| 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 | 38.4 | Very low | 52.5 | Low | 233 Ų | 233 | 103.9 Ų | 103.9 | 100% | 1.148 | 60% | 0.604 | S | S | * | * | 0 | -6.6 | 0 | -89.1 | 76.2 | 169.5 | 0 | 0 | 115.4 | |||||
| 2 | G | 39.9 | Very low | 54.8 | Low | 58 Ų | 58 | 103.9 Ų | 103.9 | 60% | 0.598 | 60% | 0.599 | S | S | * | * | trans | -103 | 13 | -164 | 0 | 0 | 0 | 0 | 0 | 120.5 | ||||
| 3 | L | 42 | Very low | 56.8 | Low | 142 Ų | 142 | 97.6 Ų | 97.6 | 74% | 0.743 | 57% | 0.567 | S | S | * | * | S | Bend | trans | -90.9 | -20.5 | -177.8 | -87.3 | 90.4 | 0 | 0 | 0 | 114.9 | L79 | L3-L79 HydrophobicContact CD2-CD1 4Š|
| 4 | C | 42.8 | Very low | 58.8 | Low | 108 Ų | 108 | 94.2 Ų | 94.2 | 73% | 0.73 | 55% | 0.545 | S | S | * | . | S | Bend | trans | -88.2 | -9.4 | 178.3 | -65.6 | 0 | 0 | 0 | 0 | 113.5 | S8 | C4-S8 WeakPolarHBondContact O-CB 3.26Š|
| 5 | D | 50.7 | Low | 60.7 | Low | 76 Ų | 76 | 91.1 Ų | 91.1 | 41% | 0.406 | 54% | 0.535 | S | S | . | . | H | α-helix | trans | -76.7 | -37.2 | -173 | -90.8 | -34 | 0 | 0 | 0 | 111.9 | L7 S8 H9 | D5-L7 PolarHBondContact O-N 2.96Å; D5-S8 PolarHBondContact O-N 2.98Å; D5-H9 VanDerWaalsContact CB-CD2 3.44Å; D5-H9 WeakPolarHBondContact CB-CD2 3.25Å; D5-H9 WeakPolarHBondContact O-CA 3.46Å; D5-H9 WeakPolarHBondContact O-CB 3.49Å; D5-H9 PolarHBondContact O-CD2 3.34Å; D5-H9 PolarHBondContact O-N 2.91Å; D5-H9 IonicContact OD1-CD2 3.88Å; D5-H9 IonicContact OD1-CE1 3.98Å; D5-H9 IonicContact OD1-NE2 3.34Å; D5-H9 PolarHBondContact OD1-NE2 2.88Å |
| 6 | G | 51 | Low | 62.4 | Low | 59 Ų | 59 | 91.1 Ų | 91.1 | 61% | 0.608 | 53% | 0.526 | S | S | * | . | H | α-helix | trans | -61 | -42.1 | -178 | 0 | 0 | 0 | 0 | 0 | 114.7 | C10 | G6-C10 PolarHBondContact O-N 3.5Å |
| 7 | L | 51.4 | Low | 64 | Low | 116 Ų | 116 | 85.8 Ų | 85.8 | 61% | 0.607 | 50% | 0.496 | S | S | * | . | H | α-helix | trans | -79.5 | -35.3 | -177.6 | -146.4 | 78.6 | 0 | 0 | 0 | 112.3 | D5 | D5-L7 PolarHBondContact O-N 2.96Å |
| 8 | S | 57.3 | Low | 65.6 | Low | 70 Ų | 70 | 84.3 Ų | 84.3 | 49% | 0.49 | 49% | 0.488 | S | S | . | . | H | α-helix | trans | -71.9 | -42 | 174.7 | -170.2 | 0 | 0 | 0 | 0 | 111.2 | C4 D5 C10 K11 L12 | C4-S8 WeakPolarHBondContact O-CB 3.26Å; D5-S8 PolarHBondContact O-N 2.98Å; S8-C10 VanDerWaalsContact C-N 3.31Å; S8-C10 PolarHBondContact O-N 2.9Å; S8-K11 PolarHBondContact O-N 2.94Å; S8-L12 VanDerWaalsContact O-CB 3.27Å; S8-L12 WeakPolarHBondContact O-CB 3.33Å; S8-L12 PolarHBondContact O-N 3.39Å |
| 9 | H | 61.6 | Low | 67 | Low | 94 Ų | 94 | 85.4 Ų | 85.4 | 44% | 0.435 | 49% | 0.491 | S | S | . | . | H | α-helix | trans | -65.2 | -32.5 | 177.9 | -76.3 | -53.7 | 0 | 0 | 0 | 112.9 | D5 L12 A13 | D5-H9 VanDerWaalsContact CB-CD2 3.44Å; D5-H9 WeakPolarHBondContact CB-CD2 3.25Å; D5-H9 WeakPolarHBondContact O-CA 3.46Å; D5-H9 WeakPolarHBondContact O-CB 3.49Å; D5-H9 PolarHBondContact O-CD2 3.34Å; D5-H9 PolarHBondContact O-N 2.91Å; D5-H9 IonicContact OD1-CD2 3.88Å; D5-H9 IonicContact OD1-CE1 3.98Å; D5-H9 IonicContact OD1-NE2 3.34Å; D5-H9 PolarHBondContact OD1-NE2 2.88Å; H9-L12 PolarHBondContact O-N 2.75Å; H9-A13 WeakPolarHBondContact O-CB 3.45Å; H9-A13 PolarHBondContact O-N 2.81Å |
| 10 | C | 68.8 | Low | 68.3 | Low | 27 Ų | 27 | 82.6 Ų | 82.6 | 18% | 0.182 | 47% | 0.474 | C | S | . | . | H | α-helix | trans | -56.8 | -61.8 | 169.5 | -125.8 | 0 | 0 | 0 | 0 | 108.3 | G6 S8 L12 A13 L14 W65 | G6-C10 PolarHBondContact O-N 3.5Å; S8-C10 VanDerWaalsContact C-N 3.31Å; S8-C10 PolarHBondContact O-N 2.9Å; C10-L12 PolarHBondContact O-N 3.43Å; C10-L12 VanDerWaalsContact O-N 3.16Å; C10-A13 WeakPolarHBondContact O-CB 3.23Å; C10-A13 PolarHBondContact O-N 3.4Å; C10-L14 PolarHBondContact O-N 3.27Å; C10-W65 VanDerWaalsContact C-CE3 3.45Å; C10-W65 HydrophobicContact CB-CE3 4.14Å; C10-W65 HydrophobicContact CB-CZ3 3.96Å; C10-W65 WeakPolarHBondContact O-CZ3 3.21Å |
| 11 | K | 74.1 | Confident | 69.4 | Low | 160 Ų | 160 | 82 Ų | 82 | 70% | 0.696 | 47% | 0.47 | S | S | * | . | H | α-helix | trans | -59.1 | -35.6 | -176.1 | -160.5 | 177.3 | 78.1 | -173.4 | 0 | 112.6 | S8 A15 | S8-K11 PolarHBondContact O-N 2.94Å; K11-A15 WeakPolarHBondContact O-CB 3.41Å; K11-A15 PolarHBondContact O-N 3.2Å |
| 12 | L | 79.3 | Confident | 72.2 | Confident | 104 Ų | 104 | 76.1 Ų | 76.1 | 55% | 0.545 | 44% | 0.442 | S | S | . | . | H | α-helix | trans | -67.2 | -40.4 | 175 | -164.3 | 80 | 0 | 0 | 0 | 112 | S8 H9 C10 A15 F16 | S8-L12 VanDerWaalsContact O-CB 3.27Å; S8-L12 WeakPolarHBondContact O-CB 3.33Å; S8-L12 PolarHBondContact O-N 3.39Å; H9-L12 PolarHBondContact O-N 2.75Å; C10-L12 PolarHBondContact O-N 3.43Å; C10-L12 VanDerWaalsContact O-N 3.16Å; L12-A15 PolarHBondContact O-N 3.28Å; L12-F16 WeakPolarHBondContact O-CB 3.4Å; L12-F16 PolarHBondContact O-N 2.96Å |
| 13 | A | 81.5 | Confident | 74.8 | Confident | 22 Ų | 22 | 78 Ų | 78 | 18% | 0.182 | 44% | 0.437 | C | S | . | . | H | α-helix | trans | -65.9 | -40 | 177.9 | 0 | 0 | 0 | 0 | 0 | 111.5 | H9 C10 A17 | H9-A13 WeakPolarHBondContact O-CB 3.45Å; H9-A13 PolarHBondContact O-N 2.81Å; C10-A13 WeakPolarHBondContact O-CB 3.23Å; C10-A13 PolarHBondContact O-N 3.4Å; A13-A17 VanDerWaalsContact O-CB 3.27Å; A13-A17 WeakPolarHBondContact O-CB 3.32Å; A13-A17 PolarHBondContact O-N 3.31Å |
| 14 | L | 84.4 | Confident | 77.3 | Confident | 50 Ų | 50 | 71.2 Ų | 71.2 | 26% | 0.262 | 40% | 0.402 | S | S | . | . | H | α-helix | trans | -64 | -48.9 | 171.2 | -176 | 73.6 | 0 | 0 | 0 | 111.5 | C10 F16 A17 V18 W62 W65 | C10-L14 PolarHBondContact O-N 3.27Å; L14-F16 VanDerWaalsContact C-N 3.26Å; L14-F16 PolarHBondContact O-N 3.09Å; L14-A17 PolarHBondContact O-N 2.91Å; L14-V18 HydrophobicContact CD1-CG2 4.29Å; L14-V18 HydrophobicContact CG-CG2 4.31Å; L14-V18 WeakPolarHBondContact O-CG2 3.46Å; L14-V18 PolarHBondContact O-N 2.65Å; L14-W62 HydrophobicContact CD1-CH2 4.46Å; L14-W62 HydrophobicContact CD1-CZ3 4.39Å; L14-W65 HydrophobicContact CB-CD2 3.67Å; L14-W65 HydrophobicContact CB-CE3 3.43Å; L14-W65 VanDerWaalsContact CB-CE3 3.43Å; L14-W65 HydrophobicContact CB-CG 4.41Å; L14-W65 HydrophobicContact CB-CH2 3.69Å; L14-W65 HydrophobicContact CB-CZ2 3.99Å; L14-W65 HydrophobicContact CB-CZ3 3.43Å; L14-W65 VanDerWaalsContact CB-CZ3 3.43Å; L14-W65 HydrophobicContact CD1-CD2 3.96Å; L14-W65 HydrophobicContact CD1-CG 4.18Å; L14-W65 HydrophobicContact CD1-CZ2 4.01Å; L14-W65 HydrophobicContact CD2-CH2 3.62Å; L14-W65 HydrophobicContact CD2-CZ2 3.59Å; L14-W65 HydrophobicContact CD2-CZ3 4.27Å; L14-W65 HydrophobicContact CG-CD2 4.3Å; L14-W65 HydrophobicContact CG-CE3 4.45Å; L14-W65 HydrophobicContact CG-CH2 4.14Å; L14-W65 HydrophobicContact CG-CZ2 4.06Å; L14-W65 HydrophobicContact CG-CZ3 4.36Å |
| 15 | A | 87.6 | Confident | 79.7 | Confident | 47 Ų | 47 | 67.3 Ų | 67.3 | 39% | 0.388 | 38% | 0.38 | S | S | . | . | H | α-helix | trans | -58.6 | -42.8 | 179.7 | 0 | 0 | 0 | 0 | 0 | 111 | K11 L12 L19 | K11-A15 WeakPolarHBondContact O-CB 3.41Å; K11-A15 PolarHBondContact O-N 3.2Å; L12-A15 PolarHBondContact O-N 3.28Å; A15-L19 VanDerWaalsContact O-CB 3.27Å; A15-L19 WeakPolarHBondContact O-CB 3.38Å; A15-L19 WeakPolarHBondContact O-CD1 3.34Å; A15-L19 WeakPolarHBondContact O-CG 3.24Å; A15-L19 PolarHBondContact O-N 3.49Å |
