| 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 | 48.7 | Very low | 61.2 | Low | 226 Ų | 226 | 113.6 Ų | 113.6 | 100% | 1.113 | 67% | 0.666 | S | S | * | * | 0 | 57.1 | 0 | -64.4 | 161.8 | 87.3 | 0 | 0 | 111.1 | |||||
| 2 | M | 51.5 | Low | 62.8 | Low | 162 Ų | 162 | 108.2 Ų | 108.2 | 80% | 0.798 | 65% | 0.652 | S | S | * | * | trans | -107.6 | -17 | -179.4 | -89.1 | 83.2 | 171.3 | 0 | 0 | 114.5 | ||||
| 3 | G | 54.5 | Low | 64.5 | Low | 53 Ų | 53 | 106.5 Ų | 106.5 | 55% | 0.546 | 64% | 0.642 | S | S | . | * | H | α-helix | trans | -77.6 | -22.2 | -170.6 | 0 | 0 | 0 | 0 | 0 | 116.6 | T6 S7 | G3-T6 PolarHBondContact O-OG1 3.37Å; G3-S7 WeakPolarHBondContact O-CB 3.33Å; G3-S7 PolarHBondContact O-N 3.2Å |
| 4 | A | 56.6 | Low | 65.6 | Low | 76 Ų | 76 | 103.1 Ų | 103.1 | 63% | 0.628 | 63% | 0.63 | S | S | * | * | H | α-helix | trans | -74 | -33.7 | -177.7 | 0 | 0 | 0 | 0 | 0 | 112.7 | T8 | A4-T8 PolarHBondContact O-N 2.96Å; A4-T8 PolarHBondContact O-OG1 3.29Å |
| 5 | K | 55.8 | Low | 66.9 | Low | 161 Ų | 161 | 98.3 Ų | 98.3 | 70% | 0.7 | 61% | 0.61 | S | S | * | * | H | α-helix | trans | -77.1 | -34.7 | -176.3 | -53.6 | 179.8 | -178.7 | -176.8 | 0 | 112.3 | T8 M9 | K5-T8 PolarHBondContact O-OG1 3.12Å; K5-T8 VanDerWaalsContact O-OG1 3.12Å; K5-M9 PolarHBondContact O-N 3.41Å |
| 6 | T | 60.6 | Low | 68.1 | