5 Ų | 161.5 | 74% | 0.744 | 82% | 0.817 | S | S | * | * | P | Polyproline II helix | trans | -70.3 | 121.6 | 175 | -61.2 | 169.6 | 0 | 0 | 0 | 106.9 | R182 | R182-I184 PolarHBondContact O-N 3.22Š|
| 185 | Q | 76.6 | Confident | 66.7 | Low | 174 Ų | 174 | 162.7 Ų | 162.7 | 81% | 0.813 | 82% | 0.821 | S | S | * | * | P | Polyproline II helix | trans | -75.7 | 128.7 | 172.7 | -68.9 | -173.7 | 8.3 | 0 | 0 | 108.7 | K183 | K183-Q185 PolarHBondContact O-N 3.35Š|
| 186 | H | 78.4 | Confident | 67.9 | Low | 181 Ų | 181 | 161.7 Ų | 161.7 | 84% | 0.838 | 81% | 0.813 | S | S | * | * | P | Polyproline II helix | trans | -79.5 | 117.8 | 170.7 | -86.6 | -108.1 | 0 | 0 | 0 | 108.7 | ||
| 187 | V | 82.1 | Confident | 68.8 | Low | 106 Ų | 106 | 159.6 Ų | 159.6 | 64% | 0.642 | 81% | 0.812 | S | S | * | * | P | Polyproline II helix | trans | -86.9 | 128.3 | 170.9 | 179.9 | 0 | 0 | 0 | 0 | 107.8 | W189 | V187-W189 HydrophobicContact CG1-CZ2 4.38Š|
| 188 | T | 81.8 | Confident | 69.8 | Low | 129 Ų | 129 | 163.6 Ų | 163.6 | 79% | 0.791 | 82% | 0.821 | S | S | * | * | trans | -107.6 | 130.8 | 171.1 | -50.7 | 0 | 0 | 0 | 0 | 107.5 | ||||
| 189 | W | 68.6 | Low | 71.1 | Confident | 217 Ų | 217 | 167.3 Ų | 167.3 | 82% | 0.822 | 83% | 0.825 | S | S | * | * | trans | -90 | 147.6 | 178.4 | -64.1 | 105.3 | 0 | 0 | 0 | 110.8 | V187 | V187-W189 HydrophobicContact CG1-CZ2 4.38Š| ||
| 190 | P | 71.2 | Confident | 72.8 | Confident | 192 Ų | 192 | 166.8 Ų | 166.8 | 100% | 1.247 | 83% | 0.827 | S | S | * | * | trans | -69.9 | 0 | 176.6 | 30.7 | -35 | 0 | 0 | 0 | 113.2 |
Retrieved 190 of 190 residues in 583 ms
(Link to these results)