| 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 | 59 | Low | 79.1 | Confident | 216 Ų | 216 | 125.5 Ų | 125.5 | 100% | 1.064 | 63% | 0.631 | S | S | * | * | 0 | -36.7 | 0 | -71.7 | -170.3 | 168.6 | 0 | 0 | 113.9 | I3 | M1-I3 PolarHBondContact O-N 3.3Š| |||
| 2 | Q | 69.9 | Low | 79.9 | Confident | 161 Ų | 161 | 123.6 Ų | 123.6 | 75% | 0.752 | 62% | 0.622 | S | S | * | * | H | α-helix | trans | -68 | -31.1 | -177.3 | -72.4 | 175.5 | -19.6 | 0 | 0 | 115.7 | H4 S5 M6 | Q2-H4 VanDerWaalsContact C-N 3.31Å; Q2-H4 PolarHBondContact O-N 3.33Å; Q2-S5 PolarHBondContact O-N 3.48Å; Q2-S5 PolarHBondContact O-OG 3.02Å; Q2-M6 PolarHBondContact O-N 3.5Å |
| 3 | I | 73.7 | Confident | 80.6 | Confident | 135 Ų | 135 | 120.7 Ų | 120.7 | 69% | 0.692 | 61% | 0.608 | S | S | * | * | H | α-helix | trans | -63.1 | -40.7 | -178.6 | -61.2 | 166.9 | 0 | 0 | 0 | 110.7 | M1 S5 M6 T7 | M1-I3 PolarHBondContact O-N 3.3Å; I3-S5 PolarHBondContact O-N 3.03Å; I3-M6 PolarHBondContact O-N 3.38Å; I3-T7 PolarHBondContact O-N 3.08Å; I3-T7 VanDerWaalsContact O-N 3.08Å; I3-T7 PolarHBondContact O-OG1 3.06Å |
| 4 | H | 73.8 | Confident | 81.2 | Confident | 136 Ų | 136 | 119.4 Ų | 119.4 | 63% | 0.63 | 60% | 0.603 | S | S | * | * | H | α-helix | trans | -66.9 | -33.5 | 178.9 | -61.8 | -60.8 | 0 | 0 | 0 | 113 | Q2 T7 M8 | Q2-H4 VanDerWaalsContact C-N 3.31Å; Q2-H4 PolarHBondContact O-N 3.33Å; H4-T7 WeakPolarHBondContact CA-OG1 3.2Å; H4-T7 PolarHBondContact O-OG1 3.44Å; H4-M8 WeakPolarHBondContact O-CB 3.42Å; H4-M8 WeakPolarHBondContact O-CG 3.25Å; H4-M8 PolarHBondContact O-N 3.45Å |
| 5 | S | 81.9 | Confident | 81.6 | Confident | 70 Ų | 70 | 114.8 Ų | 114.8 | 49% | 0.49 | 59% | 0.585 | S | S | . | * | H | α-helix | trans | -68.7 | -38.9 | 176.8 | 65.3 | 0 | 0 | 0 | 0 | 111.4 | Q2 I3 M8 F9 | Q2-S5 PolarHBondContact O-N 3.48Å; Q2-S5 PolarHBondContact O-OG 3.02Å; I3-S5 PolarHBondContact O-N 3.03Å; S5-M8 PolarHBondContact O-N 3.24Å; S5-F9 WeakPolarHBondContact O-CB 3.43Å; S5-F9 PolarHBondContact O-N 2.86Å |
| 6 | M | 78.1 | Confident | 81.7 | Confident | 131 Ų | 131 | 112.7 Ų | 112.7 | 65% | 0.645 | 58% | 0.579 | S | S | * | * | H | α-helix | trans | -67.7 | -42.3 | 177.9 | -63.6 | -60.3 | -100.4 | 0 | 0 | 111.8 | Q2 I3 F9 T10 | Q2-M6 PolarHBondContact O-N 3.5Å; I3-M6 PolarHBondContact O-N 3.38Å; M6-F9 PolarHBondContact O-N 3.48Å; M6-T10 PolarHBondContact O-N 3.03Å; M6-T10 PolarHBondContact O-OG1 3.03Å |
| 7 | T | 86.9 | Confident | 81.8 | Confident | 73 Ų | 73 | 114.4 Ų | 114.4 | 45% | 0.448 | 58% | 0.582 | S | S | . | * | H | α-helix | trans | -67 | -36.5 | 177 | 54.1 | 0 | 0 | 0 | 0 | 112.8 | I3 H4 F9 T10 F11 | I3-T7 PolarHBondContact O-N 3.08Å; I3-T7 VanDerWaalsContact O-N 3.08Å; I3-T7 PolarHBondContact O-OG1 3.06Å; H4-T7 WeakPolarHBondContact CA-OG1 3.2Å; H4-T7 PolarHBondContact O-OG1 3.44Å; T7-F9 VanDerWaalsContact C-N 3.35Å; T7-T10 PolarHBondContact O-OG1 3.26Å; T7-T10 VanDerWaalsContact O-OG1 3.06Å; T7-F11 WeakPolarHBondContact O-CB 3.45Å; T7-F11 PolarHBondContact O-N 3.32Å |
| 8 | M | 83.8 | Confident | 81.8 | Confident | 125 Ų | 125 | 114.1 Ų | 114.1 | 62% | 0.616 | 58% | 0.581 | S | S | * | * | H | α-helix | trans | -66.4 | -39.9 | 174.6 | -73.1 | -65.9 | -161.1 | 0 | 0 | 111.2 | H4 S5 F11 I12 | H4-M8 WeakPolarHBondContact O-CB 3.42Å; H4-M8 WeakPolarHBondContact O-CG 3.25Å; H4-M8 PolarHBondContact O-N 3.45Å; S5-M8 PolarHBondContact O-N 3.24Å; M8-F11 PolarHBondContact O-N 3.08Å; M8-I12 WeakPolarHBondContact O-CD1 3.33Å; M8-I12 VanDerWaalsContact O-CG1 3.25Å; M8-I12 WeakPolarHBondContact O-CG1 3.38Å; M8-I12 PolarHBondContact O-N 3.06Å |