| 16 | F | 87.4 | Confident | 81.7 | Confident | 92 Ų | 92 | 67.5 Ų | 67.5 | 40% | 0.404 | 38% | 0.384 | S | S | . | . | H | α-helix | trans | -63.8 | -46.8 | 175.7 | -176.1 | -92.1 | 0 | 0 | 0 | 112.1 | L12 L14 L19 M20 M57 | L12-F16 WeakPolarHBondContact O-CB 3.4Å; L12-F16 PolarHBondContact O-N 2.96Å; L14-F16 VanDerWaalsContact C-N 3.26Å; L14-F16 PolarHBondContact O-N 3.09Å; F16-L19 PolarHBondContact O-N 3.38Å; F16-M20 HydrophobicContact CD1-CG 4.11Å; F16-M20 HydrophobicContact CD2-CE 4.37Å; F16-M20 HydrophobicContact CE1-CE 4.29Å; F16-M20 HydrophobicContact CE1-CG 3.78Å; F16-M20 HydrophobicContact CE2-CE 3.45Å; F16-M20 VanDerWaalsContact CE2-CE 3.45Å; F16-M20 HydrophobicContact CE2-CG 4.22Å; F16-M20 HydrophobicContact CG-CG 4.48Å; F16-M20 HydrophobicContact CZ-CE 3.4Å; F16-M20 HydrophobicContact CZ-CG 3.85Å; F16-M20 HydrophobicContact CZ-SD 4.48Å; F16-M20 WeakPolarHBondContact O-CB 3.24Å; F16-M20 WeakPolarHBondContact O-CG 3.3Å; F16-M20 PolarHBondContact O-N 2.78Å; F16-M57 HydrophobicContact CZ-CE 4.4Å |
| 17 | A | 89.5 | Confident | 83.6 | Confident | 0 Ų | 0 | 65.6 Ų | 65.6 | 0% | 0 | 36% | 0.363 | C | S | . | . | H | α-helix | trans | -58.7 | -50.9 | 177.6 | 0 | 0 | 0 | 0 | 0 | 111 | A13 L14 L19 M20 D21 S58 W62 | A13-A17 VanDerWaalsContact O-CB 3.27Å; A13-A17 WeakPolarHBondContact O-CB 3.32Å; A13-A17 PolarHBondContact O-N 3.31Å; L14-A17 PolarHBondContact O-N 2.91Å; A17-L19 PolarHBondContact O-N 2.97Å; A17-M20 PolarHBondContact O-N 2.93Å; A17-D21 WeakPolarHBondContact O-CB 3.48Å; A17-D21 PolarHBondContact O-N 2.89Å; A17-S58 PolarHBondContact O-OG 3.18Å; A17-W62 HydrophobicContact CB-CG 4.27Å |
| 18 | V | 92.3 | Very high | 85.5 | Confident | 60 Ų | 60 | 62.6 Ų | 62.6 | 36% | 0.364 | 35% | 0.347 | S | S | . | . | H | α-helix | trans | -63.1 | -42.9 | 179.7 | 174.4 | 0 | 0 | 0 | 0 | 111.8 | L14 D21 L22 W62 | L14-V18 HydrophobicContact CD1-CG2 4.29Å; L14-V18 HydrophobicContact CG-CG2 4.31Å; L14-V18 WeakPolarHBondContact O-CG2 3.46Å; L14-V18 PolarHBondContact O-N 2.65Å; V18-D21 PolarHBondContact O-N 3.32Å; V18-L22 HydrophobicContact CG1-CD1 4.22Å; V18-L22 WeakPolarHBondContact O-CG 3.25Å; V18-L22 PolarHBondContact O-N 3.03Å; V18-W62 HydrophobicContact CG2-CZ2 4.36Å |
| 19 | L | 93.9 | Very high | 87 | Confident | 105 Ų | 105 | 64.3 Ų | 64.3 | 55% | 0.55 | 35% | 0.35 | S | S | . | . | H | α-helix | trans | -61.8 | -47.3 | 177.1 | -78.4 | 168.9 | 0 | 0 | 0 | 111.6 | A15 F16 A17 D21 L22 L23 | A15-L19 VanDerWaalsContact O-CB 3.27Å; A15-L19 WeakPolarHBondContact O-CB 3.38Å; A15-L19 WeakPolarHBondContact O-CD1 3.34Å; A15-L19 WeakPolarHBondContact O-CG 3.24Å; A15-L19 PolarHBondContact O-N 3.49Å; F16-L19 PolarHBondContact O-N 3.38Å; A17-L19 PolarHBondContact O-N 2.97Å; L19-D21 VanDerWaalsContact C-N 3.29Å; L19-D21 PolarHBondContact O-N 2.89Å; L19-L22 PolarHBondContact O-N 3.24Å; L19-L23 WeakPolarHBondContact O-CB 3.38Å; L19-L23 VanDerWaalsContact O-CG 3.27Å; L19-L23 WeakPolarHBondContact O-CG 3.33Å; L19-L23 PolarHBondContact O-N 3.46Å |
| 20 | M | 91.1 | Very high | 88.3 | Confident | 29 Ų | 29 | 62.2 Ų | 62.2 | 14% | 0.143 | 34% | 0.344 | C | S | . | . | H | α-helix | trans | -66 | -32.9 | 178.9 | -69.9 | -50.6 | -163.5 | 0 | 0 | 112.3 | F16 A17 L23 G24 F54 M57 | F16-M20 HydrophobicContact CD1-CG 4.11Å; F16-M20 HydrophobicContact CD2-CE 4.37Å; F16-M20 HydrophobicContact CE1-CE 4.29Å; F16-M20 HydrophobicContact CE1-CG 3.78Å; F16-M20 HydrophobicContact CE2-CE 3.45Å; F16-M20 VanDerWaalsContact CE2-CE 3.45Å; F16-M20 HydrophobicContact CE2-CG 4.22Å; F16-M20 HydrophobicContact CG-CG 4.48Å; F16-M20 HydrophobicContact CZ-CE 3.4Å; F16-M20 HydrophobicContact CZ-CG 3.85Å; F16-M20 HydrophobicContact CZ-SD 4.48Å; F16-M20 WeakPolarHBondContact O-CB 3.24Å; F16-M20 WeakPolarHBondContact O-CG 3.3Å; F16-M20 PolarHBondContact O-N 2.78Å; A17-M20 PolarHBondContact O-N 2.93Å; M20-L23 HydrophobicContact SD-CD1 4.27Å; M20-G24 WeakPolarHBondContact O-CA 3.44Å; M20-G24 PolarHBondContact O-N 3.41Å; M20-F54 HydrophobicContact CB-CD1 4.46Å; M20-F54 HydrophobicContact CE-CD1 3.98Å; M20-F54 HydrophobicContact CE-CE1 3.62Å; M20-F54 HydrophobicContact CG-CD1 4.27Å; M20-F54 HydrophobicContact SD-CD1 3.19Å; M20-F54 WeakPolarHBondContact SD-CD1 3.46Å; M20-F54 HydrophobicContact SD-CE1 3.28Å; M20-F54 WeakPolarHBondContact SD-CE1 3.2Å; M20-F54 HydrophobicContact SD-CG 4.35Å; M20-F54 HydrophobicContact SD-CZ 4.5Å; M20-M57 HydrophobicContact CE-CE 4.12Å |
| 21 | D | 93.3 | Very high | 89.1 | Confident | 71 Ų | 71 | 61.4 Ų | 61.4 | 38% | 0.38 | 34% | 0.34 | S | S | . | . | H | α-helix | trans | -69.7 | -42.5 | 176.2 | -148 | 49.3 | 0 | 0 | 0 | 112 | A17 V18 L19 G24 G25 | A17-D21 WeakPolarHBondContact O-CB 3.48Å; A17-D21 PolarHBondContact O-N 2.89Å; V18-D21 PolarHBondContact O-N 3.32Å; L19-D21 VanDerWaalsContact C-N 3.29Å; L19-D21 PolarHBondContact O-N 2.89Å; D21-G24 PolarHBondContact O-N 3.47Å; D21-G25 PolarHBondContact O-N 2.9Å |
| 22 | L | 95.8 | Very high | 89.7 | Confident | 109 Ų | 109 | 58.4 Ų | 58.4 | 57% | 0.571 | 34% | 0.335 | S | S | * | . | H | α-helix | trans | -63 | -45.5 | 173.8 | -73 | 174.2 | 0 | 0 | 0 | 111.4 | V18 L19 T26 | V18-L22 HydrophobicContact CG1-CD1 4.22Å; V18-L22 WeakPolarHBondContact O-CG 3.25Å; V18-L22 PolarHBondContact O-N 3.03Å; L19-L22 PolarHBondContact O-N 3.24Å; L22-T26 VanDerWaalsContact O-CB 3.24Å; L22-T26 WeakPolarHBondContact O-CB 3.43Å; L22-T26 PolarHBondContact O-N 3.46Å; L22-T26 PolarHBondContact O-OG1 2.79Å |
| 23 | L | 94.4 | Very high | 89.7 | Confident | 96 Ų | 96 | 60.9 Ų | 60.9 | 50% | 0.503 | 34% | 0.342 | S | S | . | . | H | α-helix | trans | -64.5 | -45.6 | 177.4 | -70.4 | 172.8 | 0 | 0 | 0 | 111.3 | L19 M20 A27 | L19-L23 WeakPolarHBondContact O-CB 3.38Å; L19-L23 VanDerWaalsContact O-CG 3.27Å; L19-L23 WeakPolarHBondContact O-CG 3.33Å; L19-L23 PolarHBondContact O-N 3.46Å; M20-L23 HydrophobicContact SD-CD1 4.27Å; L23-A27 VanDerWaalsContact O-CB 3.25Å; L23-A27 WeakPolarHBondContact O-CB 3.49Å; L23-A27 PolarHBondContact O-N 3.46Å |
| 24 | G | 94.3 | Very high | 89.5 | Confident | 0 Ų | 0 | 62.9 Ų | 62.9 | 0% | 0 | 35% | 0.351 | C | S | . | . | H | α-helix | trans | -65 | -47.7 | 179.3 | 0 | 0 | 0 | 0 | 0 | 112.6 | M20 D21 A27 L28 | M20-G24 WeakPolarHBondContact O-CA 3.44Å; M20-G24 PolarHBondContact O-N 3.41Å; D21-G24 PolarHBondContact O-N 3.47Å; G24-A27 PolarHBondContact O-N 2.85Å; G24-L28 WeakPolarHBondContact O-CB 3.43Å; G24-L28 VanDerWaalsContact O-CG 3.3Å; G24-L28 WeakPolarHBondContact O-CG 3.37Å; G24-L28 PolarHBondContact O-N 3.24Å |
| 25 | G | 93.3 | Very high | 88.7 | Confident | 26 Ų | 26 | 66.4 Ų | 66.4 | 27% | 0.268 | 38% | 0.377 | S | S | . | . | H | α-helix | trans | -61.7 | -44.2 | 175.6 | 0 | 0 | 0 | 0 | 0 | 112.3 | D21 L28 L29 | D21-G25 PolarHBondContact O-N 2.9Å; G25-L28 PolarHBondContact O-N 3.14Å; G25-L29 WeakPolarHBondContact O-CB 2.97Å; G25-L29 VanDerWaalsContact O-CG 3.23Å; G25-L29 WeakPolarHBondContact O-CG 3.27Å; G25-L29 PolarHBondContact O-N 3.14Å |