| 9 | F | 85.9 | Confident | 81.6 | Confident | 127 Ų | 127 | 113 Ų | 113 | 56% | 0.557 | 58% | 0.58 | S | S | * | * | H | α-helix | trans | -64.3 | -45.9 | 178 | -176.1 | -107.5 | 0 | 0 | 0 | 112.4 | S5 M6 T7 F11 I12 I13 | S5-F9 WeakPolarHBondContact O-CB 3.43Å; S5-F9 PolarHBondContact O-N 2.86Å; M6-F9 PolarHBondContact O-N 3.48Å; T7-F9 VanDerWaalsContact C-N 3.35Å; F9-F11 VanDerWaalsContact C-N 3.35Å; F9-F11 PolarHBondContact O-N 3.33Å; F9-I12 PolarHBondContact O-N 2.97Å; F9-I13 HydrophobicContact CD1-CD1 3.79Å; F9-I13 HydrophobicContact CE1-CD1 3.33Å; F9-I13 HydrophobicContact CE1-CG1 4.41Å; F9-I13 HydrophobicContact CE2-CD1 4.4Å; F9-I13 HydrophobicContact CZ-CD1 3.69Å; F9-I13 HydrophobicContact CZ-CG1 4.46Å; F9-I13 WeakPolarHBondContact O-CG1 3.47Å; F9-I13 PolarHBondContact O-N 3.31Å; F9-I13 VanDerWaalsContact O-N 3.08Å |
| 10 | T | 87.7 | Confident | 81.2 | Confident | 78 Ų | 78 | 114 Ų | 114 | 48% | 0.479 | 58% | 0.58 | S | S | . | * | H | α-helix | trans | -66.1 | -37.1 | 177.1 | 55 | 0 | 0 | 0 | 0 | 112.4 | M6 T7 I13 L14 | M6-T10 PolarHBondContact O-N 3.03Å; M6-T10 PolarHBondContact O-OG1 3.03Å; T7-T10 PolarHBondContact O-OG1 3.26Å; T7-T10 VanDerWaalsContact O-OG1 3.06Å; T10-I13 PolarHBondContact O-N 3.06Å; T10-L14 WeakPolarHBondContact O-CG 3.37Å; T10-L14 PolarHBondContact O-N 3.3Å |
| 11 | F | 89.2 | Confident | 80.6 | Confident | 129 Ų | 129 | 112.2 Ų | 112.2 | 57% | 0.566 | 57% | 0.572 | S | S | * | * | H | α-helix | trans | -60.7 | -44.8 | 174 | -178.1 | -102.1 | 0 | 0 | 0 | 111.8 | T7 M8 F9 I13 L14 C15 | T7-F11 WeakPolarHBondContact O-CB 3.45Å; T7-F11 PolarHBondContact O-N 3.32Å; M8-F11 PolarHBondContact O-N 3.08Å; F9-F11 VanDerWaalsContact C-N 3.35Å; F9-F11 PolarHBondContact O-N 3.33Å; F11-I13 PolarHBondContact O-N 3.27Å; F11-L14 PolarHBondContact O-N 3.46Å; F11-C15 VanDerWaalsContact CE1-SG 3.6Å; F11-C15 PolarHBondContact O-N 2.9Å; F11-C15 PolarHBondContact O-SG 3.45Å; F11-C15 VanDerWaalsContact O-SG 3.33Å |
| 12 | I | 89.4 | Confident | 80.9 | Confident | 102 Ų | 102 | 108.1 Ų | 108.1 | 52% | 0.523 | 55% | 0.554 | S | S | . | * | H | α-helix | trans | -61.2 | -44.3 | 176.5 | -68 | 163.5 | 0 | 0 | 0 | 111 | M8 F9 L14 C15 V16 | M8-I12 WeakPolarHBondContact O-CD1 3.33Å; M8-I12 VanDerWaalsContact O-CG1 3.25Å; M8-I12 WeakPolarHBondContact O-CG1 3.38Å; M8-I12 PolarHBondContact O-N 3.06Å; F9-I12 PolarHBondContact O-N 2.97Å; I12-L14 VanDerWaalsContact C-N 3.34Å; I12-L14 PolarHBondContact O-N 3.32Å; I12-C15 PolarHBondContact O-N 2.63Å; I12-V16 WeakPolarHBondContact O-CG2 3.48Å; I12-V16 PolarHBondContact O-N 3.45Å |
| 13 | I | 88.8 | Confident | 80.8 | Confident | 86 Ų | 86 | 106.3 Ų | 106.3 | 44% | 0.441 | 54% | 0.543 | S | S | . | . | H | α-helix | trans | -59.9 | -45.4 | 177.1 | -69.1 | 172.4 | 0 | 0 | 0 | 110.9 | F9 T10 F11 V16 F17 | F9-I13 HydrophobicContact CD1-CD1 3.79Å; F9-I13 HydrophobicContact CE1-CD1 3.33Å; F9-I13 HydrophobicContact CE1-CG1 4.41Å; F9-I13 HydrophobicContact CE2-CD1 4.4Å; F9-I13 HydrophobicContact CZ-CD1 3.69Å; F9-I13 HydrophobicContact CZ-CG1 4.46Å; F9-I13 WeakPolarHBondContact O-CG1 3.47Å; F9-I13 PolarHBondContact O-N 3.31Å; F9-I13 VanDerWaalsContact O-N 3.08Å; T10-I13 PolarHBondContact O-N 3.06Å; F11-I13 PolarHBondContact O-N 3.27Å; I13-V16 PolarHBondContact O-N 2.93Å; I13-F17 PolarHBondContact O-N 2.88Å |
| 14 | L | 88.7 | Confident | 80.4 | Confident | 103 Ų | 103 | 104 Ų | 104 | 54% | 0.539 | 53% | 0.531 | S | S | . | . | H | α-helix | trans | -61.8 | -43.7 | 176.8 | -77.1 | 168.9 | 0 | 0 | 0 | 111.9 | T10 F11 I12 V16 F17 I18 | T10-L14 WeakPolarHBondContact O-CG 3.37Å; T10-L14 PolarHBondContact O-N 3.3Å; F11-L14 PolarHBondContact O-N 3.46Å; I12-L14 VanDerWaalsContact C-N 3.34Å; I12-L14 PolarHBondContact O-N 3.32Å; L14-V16 PolarHBondContact O-N 3.27Å; L14-F17 PolarHBondContact O-N 3.46Å; L14-I18 VanDerWaalsContact O-CG1 3.27Å; L14-I18 WeakPolarHBondContact O-CG1 3.27Å; L14-I18 PolarHBondContact O-N 3.29Å |
| 15 | C | 87.6 | Confident | 80 | Confident | 50 Ų | 50 | 102.1 Ų | 102.1 | 34% | 0.338 | 53% | 0.526 | S | S | . | . | H | α-helix | trans | -60.3 | -45.1 | 176.5 | -72.5 | 0 | 0 | 0 | 0 | 111.8 | F11 I12 F17 I18 T19 | F11-C15 VanDerWaalsContact CE1-SG 3.6Å; F11-C15 PolarHBondContact O-N 2.9Å; F11-C15 PolarHBondContact O-SG 3.45Å; F11-C15 VanDerWaalsContact O-SG 3.33Å; I12-C15 PolarHBondContact O-N 2.63Å; C15-F17 VanDerWaalsContact C-N 3.33Å; C15-F17 PolarHBondContact O-N 2.96Å; C15-I18 PolarHBondContact O-N 3.47Å; C15-T19 WeakPolarHBondContact O-CB 3.39Å; C15-T19 PolarHBondContact O-N 3.35Å; C15-T19 PolarHBondContact O-OG1 2.91Å |
| 16 | V | 83.5 | Confident | 79.1 | Confident | 81 Ų | 81 | 100.6 Ų | 100.6 | 49% | 0.491 | 52% | 0.522 | S | S | . | . | H | α-helix | trans | -61.2 | -43.3 | 176.6 | 173.6 | 0 | 0 | 0 | 0 | 110.7 | I12 I13 L14 T19 K20 | I12-V16 WeakPolarHBondContact O-CG2 3.48Å; I12-V16 PolarHBondContact O-N 3.45Å; I13-V16 PolarHBondContact O-N 2.93Å; L14-V16 PolarHBondContact O-N 3.27Å; V16-T19 PolarHBondContact O-N 2.85Å; V16-K20 HydrophobicContact CG1-CG 4.34Å; V16-K20 WeakPolarHBondContact O-CB 3.49Å; V16-K20 VanDerWaalsContact O-CG 3.25Å; V16-K20 WeakPolarHBondContact O-CG 3.25Å; V16-K20 PolarHBondContact O-N 3.01Å |
| 17 | F | 82.1 | Confident | 78.5 | Confident | 141 Ų | 141 | 99.2 Ų | 99.2 | 62% | 0.618 | 51% | 0.514 | S | S | * | . | H | α-helix | trans | -64.7 | -44.9 | -179.9 | -145.4 | -90.3 | 0 | 0 | 0 | 112.4 | I13 L14 C15 K20 N21 | I13-F17 PolarHBondContact O-N 2.88Å; L14-F17 PolarHBondContact O-N 3.46Å; C15-F17 VanDerWaalsContact C-N 3.33Å; C15-F17 PolarHBondContact O-N 2.96Å; F17-K20 PolarHBondContact O-N 2.99Å; F17-N21 WeakPolarHBondContact O-CB 3.38Å; F17-N21 PolarHBondContact O-N 2.84Å |
| 18 | I | 81.7 | Confident | 77.3 | Confident | 110 Ų | 110 | 99.8 Ų | 99.8 | 56% | 0.564 | 51% | 0.514 | S | S | * | . | H | α-helix | trans | -64.1 | -43.2 | 177.2 | -66.5 | 165.1 | 0 | 0 | 0 | 110.5 | L14 C15 N21 L22 | L14-I18 VanDerWaalsContact O-CG1 3.27Å; L14-I18 WeakPolarHBondContact O-CG1 3.27Å; L14-I18 PolarHBondContact O-N 3.29Å; C15-I18 PolarHBondContact O-N 3.47Å; I18-N21 PolarHBondContact O-N 3.12Å; I18-L22 WeakPolarHBondContact O-CB 3.42Å; I18-L22 PolarHBondContact O-N 3.4Å |
| 19 | T | 78.4 | Confident | 76.4 | Confident | 93 Ų | 93 | 96.2 Ų | 96.2 | 57% | 0.571 | 50% | 0.504 | S | S | * | . | H | α-helix | trans | -67.7 | -40.1 | -177.5 | -47.1 | 0 | 0 | 0 | 0 | 111.1 | C15 V16 F23 | C15-T19 WeakPolarHBondContact O-CB 3.39Å; C15-T19 PolarHBondContact O-N 3.35Å; C15-T19 PolarHBondContact O-OG1 2.91Å; V16-T19 PolarHBondContact O-N 2.85Å; T19-F23 WeakPolarHBondContact O-CB 3.13Å; T19-F23 PolarHBondContact O-N 3.35Å |
| 20 | K | 73.8 | Confident | 75.2 | Confident | 133 Ų | 133 | 96.2 Ų | 96.2 | 58% | 0.578 | 51% | 0.506 | S | S | * | . | H | α-helix | trans | -65.4 | -42.9 | 175.3 | -70.5 | -69.9 | -177.4 | -179.1 | 0 | 111.5 | V16 F17 F23 I24 | V16-K20 HydrophobicContact CG1-CG 4.34Å; V16-K20 WeakPolarHBondContact O-CB 3.49Å; V16-K20 VanDerWaalsContact O-CG 3.25Å; V16-K20 WeakPolarHBondContact O-CG 3.25Å; V16-K20 PolarHBondContact O-N 3.01Å; F17-K20 PolarHBondContact O-N 2.99Å; K20-F23 PolarHBondContact O-N 3.25Å; K20-I24 WeakPolarHBondContact O-CB 3.35Å; K20-I24 WeakPolarHBondContact O-CD1 3.18Å; K20-I24 WeakPolarHBondContact O-CG1 3.16Å; K20-I24 PolarHBondContact O-N 2.91Å |