| 26 | T | 92.9 | Very high | 87.6 | Confident | 81 Ų | 81 | 66.3 Ų | 66.3 | 50% | 0.497 | 37% | 0.37 | S | S | . | . | H | α-helix | trans | -64.7 | -42.4 | 176.4 | -52.3 | 0 | 0 | 0 | 0 | 111.2 | L22 L29 V30 | L22-T26 VanDerWaalsContact O-CB 3.24Å; L22-T26 WeakPolarHBondContact O-CB 3.43Å; L22-T26 PolarHBondContact O-N 3.46Å; L22-T26 PolarHBondContact O-OG1 2.79Å; T26-L29 PolarHBondContact O-N 2.97Å; T26-V30 HydrophobicContact CG2-CG2 4.26Å; T26-V30 WeakPolarHBondContact O-CB 3.34Å; T26-V30 VanDerWaalsContact O-CG2 3.25Å; T26-V30 WeakPolarHBondContact O-CG2 3.35Å; T26-V30 PolarHBondContact O-N 3.49Å |
| 27 | A | 90.8 | Very high | 86.4 | Confident | 18 Ų | 18 | 66.2 Ų | 66.2 | 15% | 0.149 | 37% | 0.374 | C | S | . | . | H | α-helix | trans | -64.1 | -40.1 | 177.3 | 0 | 0 | 0 | 0 | 0 | 112.4 | L23 G24 G31 | L23-A27 VanDerWaalsContact O-CB 3.25Å; L23-A27 WeakPolarHBondContact O-CB 3.49Å; L23-A27 PolarHBondContact O-N 3.46Å; G24-A27 PolarHBondContact O-N 2.85Å; A27-G31 WeakPolarHBondContact O-CA 3.32Å; A27-G31 PolarHBondContact O-N 2.9Å |
| 28 | L | 91.3 | Very high | 85.1 | Confident | 54 Ų | 54 | 71.1 Ų | 71.1 | 28% | 0.283 | 40% | 0.399 | S | S | . | . | H | α-helix | trans | -64.9 | -47.2 | 174.5 | -73.4 | 171.4 | 0 | 0 | 0 | 111.6 | G24 G25 V30 G31 V32 V48 V55 | G24-L28 WeakPolarHBondContact O-CB 3.43Å; G24-L28 VanDerWaalsContact O-CG 3.3Å; G24-L28 WeakPolarHBondContact O-CG 3.37Å; G24-L28 PolarHBondContact O-N 3.24Å; G25-L28 PolarHBondContact O-N 3.14Å; L28-V30 PolarHBondContact O-N 3.45Å; L28-G31 PolarHBondContact O-N 3.44Å; L28-V32 WeakPolarHBondContact O-CB 3.41Å; L28-V32 WeakPolarHBondContact O-CG2 3.44Å; L28-V32 PolarHBondContact O-N 3.36Å; L28-V48 HydrophobicContact CD2-CB 4.47Å; L28-V48 HydrophobicContact CD2-CG1 3.97Å; L28-V48 WeakPolarHBondContact CD2-O 3.43Å; L28-V55 HydrophobicContact CD1-CG2 4Å |
| 29 | L | 89.7 | Confident | 83.5 | Confident | 106 Ų | 106 | 78.3 Ų | 78.3 | 56% | 0.555 | 43% | 0.425 | S | S | * | . | H | α-helix | trans | -60.4 | -47.8 | 178.1 | -72.1 | 172.6 | 0 | 0 | 0 | 110.9 | G25 T26 F33 | G25-L29 WeakPolarHBondContact O-CB 2.97Å; G25-L29 VanDerWaalsContact O-CG 3.23Å; G25-L29 WeakPolarHBondContact O-CG 3.27Å; G25-L29 PolarHBondContact O-N 3.14Å; T26-L29 PolarHBondContact O-N 2.97Å; L29-F33 HydrophobicContact CD2-CD2 4.04Å; L29-F33 HydrophobicContact CD2-CE2 3.77Å; L29-F33 WeakPolarHBondContact O-CB 3.34Å; L29-F33 VanDerWaalsContact O-CD2 3.26Å; L29-F33 WeakPolarHBondContact O-CD2 3.38Å; L29-F33 PolarHBondContact O-N 2.91Å |
| 30 | V | 88.2 | Confident | 82.1 | Confident | 50 Ų | 50 | 76.6 Ų | 76.6 | 30% | 0.303 | 43% | 0.433 | S | S | . | . | H | α-helix | trans | -66.5 | -41.9 | 178.5 | 174.9 | 0 | 0 | 0 | 0 | 110.9 | T26 L28 V32 V34 L36 L47 | T26-V30 HydrophobicContact CG2-CG2 4.26Å; T26-V30 WeakPolarHBondContact O-CB 3.34Å; T26-V30 VanDerWaalsContact O-CG2 3.25Å; T26-V30 WeakPolarHBondContact O-CG2 3.35Å; T26-V30 PolarHBondContact O-N 3.49Å; L28-V30 PolarHBondContact O-N 3.45Å; V30-V32 PolarHBondContact O-N 2.9Å; V30-V34 HydrophobicContact CB-CG2 4.5Å; V30-V34 HydrophobicContact CG1-CB 4.17Å; V30-V34 HydrophobicContact CG1-CG2 4.03Å; V30-V34 WeakPolarHBondContact O-CA 3.39Å; V30-V34 VanDerWaalsContact O-CB 3.24Å; V30-V34 WeakPolarHBondContact O-CB 3.19Å; V30-V34 PolarHBondContact O-N 3.33Å; V30-L36 HydrophobicContact CG1-CD1 3.72Å; V30-L36 HydrophobicContact CG1-CG 4.48Å; V30-L47 HydrophobicContact CB-CD2 3.78Å; V30-L47 HydrophobicContact CG1-CD2 3.45Å; V30-L47 VanDerWaalsContact CG1-CD2 3.45Å |
| 31 | G | 86.8 | Confident | 80.7 | Confident | 10 Ų | 10 | 84 Ų | 84 | 10% | 0.103 | 46% | 0.459 | C | S | . | . | H | α-helix | trans | -65.2 | -34 | -179.4 | 0 | 0 | 0 | 0 | 0 | 114.2 | A27 L28 | A27-G31 WeakPolarHBondContact O-CA 3.32Å; A27-G31 PolarHBondContact O-N 2.9Å; L28-G31 PolarHBondContact O-N 3.44Å |
| 32 | V | 84.8 | Confident | 79.7 | Confident | 96 Ų | 96 | 85.7 Ų | 85.7 | 58% | 0.582 | 47% | 0.468 | S | S | * | . | H | α-helix | trans | -85.6 | -44.2 | 179 | 174.6 | 0 | 0 | 0 | 0 | 112.2 | L28 V30 V48 | L28-V32 WeakPolarHBondContact O-CB 3.41Å; L28-V32 WeakPolarHBondContact O-CG2 3.44Å; L28-V32 PolarHBondContact O-N 3.36Å; V30-V32 PolarHBondContact O-N 2.9Å; V32-V48 HydrophobicContact CG2-CG2 3.91Å |
| 33 | F | 79.3 | Confident | 78.8 | Confident | 157 Ų | 157 | 84.2 Ų | 84.2 | 69% | 0.689 | 46% | 0.457 | S | S | * | . | H | α-helix | trans | -95 | -21.8 | -169.4 | -67.7 | -75 | 0 | 0 | 0 | 114.2 | L29 P35 | L29-F33 HydrophobicContact CD2-CD2 4.04Å; L29-F33 HydrophobicContact CD2-CE2 3.77Å; L29-F33 WeakPolarHBondContact O-CB 3.34Å; L29-F33 VanDerWaalsContact O-CD2 3.26Å; L29-F33 WeakPolarHBondContact O-CD2 3.38Å; L29-F33 PolarHBondContact O-N 2.91Å; F33-P35 WeakPolarHBondContact O-CD 3.5Å |
| 34 | V | 78.8 | Confident | 78.2 | Confident | 64 Ų | 64 | 80.1 Ų | 80.1 | 39% | 0.388 | 44% | 0.439 | S | S | . | . | S | Bend | trans | -100.5 | 116.6 | 179.5 | -172.9 | 0 | 0 | 0 | 0 | 109 | V30 L36 | V30-V34 HydrophobicContact CB-CG2 4.5Å; V30-V34 HydrophobicContact CG1-CB 4.17Å; V30-V34 HydrophobicContact CG1-CG2 4.03Å; V30-V34 WeakPolarHBondContact O-CA 3.39Å; V30-V34 VanDerWaalsContact O-CB 3.24Å; V30-V34 WeakPolarHBondContact O-CB 3.19Å; V30-V34 PolarHBondContact O-N 3.33Å; V34-L36 HydrophobicContact CB-CD2 4.32Å; V34-L36 HydrophobicContact CB-CG 4.02Å; V34-L36 HydrophobicContact CG1-CD2 3.54Å; V34-L36 HydrophobicContact CG1-CG 3.72Å; V34-L36 PolarHBondContact O-N 2.91Å |
| 35 | P | 66.8 | Low | 77.8 | Confident | 124 Ų | 124 | 85.2 Ų | 85.2 | 81% | 0.805 | 47% | 0.466 | S | S | * | . | trans | -69.4 | 80.5 | 169.6 | 28.1 | -32.1 | 0 | 0 | 0 | 109.1 | F33 N37 | F33-P35 WeakPolarHBondContact O-CD 3.5Å; P35-N37 PolarHBondContact O-N 2.95Å | ||
| 36 | L | 64.4 | Low | 77.4 | Confident | 45 Ų | 45 | 88.8 Ų | 88.8 | 24% | 0.236 | 48% | 0.478 | C | S | . | . | trans | -77.2 | 63.9 | 177 | -68.9 | 175.4 | 0 | 0 | 0 | 110.1 | V30 V34 I38 F43 L47 | V30-L36 HydrophobicContact CG1-CD1 3.72Å; V30-L36 HydrophobicContact CG1-CG 4.48Å; V34-L36 HydrophobicContact CB-CD2 4.32Å; V34-L36 HydrophobicContact CB-CG 4.02Å; V34-L36 HydrophobicContact CG1-CD2 3.54Å; V34-L36 HydrophobicContact CG1-CG 3.72Å; V34-L36 PolarHBondContact O-N 2.91Å; L36-I38 VanDerWaalsContact C-N 3.34Å; L36-I38 PolarHBondContact O-N 3.44Å; L36-F43 HydrophobicContact CB-CB 4.33Å; L36-F43 PolarHBondContact O-N 3.4Å; L36-L47 HydrophobicContact CD1-CD1 4.42Å; L36-L47 HydrophobicContact CD1-CD2 3.79Å | ||
| 37 | N | 63.6 | Low | 77.2 | Confident | 90 Ų | 90 | 87 Ų | 87 | 48% | 0.481 | 47% | 0.466 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -88.1 | 78.9 | 171.8 | -156.5 | -53.7 | 0 | 0 | 0 | 108.9 | P35 G40 D42 | P35-N37 PolarHBondContact O-N 2.95Å; N37-G40 WeakPolarHBondContact OD1-CA 3.33Å; N37-G40 PolarHBondContact OD1-N 2.79Å; N37-D42 PolarHBondContact ND2-OD1 2.88Å |