| 21 | N | 69.7 | Low | 73.8 | Confident | 76 Ų | 76 | 99.3 Ų | 99.3 | 41% | 0.406 | 51% | 0.51 | S | S | . | . | H | α-helix | trans | -64.5 | -45.2 | 175.3 | -90.4 | -20.7 | 0 | 0 | 0 | 112.3 | F17 I18 F23 I24 N25 | F17-N21 WeakPolarHBondContact O-CB 3.38Å; F17-N21 PolarHBondContact O-N 2.84Å; I18-N21 PolarHBondContact O-N 3.12Å; N21-F23 VanDerWaalsContact C-N 3.34Å; N21-F23 PolarHBondContact O-N 2.96Å; N21-I24 PolarHBondContact O-N 2.79Å; N21-N25 WeakPolarHBondContact O-CB 3.34Å; N21-N25 PolarHBondContact O-N 3.37Å; N21-N25 PolarHBondContact O-ND2 3.38Å; N21-N25 VanDerWaalsContact O-ND2 3.1Å |
| 22 | L | 65.3 | Low | 72.4 | Confident | 131 Ų | 131 | 99.8 Ų | 99.8 | 69% | 0.686 | 51% | 0.509 | S | S | * | . | H | α-helix | trans | -65.6 | -39 | 179.4 | -159.5 | 102.5 | 0 | 0 | 0 | 111.6 | I18 G26 | I18-L22 WeakPolarHBondContact O-CB 3.42Å; I18-L22 PolarHBondContact O-N 3.4Å; L22-G26 WeakPolarHBondContact O-CA 3.26Å; L22-G26 PolarHBondContact O-N 3.5Å |
| 23 | F | 67.5 | Low | 71 | Confident | 122 Ų | 122 | 101.1 Ų | 101.1 | 54% | 0.535 | 51% | 0.514 | S | S | . | . | H | α-helix | trans | -67.5 | -44.9 | 177.1 | -171.9 | -99.1 | 0 | 0 | 0 | 111.8 | T19 K20 N21 G26 Q27 | T19-F23 WeakPolarHBondContact O-CB 3.13Å; T19-F23 PolarHBondContact O-N 3.35Å; K20-F23 PolarHBondContact O-N 3.25Å; N21-F23 VanDerWaalsContact C-N 3.34Å; N21-F23 PolarHBondContact O-N 2.96Å; F23-G26 PolarHBondContact O-N 2.91Å; F23-Q27 HydrophobicContact CD1-CG 4.4Å; F23-Q27 HydrophobicContact CE1-CG 4.15Å; F23-Q27 HydrophobicContact CZ-CG 4.28Å; F23-Q27 WeakPolarHBondContact O-CB 3.49Å; F23-Q27 WeakPolarHBondContact O-CG 3.43Å; F23-Q27 PolarHBondContact O-N 2.81Å |
| 24 | I | 64.6 | Low | 69.4 | Low | 86 Ų | 86 | 101.8 Ų | 101.8 | 44% | 0.441 | 52% | 0.519 | S | S | . | . | H | α-helix | trans | -63.4 | -47.4 | 175.8 | -68 | 165.6 | 0 | 0 | 0 | 109.9 | K20 N21 G26 Q27 L28 | K20-I24 WeakPolarHBondContact O-CB 3.35Å; K20-I24 WeakPolarHBondContact O-CD1 3.18Å; K20-I24 WeakPolarHBondContact O-CG1 3.16Å; K20-I24 PolarHBondContact O-N 2.91Å; N21-I24 PolarHBondContact O-N 2.79Å; I24-G26 VanDerWaalsContact C-N 3.34Å; I24-G26 PolarHBondContact O-N 3.42Å; I24-Q27 PolarHBondContact O-N 3.44Å; I24-L28 HydrophobicContact CG2-CD1 4.25Å; I24-L28 WeakPolarHBondContact O-CB 3.41Å; I24-L28 PolarHBondContact O-N 2.92Å |
| 25 | N | 64.7 | Low | 67.7 | Low | 97 Ų | 97 | 101 Ų | 101 | 52% | 0.519 | 52% | 0.515 | S | S | . | . | H | α-helix | trans | -66 | -35.2 | 179.3 | -69.1 | -25.9 | 0 | 0 | 0 | 112.5 | N21 A29 | N21-N25 WeakPolarHBondContact O-CB 3.34Å; N21-N25 PolarHBondContact O-N 3.37Å; N21-N25 PolarHBondContact O-ND2 3.38Å; N21-N25 VanDerWaalsContact O-ND2 3.1Å; N25-A29 VanDerWaalsContact O-CB 3.23Å; N25-A29 WeakPolarHBondContact O-CB 3.31Å; N25-A29 PolarHBondContact O-N 3.49Å |
| 26 | G | 63.5 | Low | 66 | Low | 39 Ų | 39 | 105.9 Ų | 105.9 | 40% | 0.402 | 53% | 0.533 | S | S | . | . | H | α-helix | trans | -68.3 | -44 | 175.8 | 0 | 0 | 0 | 0 | 0 | 112 | L22 F23 I24 A29 E30 | L22-G26 WeakPolarHBondContact O-CA 3.26Å; L22-G26 PolarHBondContact O-N 3.5Å; F23-G26 PolarHBondContact O-N 2.91Å; I24-G26 VanDerWaalsContact C-N 3.34Å; I24-G26 PolarHBondContact O-N 3.42Å; G26-A29 PolarHBondContact O-N 3.44Å; G26-E30 WeakPolarHBondContact O-CB 3.35Å; G26-E30 PolarHBondContact O-N 2.82Å |
| 27 | Q | 65.3 | Low | 64.4 | Low | 101 Ų | 101 | 107.2 Ų | 107.2 | 47% | 0.472 | 54% | 0.536 | S | S | . | . | H | α-helix | trans | -66 | -38.7 | 173.5 | -73.9 | -169.7 | -28.5 | 0 | 0 | 112.1 | F23 I24 E30 Y31 | F23-Q27 HydrophobicContact CD1-CG 4.4Å; F23-Q27 HydrophobicContact CE1-CG 4.15Å; F23-Q27 HydrophobicContact CZ-CG 4.28Å; F23-Q27 WeakPolarHBondContact O-CB 3.49Å; F23-Q27 WeakPolarHBondContact O-CG 3.43Å; F23-Q27 PolarHBondContact O-N 2.81Å; I24-Q27 PolarHBondContact O-N 3.44Å; Q27-E30 PolarHBondContact O-N 3.03Å; Q27-Y31 WeakPolarHBondContact O-CB 3.19Å; Q27-Y31 PolarHBondContact O-N 2.84Å |
| 28 | L | 61.9 | Low | 62.7 | Low | 85 Ų | 85 | 104.9 Ų | 104.9 | 45% | 0.445 | 54% | 0.535 | S | S | . | . | H | α-helix | trans | -62.3 | -49.3 | 173.5 | -129.4 | 107.5 | 0 | 0 | 0 | 110 | I24 E30 Y31 Y32 | I24-L28 HydrophobicContact CG2-CD1 4.25Å; I24-L28 WeakPolarHBondContact O-CB 3.41Å; I24-L28 PolarHBondContact O-N 2.92Å; L28-E30 VanDerWaalsContact C-N 3.28Å; L28-E30 PolarHBondContact O-N 2.77Å; L28-Y31 WeakPolarHBondContact O-CB 3.41Å; L28-Y31 PolarHBondContact O-N 2.91Å; L28-Y31 VanDerWaalsContact O-N 3.12Å; L28-Y32 HydrophobicContact CB-CD2 4.44Å; L28-Y32 HydrophobicContact CD2-CD2 3.74Å; L28-Y32 HydrophobicContact CD2-CE2 3.32Å; L28-Y32 HydrophobicContact CG-CD2 3.99Å; L28-Y32 HydrophobicContact CG-CE2 3.71Å; L28-Y32 WeakPolarHBondContact O-CD2 3.2Å; L28-Y32 PolarHBondContact O-N 3.48Å |
| 29 | A | 65.8 | Low | 61.3 | Low | 50 Ų | 50 | 107.3 Ų | 107.3 | 41% | 0.413 | 54% | 0.544 | S | S | . | . | H | α-helix | trans | -59.4 | -40.8 | 178.6 | 0 | 0 | 0 | 0 | 0 | 111.5 | N25 G26 M33 | N25-A29 VanDerWaalsContact O-CB 3.23Å; N25-A29 WeakPolarHBondContact O-CB 3.31Å; N25-A29 PolarHBondContact O-N 3.49Å; G26-A29 PolarHBondContact O-N 3.44Å; A29-M33 WeakPolarHBondContact O-CB 3.29Å; A29-M33 WeakPolarHBondContact O-CG 3.06Å; A29-M33 PolarHBondContact O-N 3.1Å |
| 30 | E | 59.5 | Low | 59.9 | Low | 127 Ų | 127 | 107.9 Ų | 107.9 | 59% | 0.593 | 55% | 0.547 | S | S | * | . | H | α-helix | trans | -65.5 | -42.1 | 174.3 | -173.5 | 171.3 | -164.1 | 0 | 0 | 111.8 | G26 Q27 L28 N34 | G26-E30 WeakPolarHBondContact O-CB 3.35Å; G26-E30 PolarHBondContact O-N 2.82Å; Q27-E30 PolarHBondContact O-N 3.03Å; L28-E30 VanDerWaalsContact C-N 3.28Å; L28-E30 PolarHBondContact O-N 2.77Å; E30-N34 VanDerWaalsContact CG-ND2 3.31Å; E30-N34 WeakPolarHBondContact CG-ND2 3.23Å; E30-N34 VanDerWaalsContact O-CB 3.29Å; E30-N34 WeakPolarHBondContact O-CB 3.14Å; E30-N34 VanDerWaalsContact O-CG 3.24Å; E30-N34 PolarHBondContact O-N 3.43Å; E30-N34 PolarHBondContact O-ND2 3.36Å |
| 31 | Y | 59.2 | Low | 58.6 | Low | 144 Ų | 144 | 107 Ų | 107 | 57% | 0.565 | 55% | 0.549 | S | S | * | . | H | α-helix | trans | -61.1 | -49.7 | 175.5 | -174 | -88.8 | 0 | 0 | 0 | 111.6 | Q27 L28 N34 D35 | Q27-Y31 WeakPolarHBondContact O-CB 3.19Å; Q27-Y31 PolarHBondContact O-N 2.84Å; L28-Y31 WeakPolarHBondContact O-CB 3.41Å; L28-Y31 PolarHBondContact O-N 2.91Å; L28-Y31 VanDerWaalsContact O-N 3.12Å; Y31-N34 PolarHBondContact O-N 3.12Å; Y31-D35 WeakPolarHBondContact CE1-OD2 3.45Å; Y31-D35 WeakPolarHBondContact O-CB 3.33Å; Y31-D35 PolarHBondContact O-N 3.48Å; Y31-D35 PolarHBondContact OH-OD2 3.45Å |