| 38 | I | 60.8 | Low | 77.1 | Confident | 103 Ų | 103 | 88.3 Ų | 88.3 | 53% | 0.528 | 47% | 0.472 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -91.7 | 109.1 | 176.4 | -62.7 | 165.4 | 0 | 0 | 0 | 106.8 | L36 G40 F43 | L36-I38 VanDerWaalsContact C-N 3.34Å; L36-I38 PolarHBondContact O-N 3.44Å; I38-G40 PolarHBondContact O-N 3.43Å; I38-F43 HydrophobicContact CB-CD2 4.34Å |
| 39 | K | 59.2 | Low | 77.1 | Confident | 211 Ų | 211 | 94 Ų | 94 | 92% | 0.917 | 49% | 0.49 | S | S | * | . | T | Hydrogen-bonded Turn | trans | 67.2 | 35.5 | 170.3 | -130.4 | 168.8 | -175.2 | 174.4 | 0 | 114 | ||
| 40 | G | 63.8 | Low | 77.2 | Confident | 69 Ų | 69 | 91.7 Ų | 91.7 | 71% | 0.711 | 48% | 0.481 | S | S | * | . | T | Hydrogen-bonded Turn | trans | 79.6 | 15.7 | 172.3 | 0 | 0 | 0 | 0 | 0 | 115.4 | N37 I38 | N37-G40 WeakPolarHBondContact OD1-CA 3.33Å; N37-G40 PolarHBondContact OD1-N 2.79Å; I38-G40 PolarHBondContact O-N 3.43Å |
| 41 | R | 62.7 | Low | 77.4 | Confident | 183 Ų | 183 | 89.3 Ų | 89.3 | 69% | 0.691 | 47% | 0.466 | S | S | * | . | E | Extended strand (participates in β ladder) | trans | -128.3 | 131.2 | 175.6 | -169.4 | 178.3 | -64.5 | -145.2 | -0.4 | 109 | F43 | R41-F43 HydrophobicContact CB-CD2 4.45Å; R41-F43 HydrophobicContact CB-CE2 4.09Å; R41-F43 HydrophobicContact CG-CE2 4.43Å; R41-F43 WeakPolarHBondContact O-CD2 3.36Å; R41-F43 PolarHBondContact O-N 2.9Å |
| 42 | D | 72 | Confident | 77.7 | Confident | 107 Ų | 107 | 90.8 Ų | 90.8 | 57% | 0.572 | 48% | 0.477 | S | S | * | . | E | Extended strand (participates in β ladder) | trans | -78.3 | 101.5 | -179.2 | -61 | -55.6 | 0 | 0 | 0 | 109.9 | N37 | N37-D42 PolarHBondContact ND2-OD1 2.88Å |
| 43 | F | 77.3 | Confident | 78.2 | Confident | 78 Ų | 78 | 91.5 Ų | 91.5 | 34% | 0.342 | 48% | 0.478 | S | S | . | . | trans | -81.9 | -5.4 | 176.1 | -80.1 | -89.7 | 0 | 0 | 0 | 112.9 | L36 I38 R41 L46 L47 | L36-F43 HydrophobicContact CB-CB 4.33Å; L36-F43 PolarHBondContact O-N 3.4Å; I38-F43 HydrophobicContact CB-CD2 4.34Å; R41-F43 HydrophobicContact CB-CD2 4.45Å; R41-F43 HydrophobicContact CB-CE2 4.09Å; R41-F43 HydrophobicContact CG-CE2 4.43Å; R41-F43 WeakPolarHBondContact O-CD2 3.36Å; R41-F43 PolarHBondContact O-N 2.9Å; F43-L46 HydrophobicContact CD1-CD2 4.18Å; F43-L46 PolarHBondContact O-N 3.32Å; F43-L47 PolarHBondContact O-N 3.32Å; F43-L47 VanDerWaalsContact O-N 3.14Å | ||
| 44 | G | 82.1 | Confident | 78.9 | Confident | 11 Ų | 11 | 87.4 Ų | 87.4 | 11% | 0.113 | 46% | 0.46 | C | S | . | . | H | α-helix | trans | -59.6 | -49.7 | 176.5 | 0 | 0 | 0 | 0 | 0 | 112.1 | L46 L47 V48 | G44-L46 VanDerWaalsContact C-N 3.31Å; G44-L46 PolarHBondContact O-N 2.9Å; G44-L47 WeakPolarHBondContact O-CB 3.36Å; G44-L47 PolarHBondContact O-N 3.25Å; G44-L47 VanDerWaalsContact O-N 3.09Å; G44-V48 WeakPolarHBondContact O-CG2 3.45Å; G44-V48 PolarHBondContact O-N 2.98Å |
| 45 | D | 84.4 | Confident | 79.5 | Confident | 106 Ų | 106 | 86.8 Ų | 86.8 | 57% | 0.567 | 46% | 0.456 | S | S | * | . | H | α-helix | trans | -58.3 | -43.1 | 179.8 | -72.6 | -17.7 | 0 | 0 | 0 | 111.9 | L47 V48 Y49 | D45-L47 PolarHBondContact O-N 3.34Å; D45-V48 PolarHBondContact O-N 3Å; D45-Y49 HydrophobicContact CB-CD2 4.38Å; D45-Y49 HydrophobicContact CB-CE2 4.2Å; D45-Y49 WeakPolarHBondContact O-CD2 2.94Å; D45-Y49 PolarHBondContact O-N 3.26Å |
| 46 | L | 86.4 | Confident | 80.8 | Confident | 101 Ų | 101 | 86.6 Ų | 86.6 | 53% | 0.529 | 45% | 0.448 | S | S | . | . | H | α-helix | trans | -62.4 | -42.3 | 177.5 | -170.4 | 72.8 | 0 | 0 | 0 | 111.7 | F43 G44 V48 Y49 T50 | F43-L46 HydrophobicContact CD1-CD2 4.18Å; F43-L46 PolarHBondContact O-N 3.32Å; G44-L46 VanDerWaalsContact C-N 3.31Å; G44-L46 PolarHBondContact O-N 2.9Å; L46-V48 VanDerWaalsContact C-N 3.35Å; L46-Y49 PolarHBondContact O-N 3.24Å; L46-T50 WeakPolarHBondContact O-CB 3.46Å; L46-T50 VanDerWaalsContact O-CG2 3.32Å; L46-T50 WeakPolarHBondContact O-CG2 3.19Å; L46-T50 PolarHBondContact O-N 2.87Å; L46-T50 PolarHBondContact O-OG1 3.42Å |
| 47 | L | 87.8 | Confident | 82 | Confident | 45 Ų | 45 | 89 Ų | 89 | 24% | 0.236 | 46% | 0.459 | C | S | . | . | H | α-helix | trans | -64.2 | -39.5 | 175.5 | -108 | 77 | 0 | 0 | 0 | 112.1 | V30 L36 F43 G44 D45 T50 G51 | V30-L47 HydrophobicContact CB-CD2 3.78Å; V30-L47 HydrophobicContact CG1-CD2 3.45Å; V30-L47 VanDerWaalsContact CG1-CD2 3.45Å; L36-L47 HydrophobicContact CD1-CD1 4.42Å; L36-L47 HydrophobicContact CD1-CD2 3.79Å; F43-L47 PolarHBondContact O-N 3.32Å; F43-L47 VanDerWaalsContact O-N 3.14Å; G44-L47 WeakPolarHBondContact O-CB 3.36Å; G44-L47 PolarHBondContact O-N 3.25Å; G44-L47 VanDerWaalsContact O-N 3.09Å; D45-L47 PolarHBondContact O-N 3.34Å; L47-T50 WeakPolarHBondContact CA-OG1 3.27Å; L47-T50 PolarHBondContact O-OG1 3.46Å; L47-T50 VanDerWaalsContact O-OG1 3.14Å; L47-G51 PolarHBondContact O-N 2.97Å |
| 48 | V | 89.7 | Confident | 83.2 | Confident | 45 Ų | 45 | 84.7 Ų | 84.7 | 27% | 0.273 | 44% | 0.436 | S | S | . | . | H | α-helix | trans | -65.9 | -46.6 | 177 | 174.1 | 0 | 0 | 0 | 0 | 111 | L28 V32 G44 D45 L46 G51 A52 | L28-V48 HydrophobicContact CD2-CB 4.47Å; L28-V48 HydrophobicContact CD2-CG1 3.97Å; L28-V48 WeakPolarHBondContact CD2-O 3.43Å; V32-V48 HydrophobicContact CG2-CG2 3.91Å; G44-V48 WeakPolarHBondContact O-CG2 3.45Å; G44-V48 PolarHBondContact O-N 2.98Å; D45-V48 PolarHBondContact O-N 3Å; L46-V48 VanDerWaalsContact C-N 3.35Å; V48-G51 PolarHBondContact O-N 3.39Å; V48-A52 WeakPolarHBondContact O-CB 3.38Å; V48-A52 PolarHBondContact O-N 3.02Å |
| 49 | Y | 90.7 | Very high | 84.6 | Confident | 173 Ų | 173 | 85.1 Ų | 85.1 | 68% | 0.678 | 44% | 0.439 | S | S | * | . | H | α-helix | trans | -63.6 | -44.6 | 178.5 | -76.2 | -61.2 | 0 | 0 | 0 | 112.5 | D45 L46 A52 L53 | D45-Y49 HydrophobicContact CB-CD2 4.38Å; D45-Y49 HydrophobicContact CB-CE2 4.2Å; D45-Y49 WeakPolarHBondContact O-CD2 2.94Å; D45-Y49 PolarHBondContact O-N 3.26Å; L46-Y49 PolarHBondContact O-N 3.24Å; Y49-A52 PolarHBondContact O-N 3.34Å; Y49-L53 PolarHBondContact O-N 3.24Å |
| 50 | T | 91.4 | Very high | 85.9 | Confident | 57 Ų | 57 | 76.8 Ų | 76.8 | 35% | 0.35 | 41% | 0.412 | S | S | . | . | H | α-helix | trans | -67.5 | -40.4 | 177.3 | 51.5 | 0 | 0 | 0 | 0 | 111.8 | L46 L47 L53 F54 | L46-T50 WeakPolarHBondContact O-CB 3.46Å; L46-T50 VanDerWaalsContact O-CG2 3.32Å; L46-T50 WeakPolarHBondContact O-CG2 3.19Å; L46-T50 PolarHBondContact O-N 2.87Å; L46-T50 PolarHBondContact O-OG1 3.42Å; L47-T50 WeakPolarHBondContact CA-OG1 3.27Å; L47-T50 PolarHBondContact O-OG1 3.46Å; L47-T50 VanDerWaalsContact O-OG1 3.14Å; T50-L53 WeakPolarHBondContact O-CB 3.27Å; T50-L53 PolarHBondContact O-N 2.99Å; T50-F54 WeakPolarHBondContact O-CD2 3.32Å; T50-F54 PolarHBondContact O-N 3.23Å |
| 51 | G | 93.1 | Very high | 86.9 | Confident | 0 Ų | 0 | 73.8 Ų | 73.8 | 0% | 0 | 38% | 0.381 | C | S | . | . | H | α-helix | trans | -61 | -43.8 | 174.6 | 0 | 0 | 0 | 0 | 0 | 112.6 | L47 V48 L53 F54 V55 | L47-G51 PolarHBondContact O-N 2.97Å; V48-G51 PolarHBondContact O-N 3.39Å; G51-L53 PolarHBondContact O-N 2.99Å; G51-F54 PolarHBondContact O-N 3.06Å; G51-V55 WeakPolarHBondContact O-CG2 3.28Å; G51-V55 PolarHBondContact O-N 2.94Å |