| 32 | Y | 58.9 | Low | 57.6 | Low | 138 Ų | 138 | 111.3 Ų | 111.3 | 54% | 0.541 | 56% | 0.564 | S | S | . | * | H | α-helix | trans | -69.6 | -38.6 | 179.9 | -78.8 | -76.1 | 0 | 0 | 0 | 113.2 | L28 N34 D35 E36 | L28-Y32 HydrophobicContact CB-CD2 4.44Å; L28-Y32 HydrophobicContact CD2-CD2 3.74Å; L28-Y32 HydrophobicContact CD2-CE2 3.32Å; L28-Y32 HydrophobicContact CG-CD2 3.99Å; L28-Y32 HydrophobicContact CG-CE2 3.71Å; L28-Y32 WeakPolarHBondContact O-CD2 3.2Å; L28-Y32 PolarHBondContact O-N 3.48Å; Y32-N34 VanDerWaalsContact C-N 3.32Å; Y32-N34 PolarHBondContact O-N 2.87Å; Y32-D35 PolarHBondContact O-N 2.82Å; Y32-E36 WeakPolarHBondContact O-CB 3.47Å; Y32-E36 PolarHBondContact O-N 2.83Å |
| 33 | M | 61.3 | Low | 56.5 | Low | 131 Ų | 131 | 113.6 Ų | 113.6 | 65% | 0.645 | 57% | 0.565 | S | S | * | * | H | α-helix | trans | -69 | -31.3 | 177.4 | -72.4 | -76.9 | 172.7 | 0 | 0 | 112.4 | A29 | A29-M33 WeakPolarHBondContact O-CB 3.29Å; A29-M33 WeakPolarHBondContact O-CG 3.06Å; A29-M33 PolarHBondContact O-N 3.1Å |
| 34 | N | 54.8 | Low | 55.5 | Low | 100 Ų | 100 | 112.7 Ų | 112.7 | 54% | 0.535 | 57% | 0.566 | S | S | . | * | H | α-helix | trans | -79.2 | -34.1 | 175.6 | -71.9 | -49 | 0 | 0 | 0 | 112.1 | E30 Y31 Y32 | E30-N34 VanDerWaalsContact CG-ND2 3.31Å; E30-N34 WeakPolarHBondContact CG-ND2 3.23Å; E30-N34 VanDerWaalsContact O-CB 3.29Å; E30-N34 WeakPolarHBondContact O-CB 3.14Å; E30-N34 VanDerWaalsContact O-CG 3.24Å; E30-N34 PolarHBondContact O-N 3.43Å; E30-N34 PolarHBondContact O-ND2 3.36Å; Y31-N34 PolarHBondContact O-N 3.12Å; Y32-N34 VanDerWaalsContact C-N 3.32Å; Y32-N34 PolarHBondContact O-N 2.87Å |
| 35 | D | 52.6 | Low | 54.8 | Low | 87 Ų | 87 | 115.6 Ų | 115.6 | 47% | 0.465 | 58% | 0.582 | S | S | . | * | H | α-helix | trans | -76.1 | -23.1 | 177.5 | -81.7 | -0.4 | 0 | 0 | 0 | 113.2 | Y31 Y32 I37 P38 | Y31-D35 WeakPolarHBondContact CE1-OD2 3.45Å; Y31-D35 WeakPolarHBondContact O-CB 3.33Å; Y31-D35 PolarHBondContact O-N 3.48Å; Y31-D35 PolarHBondContact OH-OD2 3.45Å; Y32-D35 PolarHBondContact O-N 2.82Å; D35-I37 PolarHBondContact O-N 3Å; D35-P38 WeakPolarHBondContact O-CD 3.39Å |
| 36 | E | 51.2 | Low | 54.2 | Low | 151 Ų | 151 | 116.2 Ų | 116.2 | 71% | 0.706 | 58% | 0.584 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -77 | 2.4 | 174.5 | -85.3 | -172 | 172.8 | 0 | 0 | 114.8 | Y32 P38 | Y32-E36 WeakPolarHBondContact O-CB 3.47Å; Y32-E36 PolarHBondContact O-N 2.83Å; E36-P38 WeakPolarHBondContact O-CD 2.98Å |
| 37 | I | 50.6 | Low | 53 | Low | 109 Ų | 109 | 122.9 Ų | 122.9 | 56% | 0.559 | 60% | 0.599 | S | S | * | * | trans | -109.5 | 58.3 | 165.2 | -42.2 | 171.2 | 0 | 0 | 0 | 111.2 | D35 | D35-I37 PolarHBondContact O-N 3Š| ||
| 38 | P | 47.1 | Very low | 52.2 | Low | 93 Ų | 93 | 124 Ų | 124 | 60% | 0.604 | 62% | 0.615 | S | S | * | * | trans | -79.8 | 131 | 163.5 | 30.4 | -18.7 | 0 | 0 | 0 | 108.6 | D35 E36 | D35-P38 WeakPolarHBondContact O-CD 3.39Å; E36-P38 WeakPolarHBondContact O-CD 2.98Å | ||
| 39 | E | 51.2 | Low | 51.4 | Low | 161 Ų | 161 | 129.5 Ų | 129.5 | 75% | 0.752 | 63% | 0.629 | S | S | * | * | S | Bend | trans | 97.4 | -20.7 | 162.8 | -57.6 | -165 | 139.8 | 0 | 0 | 121.3 | ||
| 40 | V | 48.9 | Very low | 50.5 | Low | 104 Ų | 104 | 135.6 Ų | 135.6 | 63% | 0.63 | 65% | 0.647 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -71.6 | -36.4 | 176.1 | -171 | 0 | 0 | 0 | 0 | 111.6 | K42 Y43 | V40-K42 VanDerWaalsContact C-N 3.26Å; V40-K42 PolarHBondContact O-N 3.42Å; V40-Y43 PolarHBondContact O-N 2.97Å |
| 41 | N | 47.7 | Very low | 49.9 | Very low | 115 Ų | 115 | 137.4 Ų | 137.4 | 62% | 0.615 | 66% | 0.659 | S | S | * | * | H | α-helix | trans | -73.4 | -6.7 | -178.2 | -86.9 | -8.4 | 0 | 0 | 0 | 115.3 | ||
| 42 | K | 47.6 | Very low | 48.9 | Very low | 166 Ų | 166 | 138.6 Ų | 138.6 | 72% | 0.722 | 67% | 0.669 | S | S | * | * | H | α-helix | trans | -78.3 | -25.3 | 177.9 | -143.8 | 178.8 | -172.5 | 179.7 | 0 | 112.2 | V40 | V40-K42 VanDerWaalsContact C-N 3.26Å; V40-K42 PolarHBondContact O-N 3.42Å |
| 43 | Y | 43.5 | Very low | 48.1 | Very low | 179 Ų | 179 | 139.6 Ų | 139.6 | 70% | 0.702 | 68% | 0.679 | S | S | * | * | H | α-helix | trans | -84.7 | -29.8 | -179.5 | -74.7 | -79.4 | 0 | 0 | 0 | 113.4 | V40 N45 I46 | V40-Y43 PolarHBondContact O-N 2.97Å; Y43-N45 VanDerWaalsContact C-N 3.26Å; Y43-N45 PolarHBondContact O-N 2.99Å; Y43-I46 PolarHBondContact O-N 2.81Å |
| 44 | D | 45.3 | Very low | 47.1 | Very low | 104 Ų | 104 | 141.6 Ų | 141.6 | 56% | 0.556 | 69% | 0.686 | S | S | * | * | H | α-helix | trans | -68 | -23.5 | 179.6 | -80.3 | -10.1 | 0 | 0 | 0 | 113.5 | ||
| 45 | N | 50.8 | Low | 46.6 | Very low | 146 Ų | 146 | 145.3 Ų | 145.3 | 78% | 0.781 | 70% | 0.7 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -81.6 | -14.4 | 176.8 | -83.7 | -11.5 | 0 | 0 | 0 | 114.4 | Y43 | Y43-N45 VanDerWaalsContact C-N 3.26Å; Y43-N45 PolarHBondContact O-N 2.99Å |
| 46 | I | 51.4 | Low | 46 | Very low | 111 Ų | 111 | 151.8 Ų | 151.8 | 57% | 0.569 | 72% | 0.718 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -86.6 | -27.5 | -178.3 | -61 | 175.4 | 0 | 0 | 0 | 111.2 | Y43 | Y43-I46 PolarHBondContact O-N 2.81Š|
| 47 | Y | 38.7 | Very low | 45.7 | Very low | 179 Ų | 179 | 148.4 Ų | 148.4 | 70% | 0.702 | 71% | 0.711 | S | S | * | * | trans | -129.3 | 89.4 | 178.1 | -69.8 | -81.1 | 0 | 0 | 0 | 111.4 | R49 | Y47-R49 PolarHBondContact O-N 3.46Š| ||
| 48 | P | 47.8 | Very low | 45.4 | Very low | 124 Ų | 124 | 152.4 Ų | 152.4 | 81% | 0.805 | 73% | 0.727 | S | S | * | * | trans | -73.4 | 71.5 | 162.1 | 31.6 | -32.6 | 0 | 0 | 0 | 108.4 | ||||
| 49 | R | 46.6 | Very low | 45.5 | Very low | 200 Ų | 200 | 158.2 Ų | 158.2 | 76% | 0.755 | 74% | 0.738 | S | S | * | * | trans | -127.5 | 98.6 | 175.6 | -105.2 | -169.3 | 176.5 | 175.9 | 0.9 | 110.3 | Y47 | Y47-R49 PolarHBondContact O-N 3.46Š| ||
| 50 | F | 46.7 | Very low | 45.2 | Very low | 178 Ų | 178 | 160 Ų | 160 | 78% | 0.781 | 74% | 0.743 | S | S | * | * | S | Bend | trans | 78.9 | 41.9 | 154.1 | -56 | -76.8 | 0 | 0 | 0 | 119.7 | ||
| 51 | I | 45.2 | Very low | 45.2 | Very low | 166 Ų | 166 | 167 Ų | 167 | 85% | 0.851 | 76% | 0.759 | S | S | * | * | trans | -111.1 | 60.3 | 151.5 | -44.1 | 178.4 | 0 | 0 | 0 | 109.1 | ||||
| 52 | H | 38.8 | Very low | 45.1 | Very low | 168 Ų | 168 | 165.4 Ų | 165.4 | 78% | 0.778 | 77% | 0.769 | S | S | * | * | trans | -89.2 | 142.7 | 151.8 | -101 | 60.4 | 0 | 0 | 0 | 107.2 | ||||
| 53 | H | 41.5 | Very low | 45.1 | Very low | 159 Ų | 159 | 160.9 Ų | 160.9 | 74% | 0.736 | 77% | 0.769 | S | S | * | * | S | Bend | trans | 86 | 100.1 | 171.6 | -65.1 | -28.9 | 0 | 0 | 0 | 117.5 | ||
| 54 | H | 40.4 | Very low | 45.4 | Very low | 173 Ų | 173 | 159.8 Ų | 159.8 | 80% | 0.801 | 77% | 0.773 | S | S | * | * | trans | 125.9 | 80.4 | 140.8 | -66.9 | 2.6 | 0 | 0 | 0 | 114.5 | ||||
| 55 | H | 44.7 | Very low | 45.9 | Very low | 179 Ų | 179 | 165.9 Ų | 165.9 | 83% | 0.829 | 79% | 0.789 | S | S | * | * | 168.7 | 84.8 | 129.3 | -109.2 | -86.3 | 0 | 0 | 0 | 108.7 | |||||
| 56 | R | 40.5 | Very low | 45.9 | Very low | 223 Ų | 223 | 163.1 Ų | 163.1 | 84% | 0.842 | 80% | 0.795 | S | S | * | * | 60.6 | 109.9 | 102 | -85.2 | -167.7 | 174.3 | -174.7 | 0.2 | 115.1 | |||||