| 52 | A | 93.6 | Very high | 87.9 | Confident | 41 Ų | 41 | 70.3 Ų | 70.3 | 34% | 0.339 | 37% | 0.368 | S | S | . | . | H | α-helix | trans | -61.1 | -42.4 | 174.6 | 0 | 0 | 0 | 0 | 0 | 112.1 | V48 Y49 F54 V55 L56 | V48-A52 WeakPolarHBondContact O-CB 3.38Å; V48-A52 PolarHBondContact O-N 3.02Å; Y49-A52 PolarHBondContact O-N 3.34Å; A52-F54 VanDerWaalsContact C-N 3.33Å; A52-F54 PolarHBondContact O-N 2.86Å; A52-V55 PolarHBondContact O-N 2.8Å; A52-L56 WeakPolarHBondContact O-CG 3.19Å; A52-L56 PolarHBondContact O-N 3.26Å |
| 53 | L | 94.1 | Very high | 88.6 | Confident | 112 Ų | 112 | 69.7 Ų | 69.7 | 59% | 0.586 | 37% | 0.368 | S | S | * | . | H | α-helix | trans | -61.6 | -41.4 | 176 | -169.9 | 71.8 | 0 | 0 | 0 | 111.8 | Y49 T50 G51 L56 M57 | Y49-L53 PolarHBondContact O-N 3.24Å; T50-L53 WeakPolarHBondContact O-CB 3.27Å; T50-L53 PolarHBondContact O-N 2.99Å; G51-L53 PolarHBondContact O-N 2.99Å; L53-L56 PolarHBondContact O-N 3.29Å; L53-M57 WeakPolarHBondContact O-CB 3.41Å; L53-M57 PolarHBondContact O-N 3.5Å |
| 54 | F | 93.5 | Very high | 88.7 | Confident | 70 Ų | 70 | 71.8 Ų | 71.8 | 31% | 0.307 | 38% | 0.382 | S | S | . | . | H | α-helix | trans | -63.8 | -42.4 | 176.5 | -83.2 | -59.8 | 0 | 0 | 0 | 112.9 | M20 T50 G51 A52 M57 S58 | M20-F54 HydrophobicContact CB-CD1 4.46Å; M20-F54 HydrophobicContact CE-CD1 3.98Å; M20-F54 HydrophobicContact CE-CE1 3.62Å; M20-F54 HydrophobicContact CG-CD1 4.27Å; M20-F54 HydrophobicContact SD-CD1 3.19Å; M20-F54 WeakPolarHBondContact SD-CD1 3.46Å; M20-F54 HydrophobicContact SD-CE1 3.28Å; M20-F54 WeakPolarHBondContact SD-CE1 3.2Å; M20-F54 HydrophobicContact SD-CG 4.35Å; M20-F54 HydrophobicContact SD-CZ 4.5Å; T50-F54 WeakPolarHBondContact O-CD2 3.32Å; T50-F54 PolarHBondContact O-N 3.23Å; G51-F54 PolarHBondContact O-N 3.06Å; A52-F54 VanDerWaalsContact C-N 3.33Å; A52-F54 PolarHBondContact O-N 2.86Å; F54-M57 PolarHBondContact O-N 3.36Å; F54-S58 WeakPolarHBondContact O-CB 3.35Å; F54-S58 PolarHBondContact O-N 2.83Å |
| 55 | V | 93.1 | Very high | 88.6 | Confident | 52 Ų | 52 | 73.9 Ų | 73.9 | 32% | 0.315 | 39% | 0.387 | S | S | . | . | H | α-helix | trans | -63.4 | -43.1 | 175.4 | 174 | 0 | 0 | 0 | 0 | 111.1 | L28 G51 A52 M57 S58 L59 | L28-V55 HydrophobicContact CD1-CG2 4Å; G51-V55 WeakPolarHBondContact O-CG2 3.28Å; G51-V55 PolarHBondContact O-N 2.94Å; A52-V55 PolarHBondContact O-N 2.8Å; V55-M57 VanDerWaalsContact C-N 3.33Å; V55-M57 PolarHBondContact O-N 3.04Å; V55-S58 WeakPolarHBondContact O-CB 3.26Å; V55-S58 PolarHBondContact O-N 3.33Å; V55-L59 PolarHBondContact O-N 3.43Å |
| 56 | L | 93 | Very high | 88.1 | Confident | 120 Ų | 120 | 76.9 Ų | 76.9 | 63% | 0.628 | 39% | 0.391 | S | S | * | . | H | α-helix | trans | -60.4 | -42.8 | 175.6 | -72.5 | 174.7 | 0 | 0 | 0 | 112 | A52 L53 S58 L59 | A52-L56 WeakPolarHBondContact O-CG 3.19Å; A52-L56 PolarHBondContact O-N 3.26Å; L53-L56 PolarHBondContact O-N 3.29Å; L56-S58 VanDerWaalsContact C-N 3.34Å; L56-L59 WeakPolarHBondContact O-CB 3.49Å; L56-L59 PolarHBondContact O-N 3.48Å |
| 57 | M | 88.9 | Confident | 87.4 | Confident | 95 Ų | 95 | 75.1 Ų | 75.1 | 47% | 0.468 | 39% | 0.388 | S | S | . | . | H | α-helix | trans | -69.6 | -34.7 | 178.8 | -153.8 | 148.7 | 74.6 | 0 | 0 | 111.7 | F16 M20 L53 F54 V55 L59 G60 G61 | F16-M57 HydrophobicContact CZ-CE 4.4Å; M20-M57 HydrophobicContact CE-CE 4.12Å; L53-M57 WeakPolarHBondContact O-CB 3.41Å; L53-M57 PolarHBondContact O-N 3.5Å; F54-M57 PolarHBondContact O-N 3.36Å; V55-M57 VanDerWaalsContact C-N 3.33Å; V55-M57 PolarHBondContact O-N 3.04Å; M57-L59 VanDerWaalsContact C-N 3.35Å; M57-G60 PolarHBondContact O-N 3.25Å; M57-G61 PolarHBondContact O-N 3.33Å |
| 58 | S | 90.5 | Very high | 86.6 | Confident | 0 Ų | 0 | 74 Ų | 74 | 0% | 0 | 39% | 0.387 | C | S | . | . | H | α-helix | trans | -61.2 | -40.9 | 171.8 | -179.3 | 0 | 0 | 0 | 0 | 112 | A17 F54 V55 L56 G60 G61 W62 | A17-S58 PolarHBondContact O-OG 3.18Å; F54-S58 WeakPolarHBondContact O-CB 3.35Å; F54-S58 PolarHBondContact O-N 2.83Å; V55-S58 WeakPolarHBondContact O-CB 3.26Å; V55-S58 PolarHBondContact O-N 3.33Å; L56-S58 VanDerWaalsContact C-N 3.34Å; S58-G60 PolarHBondContact O-N 3.41Å; S58-G61 CarbonylContact O-C 3.55Å; S58-G61 WeakPolarHBondContact O-CA 3.46Å; S58-G61 PolarHBondContact O-N 2.87Å; S58-W62 VanDerWaalsContact O-CD1 3.23Å; S58-W62 PolarHBondContact O-N 3.29Å; S58-W62 PolarHBondContact OG-NE1 3.31Å |
| 59 | L | 89.5 | Confident | 85.6 | Confident | 112 Ų | 112 | 75.3 Ų | 75.3 | 59% | 0.586 | 39% | 0.392 | S | S | * | . | H | α-helix | trans | -56 | -40.2 | 177 | -165.6 | 72.7 | 0 | 0 | 0 | 111.9 | V55 L56 M57 W62 V63 | V55-L59 PolarHBondContact O-N 3.43Å; L56-L59 WeakPolarHBondContact O-CB 3.49Å; L56-L59 PolarHBondContact O-N 3.48Å; M57-L59 VanDerWaalsContact C-N 3.35Å; L59-W62 PolarHBondContact O-N 3.36Å; L59-V63 WeakPolarHBondContact O-CG2 3.27Å; L59-V63 PolarHBondContact O-N 2.86Å |
| 60 | G | 86.6 | Confident | 84.1 | Confident | 35 Ų | 35 | 72 Ų | 72 | 36% | 0.361 | 39% | 0.386 | S | S | . | . | H | α-helix | trans | -61.3 | -41.8 | 172.3 | 0 | 0 | 0 | 0 | 0 | 112.8 | M57 S58 V63 L64 | M57-G60 PolarHBondContact O-N 3.25Å; S58-G60 PolarHBondContact O-N 3.41Å; G60-V63 PolarHBondContact O-N 2.93Å; G60-L64 WeakPolarHBondContact O-CB 3.46Å; G60-L64 VanDerWaalsContact O-CG 3.27Å; G60-L64 WeakPolarHBondContact O-CG 3.27Å; G60-L64 PolarHBondContact O-N 2.92Å |
| 61 | G | 84.8 | Confident | 82.5 | Confident | 6 Ų | 6 | 74 Ų | 74 | 6% | 0.062 | 39% | 0.394 | C | S | . | . | H | α-helix | trans | -62.4 | -40.4 | 174.4 | 0 | 0 | 0 | 0 | 0 | 113.3 | M57 S58 L64 W65 | M57-G61 PolarHBondContact O-N 3.33Å; S58-G61 CarbonylContact O-C 3.55Å; S58-G61 WeakPolarHBondContact O-CA 3.46Å; S58-G61 PolarHBondContact O-N 2.87Å; G61-L64 PolarHBondContact O-N 3.49Å; G61-W65 VanDerWaalsContact O-CB 3.26Å; G61-W65 WeakPolarHBondContact O-CB 3.11Å; G61-W65 PolarHBondContact O-N 3.35Å |
| 62 | W | 84.5 | Confident | 80.8 | Confident | 110 Ų | 110 | 75.1 Ų | 75.1 | 42% | 0.417 | 41% | 0.406 | S | S | . | . | H | α-helix | trans | -64.9 | -42.1 | 174.2 | -78.5 | 102.5 | 0 | 0 | 0 | 112.5 | L14 A17 V18 S58 L59 W65 Y66 | L14-W62 HydrophobicContact CD1-CH2 4.46Å; L14-W62 HydrophobicContact CD1-CZ3 4.39Å; A17-W62 HydrophobicContact CB-CG 4.27Å; V18-W62 HydrophobicContact CG2-CZ2 4.36Å; S58-W62 VanDerWaalsContact O-CD1 3.23Å; S58-W62 PolarHBondContact O-N 3.29Å; S58-W62 PolarHBondContact OG-NE1 3.31Å; L59-W62 PolarHBondContact O-N 3.36Å; W62-W65 PolarHBondContact O-N 3.18Å; W62-Y66 WeakPolarHBondContact O-CB 3.42Å; W62-Y66 PolarHBondContact O-N 3.16Å |
| 63 | V | 84.8 | Confident | 78.8 | Confident | 95 Ų | 95 | 79.1 Ų | 79.1 | 58% | 0.576 | 42% | 0.42 | S | S | * | . | H | α-helix | trans | -63.6 | -46.9 | 175.7 | 171.1 | 0 | 0 | 0 | 0 | 111 | L59 G60 W65 Y66 S67 | L59-V63 WeakPolarHBondContact O-CG2 3.27Å; L59-V63 PolarHBondContact O-N 2.86Å; G60-V63 PolarHBondContact O-N 2.93Å; V63-W65 VanDerWaalsContact C-N 3.35Å; V63-W65 PolarHBondContact O-N 3.41Å; V63-Y66 PolarHBondContact O-N 3.5Å; V63-S67 WeakPolarHBondContact O-CB 3.23Å; V63-S67 PolarHBondContact O-N 2.94Å |
| 64 | L | 79.8 | Confident | 76.7 | Confident | 121 Ų | 121 | 78.7 Ų | 78.7 | 63% | 0.634 | 42% | 0.422 | S | S | * | . | H | α-helix | trans | -62.3 | -41.7 | 176.9 | -72.8 | 169.6 | 0 | 0 | 0 | 111.8 | G60 G61 G68 | G60-L64 WeakPolarHBondContact O-CB 3.46Å; G60-L64 VanDerWaalsContact O-CG 3.27Å; G60-L64 WeakPolarHBondContact O-CG 3.27Å; G60-L64 PolarHBondContact O-N 2.92Å; G61-L64 PolarHBondContact O-N 3.49Å; L64-G68 PolarHBondContact O-N 2.89Å |
| 65 | W | 79.8 | Confident | 74.8 | Confident | 56 Ų | 56 | 78.5 Ų | 78.5 | 21% | 0.212 | 43% | 0.43 | C | S | . | . | H | α-helix | trans | -64.2 | -42.3 | 174.9 | 172.2 | -95.1 | 0 | 0 | 0 | 112.3 | C10 L14 G61 W62 V63 G68 N69 | C10-W65 VanDerWaalsContact C-CE3 3.45Å; C10-W65 HydrophobicContact CB-CE3 4.14Å; C10-W65 HydrophobicContact CB-CZ3 3.96Å; C10-W65 WeakPolarHBondContact O-CZ3 3.21Å; L14-W65 HydrophobicContact CB-CD2 3.67Å; L14-W65 HydrophobicContact CB-CE3 3.43Å; L14-W65 VanDerWaalsContact CB-CE3 3.43Å; L14-W65 HydrophobicContact CB-CG 4.41Å; L14-W65 HydrophobicContact CB-CH2 3.69Å; L14-W65 HydrophobicContact CB-CZ2 3.99Å; L14-W65 HydrophobicContact CB-CZ3 3.43Å; L14-W65 VanDerWaalsContact CB-CZ3 3.43Å; L14-W65 HydrophobicContact CD1-CD2 3.96Å; L14-W65 HydrophobicContact CD1-CG 4.18Å; L14-W65 HydrophobicContact CD1-CZ2 4.01Å; L14-W65 HydrophobicContact CD2-CH2 3.62Å; L14-W65 HydrophobicContact CD2-CZ2 3.59Å; L14-W65 HydrophobicContact CD2-CZ3 4.27Å; L14-W65 HydrophobicContact CG-CD2 4.3Å; L14-W65 HydrophobicContact CG-CE3 4.45Å; L14-W65 HydrophobicContact CG-CH2 4.14Å; L14-W65 HydrophobicContact CG-CZ2 4.06Å; L14-W65 HydrophobicContact CG-CZ3 4.36Å; G61-W65 VanDerWaalsContact O-CB 3.26Å; G61-W65 WeakPolarHBondContact O-CB 3.11Å; G61-W65 PolarHBondContact O-N 3.35Å; W62-W65 PolarHBondContact O-N 3.18Å; V63-W65 VanDerWaalsContact C-N 3.35Å; V63-W65 PolarHBondContact O-N 3.41Å; W65-G68 PolarHBondContact O-N 2.83Å; W65-N69 WeakPolarHBondContact CZ2-ND2 3.49Å; W65-N69 PolarHBondContact NE1-ND2 3.42Å; W65-N69 WeakPolarHBondContact O-CB 3.42Å; W65-N69 PolarHBondContact O-N 2.97Å |
| 66 | Y | 73.8 | Confident | 73.1 | Confident | 168 Ų | 168 | 78.9 Ų | 78.9 | 66% | 0.659 | 44% | 0.435 | S | S | * | . | H | α-helix | trans | -65.9 | -45.3 | 179.1 | -165.2 | -88.7 | 0 | 0 | 0 | 111.2 | W62 V63 N69 I70 | W62-Y66 WeakPolarHBondContact O-CB 3.42Å; W62-Y66 PolarHBondContact O-N 3.16Å; V63-Y66 PolarHBondContact O-N 3.5Å; Y66-N69 PolarHBondContact O-N 3.2Å; Y66-I70 HydrophobicContact CE1-CG1 4.4Å; Y66-I70 PolarHBondContact O-N 2.76Å |
| 67 | S | 73.4 | Confident | 71.3 | Confident | 65 Ų | 65 | 81.8 Ų | 81.8 | 46% | 0.455 | 44% | 0.442 | S | S | . | . | H | α-helix | trans | -60.3 | -47 | 173.6 | -163.9 | 0 | 0 | 0 | 0 | 111.1 | V63 N69 I70 D71 | V63-S67 WeakPolarHBondContact O-CB 3.23Å; V63-S67 PolarHBondContact O-N 2.94Å; S67-N69 VanDerWaalsContact C-N 3.29Å; S67-N69 PolarHBondContact O-N 2.76Å; S67-I70 PolarHBondContact O-N 2.87Å; S67-D71 PolarHBondContact O-N 3.02Å |
| 68 | G | 70.6 | Confident | 69.9 | Low | 22 Ų | 22 | 83 Ų | 83 | 23% | 0.227 | 45% | 0.447 | C | S | . | . | H | α-helix | trans | -65.2 | -26.2 | 177.2 | 0 | 0 | 0 | 0 | 0 | 114.3 | L64 W65 G72 | L64-G68 PolarHBondContact O-N 2.89Å; W65-G68 PolarHBondContact O-N 2.83Å; G68-G72 WeakPolarHBondContact O-CA 3.44Å; G68-G72 PolarHBondContact O-N 3.45Å |
| 69 | N | 67.5 | Low | 68.5 | Low | 71 Ų | 71 | 86.7 Ų | 86.7 | 38% | 0.38 | 47% | 0.466 | S | S | . | . | H | α-helix | trans | -71.9 | -39.2 | 174.8 | -122.2 | -78.1 | 0 | 0 | 0 | 112 | W65 Y66 S67 L73 | W65-N69 WeakPolarHBondContact CZ2-ND2 3.49Å; W65-N69 PolarHBondContact NE1-ND2 3.42Å; W65-N69 WeakPolarHBondContact O-CB 3.42Å; W65-N69 PolarHBondContact O-N 2.97Å; Y66-N69 PolarHBondContact O-N 3.2Å; S67-N69 VanDerWaalsContact C-N 3.29Å; S67-N69 PolarHBondContact O-N 2.76Å; N69-L73 PolarHBondContact O-N 3.19Å |
| 70 | I | 59.4 | Low | 67.3 | Low | 105 Ų | 105 | 83.3 Ų | 83.3 | 54% | 0.538 | 46% | 0.459 | S | S | . | . | H | α-helix | trans | -72.2 | -43.8 | 177.9 | -59.4 | -64.5 | 0 | 0 | 0 | 110.5 | Y66 S67 | Y66-I70 HydrophobicContact CE1-CG1 4.4Å; Y66-I70 PolarHBondContact O-N 2.76Å; S67-I70 PolarHBondContact O-N 2.87Å |
| 71 | D | 58.7 | Low | 66.2 | Low | 99 Ų | 99 | 87.9 Ų | 87.9 | 53% | 0.529 | 47% | 0.47 | S | S | . | . | H | α-helix | trans | -73.5 | -31.4 | 176.7 | -74.4 | -58.8 | 0 | 0 | 0 | 113 | S67 L73 V74 S75 | S67-D71 PolarHBondContact O-N 3.02Å; D71-L73 VanDerWaalsContact C-N 3.34Å; D71-L73 PolarHBondContact O-N 3.14Å; D71-V74 PolarHBondContact O-N 3.4Å; D71-S75 WeakPolarHBondContact O-CB 3.2Å; D71-S75 PolarHBondContact O-N 2.86Å |
| 72 | G | 56.7 | Low | 65.5 | Low | 23 Ų | 23 | 91 Ų | 91 | 24% | 0.237 | 49% | 0.485 | C | S | . | . | H | α-helix | trans | -68.5 | -27.1 | -179 | 0 | 0 | 0 | 0 | 0 | 114.2 | G68 S76 | G68-G72 WeakPolarHBondContact O-CA 3.44Å; G68-G72 PolarHBondContact O-N 3.45Å; G72-S76 VanDerWaalsContact O-CB 3.23Å; G72-S76 WeakPolarHBondContact O-CB 3.07Å; G72-S76 PolarHBondContact O-N 3.06Å; G72-S76 PolarHBondContact O-OG 3.31Å |
| 73 | L | 51.9 | Low | 65 | Low | 124 Ų | 124 | 87.7 Ų | 87.7 | 65% | 0.649 | 48% | 0.484 | S | S | * | . | H | α-helix | trans | -69 | -35.8 | 171.4 | -87.2 | 161.8 | 0 | 0 | 0 | 112.2 | N69 D71 | N69-L73 PolarHBondContact O-N 3.19Å; D71-L73 VanDerWaalsContact C-N 3.34Å; D71-L73 PolarHBondContact O-N 3.14Å |
| 74 | V | 51.1 | Low | 64.5 | Low | 103 Ų | 103 | 87.1 Ų | 87.1 | 62% | 0.624 | 48% | 0.481 | S | S | * | . | H | α-helix | trans | -75.3 | -46.6 | 175.9 | -179.3 | 0 | 0 | 0 | 0 | 109.9 | D71 K77 E78 | D71-V74 PolarHBondContact O-N 3.4Å; V74-K77 PolarHBondContact O-N 2.78Å; V74-E78 PolarHBondContact O-N 2.76Å |
| 75 | S | 53.4 | Low | 64.5 | Low | 67 Ų | 67 | 84.9 Ų | 84.9 | 47% | 0.469 | 47% | 0.473 | S | S | . | . | H | α-helix | trans | -65.9 | -39.6 | 179.9 | -173.8 | 0 | 0 | 0 | 0 | 113.1 | D71 K77 E78 L79 | D71-S75 WeakPolarHBondContact O-CB 3.2Å; D71-S75 PolarHBondContact O-N 2.86Å; S75-K77 PolarHBondContact O-N 3.34Å; S75-E78 PolarHBondContact O-N 3.34Å; S75-L79 WeakPolarHBondContact O-CB 3.46Å; S75-L79 PolarHBondContact O-N 3.47Å |
| 76 | S | 56.9 | Low | 64.6 | Low | 60 Ų | 60 | 86.2 Ų | 86.2 | 42% | 0.42 | 49% | 0.487 | S | S | . | . | H | α-helix | trans | -67 | -35.7 | 177.7 | -68.6 | 0 | 0 | 0 | 0 | 112.9 | G72 G80 | G72-S76 VanDerWaalsContact O-CB 3.23Å; G72-S76 WeakPolarHBondContact O-CB 3.07Å; G72-S76 PolarHBondContact O-N 3.06Å; G72-S76 PolarHBondContact O-OG 3.31Å; S76-G80 PolarHBondContact O-N 3Å |
| 77 | K | 55.7 | Low | 64.9 | Low | 180 Ų | 180 | 81.8 Ų | 81.8 | 78% | 0.783 | 48% | 0.475 | S | S | * | . | H | α-helix | trans | -67.8 | -41.7 | 173.8 | -106.7 | 179 | 174.3 | 172.6 | 0 | 111.4 | V74 S75 H81 | V74-K77 PolarHBondContact O-N 2.78Å; S75-K77 PolarHBondContact O-N 3.34Å; K77-H81 PolarHBondContact O-N 2.9Å; K77-H81 VanDerWaalsContact O-N 3.14Å |