| 57 | S | 44.2 | Very low | 46.1 | Very low | 79 Ų | 79 | 161 Ų | 161 | 55% | 0.552 | 80% | 0.801 | S | S | * | * | 86.7 | 90.2 | 124.7 | -170 | 0 | 0 | 0 | 0 | 117.5 | Y59 | S57-Y59 WeakPolarHBondContact O-CD1 3.2Å; S57-Y59 VanDerWaalsContact O-CE1 3.26Å; S57-Y59 WeakPolarHBondContact O-CE1 3.21Å; S57-Y59 PolarHBondContact O-N 3.19Å; S57-Y59 VanDerWaalsContact O-N 3.12Å | |||
| 58 | Q | 45.4 | Very low | 46.9 | Very low | 193 Ų | 193 | 160.5 Ų | 160.5 | 90% | 0.902 | 81% | 0.81 | S | S | * | * | 26.7 | 79.6 | 119.5 | -65.3 | -173.9 | -31.7 | 0 | 0 | 115.9 | |||||
| 59 | Y | 48 | Very low | 47.2 | Very low | 215 Ų | 215 | 163 Ų | 163 | 84% | 0.843 | 82% | 0.815 | S | S | * | * | trans | -98.7 | 97.5 | 150.8 | 11.3 | -81.8 | 0 | 0 | 0 | 107.6 | S57 R61 | S57-Y59 WeakPolarHBondContact O-CD1 3.2Å; S57-Y59 VanDerWaalsContact O-CE1 3.26Å; S57-Y59 WeakPolarHBondContact O-CE1 3.21Å; S57-Y59 PolarHBondContact O-N 3.19Å; S57-Y59 VanDerWaalsContact O-N 3.12Å; Y59-R61 PolarHBondContact O-N 3.35Å | ||
| 60 | K | 44.9 | Very low | 47.5 | Very low | 198 Ų | 198 | 156.8 Ų | 156.8 | 86% | 0.861 | 81% | 0.814 | S | S | * | * | trans | -3 | 107.2 | 158.2 | -89 | 170.3 | 166.2 | 176.6 | 0 | 114 | G62 | K60-G62 VanDerWaalsContact C-N 3.31Å; K60-G62 PolarHBondContact O-N 3.24Å | ||
| 61 | R | 49 | Very low | 47.3 | Very low | 253 Ų | 253 | 161.4 Ų | 161.4 | 96% | 0.955 | 83% | 0.834 | S | S | * | * | trans | -46.1 | 101.6 | 145.4 | -82.9 | 175.4 | 163.8 | 175.2 | -5.2 | 107.5 | Y59 G63 | Y59-R61 PolarHBondContact O-N 3.35Å; R61-G63 VanDerWaalsContact C-N 3.26Å; R61-G63 PolarHBondContact O-N 3.31Å | ||
| 62 | G | 46 | Very low | 47.4 | Very low | 81 Ų | 81 | 161.2 Ų | 161.2 | 84% | 0.835 | 83% | 0.833 | S | S | * | * | trans | -62.2 | 90 | 171.6 | 0 | 0 | 0 | 0 | 0 | 109 | K60 | K60-G62 VanDerWaalsContact C-N 3.31Å; K60-G62 PolarHBondContact O-N 3.24Å | ||
| 63 | G | 47.7 | Very low | 47.9 | Very low | 70 Ų | 70 | 160.8 Ų | 160.8 | 72% | 0.722 | 84% | 0.836 | S | S | * | * | trans | -71.5 | 120.4 | 159.1 | 0 | 0 | 0 | 0 | 0 | 108.3 | R61 | R61-G63 VanDerWaalsContact C-N 3.26Å; R61-G63 PolarHBondContact O-N 3.31Å | ||
| 64 | M | 50.3 | Low | 48.3 | Very low | 157 Ų | 157 | 160.9 Ų | 160.9 | 77% | 0.773 | 84% | 0.841 | S | S | * | * | trans | -165.7 | 25.4 | 153.3 | -124.5 | 179.1 | 84.6 | 0 | 0 | 116.5 | ||||
| 65 | Y | 55.4 | Low | 48.7 | Very low | 231 Ų | 231 | 160.2 Ų | 160.2 | 91% | 0.906 | 84% | 0.844 | S | S | * | * | S | Bend | trans | -135.6 | 27.3 | 176.8 | -62.8 | -73.7 | 0 | 0 | 0 | 115.7 | ||
| 66 | G | 49.9 | Very low | 49 | Very low | 88 Ų | 88 | 159 Ų | 159 | 91% | 0.907 | 85% | 0.845 | S | S | * | * | S | Bend | trans | -101 | 0.9 | 170.6 | 0 | 0 | 0 | 0 | 0 | 115.3 | ||
| 67 | G | 57 | Low | 49.5 | Very low | 67 Ų | 67 | 154.7 Ų | 154.7 | 69% | 0.691 | 85% | 0.845 | S | S | * | * | S | Bend | trans | -110 | 0.1 | -157.8 | 0 | 0 | 0 | 0 | 0 | 118.5 | ||
| 68 | L | 55.9 | Low | 49.9 | Very low | 168 Ų | 168 | 160.1 Ų | 160.1 | 88% | 0.88 | 87% | 0.866 | S | S | * | * | S | Bend | trans | -138.8 | 80.3 | -177 | -80.6 | 163.4 | 0 | 0 | 0 | 111.4 | ||
| 69 | L | 52.9 | Low | 50.3 | Low | 176 Ų | 176 | 157.6 Ų | 157.6 | 92% | 0.921 | 86% | 0.863 | S | S | * | * | trans | -167.5 | 52.7 | 140 | -96.7 | 155.1 | 0 | 0 | 0 | 108.2 | ||||
| 70 | G | 53 | Low | 50.5 | Low | 71 Ų | 71 | 152.8 Ų | 152.8 | 73% | 0.732 | 86% | 0.864 | S | S | * | * | trans | -105.1 | 94.7 | 154 | 0 | 0 | 0 | 0 | 0 | 106.9 | ||||
| 71 | K | 43.6 | Very low | 51 | Low | 274 Ų | 274 | 148.7 Ų | 148.7 | 100% | 1.191 | 87% | 0.865 | S | S | * | * | trans | 157 | 0 | 154.1 | -90.4 | 176.6 | -178.4 | -173.9 | 0 | 110.4 |
Retrieved 71 of 71 residues in 105.4 ms
(Link to these results)