| 78 | E | 59.1 | Low | 65.3 | Low | 122 Ų | 122 | 87.6 Ų | 87.6 | 57% | 0.57 | 49% | 0.487 | S | S | * | . | H | α-helix | trans | -68.1 | -44.2 | 177.2 | -131.1 | -130.9 | 128.8 | 0 | 0 | 111.5 | V74 S75 G80 H81 I82 | V74-E78 PolarHBondContact O-N 2.76Å; S75-E78 PolarHBondContact O-N 3.34Å; E78-G80 PolarHBondContact O-N 3.08Å; E78-H81 CarbonylContact O-C 3.58Å; E78-H81 PolarHBondContact O-N 3.46Å; E78-H81 VanDerWaalsContact O-N 3.14Å; E78-I82 WeakPolarHBondContact O-CG1 3.34Å; E78-I82 PolarHBondContact O-N 2.79Å; E78-I82 WeakPolarHBondContact OE1-CD1 3.22Å |
| 79 | L | 61.5 | Low | 65.8 | Low | 76 Ų | 76 | 91.5 Ų | 91.5 | 40% | 0.398 | 50% | 0.502 | S | S | . | . | H | α-helix | trans | -67.2 | -35.4 | 179.7 | -160.9 | 73.4 | 0 | 0 | 0 | 112.4 | L3 S75 I82 G83 | L3-L79 HydrophobicContact CD2-CD1 4Å; S75-L79 WeakPolarHBondContact O-CB 3.46Å; S75-L79 PolarHBondContact O-N 3.47Å; L79-I82 PolarHBondContact O-N 2.88Å; L79-G83 PolarHBondContact O-N 3.29Å |
| 80 | G | 62.5 | Low | 66.6 | Low | 42 Ų | 42 | 90.5 Ų | 90.5 | 43% | 0.433 | 50% | 0.504 | S | S | . | . | H | α-helix | trans | -63.6 | -41.9 | 170.5 | 0 | 0 | 0 | 0 | 0 | 112.2 | S76 E78 T84 | S76-G80 PolarHBondContact O-N 3Å; E78-G80 PolarHBondContact O-N 3.08Å; G80-T84 WeakPolarHBondContact O-CG2 3.23Å; G80-T84 PolarHBondContact O-N 2.82Å; G80-T84 VanDerWaalsContact O-N 3.08Å; G80-T84 PolarHBondContact O-OG1 2.68Å |
| 81 | H | 64.5 | Low | 67.6 | Low | 131 Ų | 131 | 92 Ų | 92 | 61% | 0.606 | 50% | 0.503 | S | S | * | . | H | α-helix | trans | -67.5 | -42 | 175 | -161.6 | -46.7 | 0 | 0 | 0 | 111.7 | K77 E78 T84 T85 | K77-H81 PolarHBondContact O-N 2.9Å; K77-H81 VanDerWaalsContact O-N 3.14Å; E78-H81 CarbonylContact O-C 3.58Å; E78-H81 PolarHBondContact O-N 3.46Å; E78-H81 VanDerWaalsContact O-N 3.14Å; H81-T84 PolarHBondContact O-N 3.14Å; H81-T84 PolarHBondContact O-OG1 3.06Å; H81-T85 PolarHBondContact ND1-OG1 2.64Å; H81-T85 PolarHBondContact O-N 3.4Å; H81-T85 PolarHBondContact O-OG1 3.32Å |
| 82 | I | 70.9 | Confident | 68.7 | Low | 71 Ų | 71 | 90.7 Ų | 90.7 | 36% | 0.364 | 50% | 0.498 | S | S | . | . | H | α-helix | trans | -64.6 | -45.4 | 177.4 | -65 | 161.3 | 0 | 0 | 0 | 109.8 | E78 L79 T84 T85 V86 | E78-I82 WeakPolarHBondContact O-CG1 3.34Å; E78-I82 PolarHBondContact O-N 2.79Å; E78-I82 WeakPolarHBondContact OE1-CD1 3.22Å; L79-I82 PolarHBondContact O-N 2.88Å; I82-T84 PolarHBondContact O-N 3.44Å; I82-T85 WeakPolarHBondContact O-CB 3.48Å; I82-T85 PolarHBondContact O-N 3.06Å; I82-V86 HydrophobicContact CG2-CG2 4.06Å; I82-V86 VanDerWaalsContact O-CG2 3.29Å; I82-V86 WeakPolarHBondContact O-CG2 3.44Å; I82-V86 PolarHBondContact O-N 2.89Å |
| 83 | G | 73.8 | Confident | 69.7 | Low | 40 Ų | 40 | 94.4 Ų | 94.4 | 41% | 0.412 | 51% | 0.512 | S | S | . | . | H | α-helix | trans | -56.2 | -46.8 | 177.2 | 0 | 0 | 0 | 0 | 0 | 112.5 | L79 T85 V86 D87 | L79-G83 PolarHBondContact O-N 3.29Å; G83-T85 VanDerWaalsContact C-N 3.31Å; G83-T85 PolarHBondContact O-N 3.05Å; G83-V86 PolarHBondContact O-N 3.43Å; G83-D87 VanDerWaalsContact O-CB 3.23Å; G83-D87 WeakPolarHBondContact O-CB 3.29Å; G83-D87 PolarHBondContact O-N 2.85Å |
| 84 | T | 74.2 | Confident | 71 | Confident | 83 Ų | 83 | 91.9 Ų | 91.9 | 51% | 0.509 | 51% | 0.505 | S | S | . | . | H | α-helix | trans | -65.9 | -32.2 | 176.4 | 58.4 | 0 | 0 | 0 | 0 | 113.1 | G80 H81 I82 R88 | G80-T84 WeakPolarHBondContact O-CG2 3.23Å; G80-T84 PolarHBondContact O-N 2.82Å; G80-T84 VanDerWaalsContact O-N 3.08Å; G80-T84 PolarHBondContact O-OG1 2.68Å; H81-T84 PolarHBondContact O-N 3.14Å; H81-T84 PolarHBondContact O-OG1 3.06Å; I82-T84 PolarHBondContact O-N 3.44Å; T84-R88 WeakPolarHBondContact O-CG 3.48Å; T84-R88 PolarHBondContact O-N 2.73Å |
| 85 | T | 78.3 | Confident | 72.2 | Confident | 74 Ų | 74 | 94.2 Ų | 94.2 | 45% | 0.454 | 50% | 0.503 | S | S | . | . | H | α-helix | trans | -71.7 | -44.4 | 178.1 | -46.2 | 0 | 0 | 0 | 0 | 111.1 | H81 I82 G83 D87 R88 L89 | H81-T85 PolarHBondContact ND1-OG1 2.64Å; H81-T85 PolarHBondContact O-N 3.4Å; H81-T85 PolarHBondContact O-OG1 3.32Å; I82-T85 WeakPolarHBondContact O-CB 3.48Å; I82-T85 PolarHBondContact O-N 3.06Å; G83-T85 VanDerWaalsContact C-N 3.31Å; G83-T85 PolarHBondContact O-N 3.05Å; T85-D87 VanDerWaalsContact C-N 3.33Å; T85-R88 PolarHBondContact O-N 3.45Å; T85-L89 WeakPolarHBondContact O-CB 3.42Å; T85-L89 PolarHBondContact O-N 2.87Å |
| 86 | V | 82.3 | Confident | 73.2 | Confident | 85 Ų | 85 | 98.5 Ų | 98.5 | 52% | 0.515 | 51% | 0.513 | S | S | . | . | H | α-helix | trans | -65 | -38.8 | 175.1 | 178.3 | 0 | 0 | 0 | 0 | 110.5 | I82 G83 L89 A90 | I82-V86 HydrophobicContact CG2-CG2 4.06Å; I82-V86 VanDerWaalsContact O-CG2 3.29Å; I82-V86 WeakPolarHBondContact O-CG2 3.44Å; I82-V86 PolarHBondContact O-N 2.89Å; G83-V86 PolarHBondContact O-N 3.43Å; V86-L89 CarbonylContact O-C 3.59Å; V86-L89 PolarHBondContact O-N 3.1Å; V86-A90 VanDerWaalsContact O-CB 3.26Å; V86-A90 WeakPolarHBondContact O-CB 3.49Å; V86-A90 PolarHBondContact O-N 3.49Å |
| 87 | D | 81.6 | Confident | 73.8 | Confident | 75 Ų | 75 | 101.9 Ų | 101.9 | 40% | 0.401 | 52% | 0.524 | S | S | . | . | H | α-helix | trans | -65.6 | -38.9 | 177.4 | -162.6 | -106.6 | 0 | 0 | 0 | 112 | G83 T85 A90 R91 | G83-D87 VanDerWaalsContact O-CB 3.23Å; G83-D87 WeakPolarHBondContact O-CB 3.29Å; G83-D87 PolarHBondContact O-N 2.85Å; T85-D87 VanDerWaalsContact C-N 3.33Å; D87-A90 PolarHBondContact O-N 3.39Å; D87-R91 WeakPolarHBondContact O-CG 3.44Å; D87-R91 PolarHBondContact O-N 2.97Å; D87-R91 IonicContact OD1-CZ 2.94Å; D87-R91 IonicContact OD1-NE 3.98Å; D87-R91 IonicContact OD1-NH1 2.68Å; D87-R91 PolarHBondContact OD1-NH1 3.36Å; D87-R91 IonicContact OD1-NH2 2.73Å; D87-R91 PolarHBondContact OD1-NH2 2.75Å |
| 88 | R | 80.4 | Confident | 74.2 | Confident | 187 Ų | 187 | 99.3 Ų | 99.3 | 71% | 0.706 | 51% | 0.514 | S | S | * | . | H | α-helix | trans | -65.3 | -39.8 | 171 | -77.9 | -174 | 178.9 | -158 | 2.1 | 112.6 | T84 T85 T92 | T84-R88 WeakPolarHBondContact O-CG 3.48Å; T84-R88 PolarHBondContact O-N 2.73Å; T85-R88 PolarHBondContact O-N 3.45Å; R88-T92 PolarHBondContact O-N 2.95Å; R88-T92 VanDerWaalsContact O-N 3.1Å; R88-T92 PolarHBondContact O-OG1 3.43Å |
| 89 | L | 81.9 | Confident | 74.3 | Confident | 103 Ų | 103 | 98.8 Ų | 98.8 | 54% | 0.539 | 51% | 0.514 | S | S | . | . | H | α-helix | trans | -66.4 | -45.1 | 176.2 | -173 | 65.2 | 0 | 0 | 0 | 110.9 | T85 V86 R91 T92 L93 | T85-L89 WeakPolarHBondContact O-CB 3.42Å; T85-L89 PolarHBondContact O-N 2.87Å; V86-L89 CarbonylContact O-C 3.59Å; V86-L89 PolarHBondContact O-N 3.1Å; L89-R91 PolarHBondContact O-N 3.21Å; L89-T92 WeakPolarHBondContact O-CB 3.15Å; L89-T92 PolarHBondContact O-N 3.5Å; L89-L93 HydrophobicContact CG-CD1 4.14Å; L89-L93 HydrophobicContact CG-CG 4.45Å; L89-L93 WeakPolarHBondContact O-CG 3.26Å; L89-L93 PolarHBondContact O-N 2.84Å |
| 90 | A | 83.8 | Confident | 74.1 | Confident | 51 Ų | 51 | 102.6 Ų | 102.6 | 42% | 0.421 | 53% | 0.529 | S | S | . | . | H | α-helix | trans | -59.2 | -43.5 | 176.3 | 0 | 0 | 0 | 0 | 0 | 111.4 | V86 D87 T92 L93 S94 | V86-A90 VanDerWaalsContact O-CB 3.26Å; V86-A90 WeakPolarHBondContact O-CB 3.49Å; V86-A90 PolarHBondContact O-N 3.49Å; D87-A90 PolarHBondContact O-N 3.39Å; A90-T92 VanDerWaalsContact C-N 3.3Å; A90-T92 PolarHBondContact O-N 3.49Å; A90-L93 PolarHBondContact O-N 3.45Å; A90-S94 WeakPolarHBondContact O-CB 3.4Å; A90-S94 PolarHBondContact O-N 3.07Å |
| 91 | R | 80.8 | Confident | 74 | Confident | 136 Ų | 136 | 110.8 Ų | 110.8 | 51% | 0.513 | 55% | 0.547 | S | S | . | . | H | α-helix | trans | -61.8 | -37.3 | 172.8 | -74.8 | -166.2 | -168.5 | 90.3 | 8.7 | 112.7 | D87 L89 R95 | D87-R91 WeakPolarHBondContact O-CG 3.44Å; D87-R91 PolarHBondContact O-N 2.97Å; D87-R91 IonicContact OD1-CZ 2.94Å; D87-R91 IonicContact OD1-NE 3.98Å; D87-R91 IonicContact OD1-NH1 2.68Å; D87-R91 PolarHBondContact OD1-NH1 3.36Å; D87-R91 IonicContact OD1-NH2 2.73Å; D87-R91 PolarHBondContact OD1-NH2 2.75Å; L89-R91 PolarHBondContact O-N 3.21Å; R91-R95 WeakPolarHBondContact O-CG 3.43Å; R91-R95 PolarHBondContact O-N 2.82Å |
| 92 | T | 81.7 | Confident | 73.5 | Confident | 72 Ų | 72 | 112.1 Ų | 112.1 | 44% | 0.442 | 55% | 0.553 | S | S | . | * | H | α-helix | trans | -72.3 | -42.4 | -179.7 | -56 | 0 | 0 | 0 | 0 | 111.6 | R88 L89 A90 R95 K96 | R88-T92 PolarHBondContact O-N 2.95Å; R88-T92 VanDerWaalsContact O-N 3.1Å; R88-T92 PolarHBondContact O-OG1 3.43Å; L89-T92 WeakPolarHBondContact O-CB 3.15Å; L89-T92 PolarHBondContact O-N 3.5Å; A90-T92 VanDerWaalsContact C-N 3.3Å; A90-T92 PolarHBondContact O-N 3.49Å; T92-R95 PolarHBondContact O-N 3.19Å; T92-K96 PolarHBondContact O-N 3.06Å |
| 93 | L | 78 | Confident | 72.8 | Confident | 101 Ų | 101 | 118.7 Ų | 118.7 | 53% | 0.529 | 57% | 0.574 | S | S | . | * | H | α-helix | trans | -66.2 | -41.1 | 174.4 | -67.8 | 176.7 | 0 | 0 | 0 | 111.7 | L89 A90 R95 K96 M97 | L89-L93 HydrophobicContact CG-CD1 4.14Å; L89-L93 HydrophobicContact CG-CG 4.45Å; L89-L93 WeakPolarHBondContact O-CG 3.26Å; L89-L93 PolarHBondContact O-N 2.84Å; A90-L93 PolarHBondContact O-N 3.45Å; L93-R95 PolarHBondContact O-N 3.47Å; L93-K96 PolarHBondContact O-N 3.47Å; L93-M97 WeakPolarHBondContact O-CB 3.49Å; L93-M97 PolarHBondContact O-N 2.98Å |
| 94 | S | 79.7 | Confident | 72 | Confident | 71 Ų | 71 | 119.1 Ų | 119.1 | 50% | 0.497 | 58% | 0.578 | S | S | . | * | H | α-helix | trans | -59.8 | -46.5 | 175.8 | -176.2 | 0 | 0 | 0 | 0 | 111.7 | A90 K96 M97 H98 | A90-S94 WeakPolarHBondContact O-CB 3.4Å; A90-S94 PolarHBondContact O-N 3.07Å; S94-K96 VanDerWaalsContact C-N 3.35Å; S94-K96 PolarHBondContact O-N 3.03Å; S94-M97 PolarHBondContact O-N 3.4Å; S94-H98 WeakPolarHBondContact O-CB 3.48Å; S94-H98 PolarHBondContact O-N 3.39Å |
| 95 | R | 75.9 | Confident | 71.1 | Confident | 152 Ų | 152 | 125.1 Ų | 125.1 | 57% | 0.574 | 62% | 0.618 | S | S | * | * | H | α-helix | trans | -60 | -43 | 173.9 | -77.3 | -170 | -65.8 | -106.7 | -0.1 | 112.5 | R91 T92 L93 H98 I99 | R91-R95 WeakPolarHBondContact O-CG 3.43Å; R91-R95 PolarHBondContact O-N 2.82Å; T92-R95 PolarHBondContact O-N 3.19Å; L93-R95 PolarHBondContact O-N 3.47Å; R95-H98 PolarHBondContact O-N 3.42Å; R95-I99 WeakPolarHBondContact O-CG1 3.36Å; R95-I99 PolarHBondContact O-N 2.87Å |
| 96 | K | 73.6 | Confident | 70.7 | Confident | 157 Ų | 157 | 127.7 Ų | 127.7 | 68% | 0.683 | 63% | 0.627 | S | S | * | * | H | α-helix | trans | -68.1 | -38.8 | -178.5 | -159.6 | 179 | -177.2 | -172.2 | 0 | 112 | T92 L93 S94 I99 H100 | T92-K96 PolarHBondContact O-N 3.06Å; L93-K96 PolarHBondContact O-N 3.47Å; S94-K96 VanDerWaalsContact C-N 3.35Å; S94-K96 PolarHBondContact O-N 3.03Å; K96-I99 PolarHBondContact O-N 3.2Å; K96-H100 PolarHBondContact O-N 3.3Å; K96-H100 VanDerWaalsContact O-N 3.09Å |
| 97 | M | 69.3 | Low | 70.1 | Confident | 131 Ų | 131 | 129.9 Ų | 129.9 | 65% | 0.645 | 63% | 0.632 | S | S | * | * | H | α-helix | trans | -70.5 | -36.4 | 177.6 | -176.2 | 161 | 50.1 | 0 | 0 | 112.4 | L93 S94 H100 R101 | L93-M97 WeakPolarHBondContact O-CB 3.49Å; L93-M97 PolarHBondContact O-N 2.98Å; S94-M97 PolarHBondContact O-N 3.4Å; M97-H100 PolarHBondContact O-N 3.47Å; M97-R101 WeakPolarHBondContact O-CB 3.47Å; M97-R101 PolarHBondContact O-N 3.41Å |
| 98 | H | 63.6 | Low | 69.5 | Low | 126 Ų | 126 | 133 Ų | 133 | 58% | 0.583 | 65% | 0.645 | S | S | * | * | H | α-helix | trans | -64.6 | -40.1 | 174.5 | -166.2 | -79.5 | 0 | 0 | 0 | 112.3 | S94 R95 H100 R101 H102 | S94-H98 WeakPolarHBondContact O-CB 3.48Å; S94-H98 PolarHBondContact O-N 3.39Å; R95-H98 PolarHBondContact O-N 3.42Å; H98-H100 VanDerWaalsContact C-N 3.34Å; H98-R101 PolarHBondContact O-N 2.94Å; H98-H102 AromaticContact CE1-CD2 3.84Å; H98-H102 PolarHBondContact O-N 3.09Å |
| 99 | I | 62.3 | Low | 68.8 | Low | 110 Ų | 110 | 129.8 Ų | 129.8 | 56% | 0.564 | 64% | 0.642 | S | S | * | * | H | α-helix | trans | -66.6 | -37.5 | 175.3 | -68.5 | 169.9 | 0 | 0 | 0 | 111.1 | R95 K96 | R95-I99 WeakPolarHBondContact O-CG1 3.36Å; R95-I99 PolarHBondContact O-N 2.87Å; K96-I99 PolarHBondContact O-N 3.2Å |
| 100 | H | 57.8 | Low | 68 | Low | 156 Ų | 156 | 131.5 Ų | 131.5 | 72% | 0.722 | 65% | 0.648 | S | S | * | * | H | α-helix | trans | -70.7 | -33.9 | 178 | -137.8 | 38.9 | 0 | 0 | 0 | 112.4 | K96 M97 H98 H102 R103 | K96-H100 PolarHBondContact O-N 3.3Å; K96-H100 VanDerWaalsContact O-N 3.09Å; M97-H100 PolarHBondContact O-N 3.47Å; H98-H100 VanDerWaalsContact C-N 3.34Å; H100-H102 VanDerWaalsContact C-N 3.34Å; H100-H102 PolarHBondContact O-N 3.3Å; H100-R103 PolarHBondContact O-N 3.26Å |
| 101 | R | 59.1 | Low | 67 | Low | 215 Ų | 215 | 136.9 Ų | 136.9 | 81% | 0.811 | 66% | 0.663 | S | S | * | * | H | α-helix | trans | -72.3 | -24.3 | 178.8 | -164 | 141.8 | 86.9 | 103.6 | -4.8 | 114 | M97 H98 | M97-R101 WeakPolarHBondContact O-CB 3.47Å; M97-R101 PolarHBondContact O-N 3.41Å; H98-R101 PolarHBondContact O-N 2.94Å |
| 102 | H | 55.7 | Low | 66 | Low | 158 Ų | 158 | 136.9 Ų | 136.9 | 73% | 0.731 | 67% | 0.674 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -90 | 2.8 | 173.6 | -106.2 | -69.9 | 0 | 0 | 0 | 114.2 | H98 H100 | H98-H102 AromaticContact CE1-CD2 3.84Å; H98-H102 PolarHBondContact O-N 3.09Å; H100-H102 VanDerWaalsContact C-N 3.34Å; H100-H102 PolarHBondContact O-N 3.3Å |
| 103 | R | 55.2 | Low | 64.8 | Low | 210 Ų | 210 | 141.9 Ų | 141.9 | 79% | 0.792 | 69% | 0.692 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -123.4 | 26.9 | 179 | -131.6 | -178.7 | -171.3 | 149.5 | 1 | 112.2 | H100 | H100-R103 PolarHBondContact O-N 3.26Š|
| 104 | G | 57.7 | Low | 63.7 | Low | 49 Ų | 49 | 145.3 Ų | 145.3 | 51% | 0.505 | 71% | 0.705 | S | S | . | * | trans | -71.2 | 147.9 | 157.2 | 0 | 0 | 0 | 0 | 0 | 109.4 | ||||
| 105 | P | 54.4 | Low | 62.2 | Low | 209 Ų | 209 | 152.1 Ų | 152.1 | 100% | 1.357 | 72% | 0.724 | S | S | * | * | trans | -56.7 | 0 | -171 | 26.5 | -35.9 | 0 | 0 | 0 | 114.2 |
Retrieved 105 of 105 residues in 66.2 ms
(Link to these results)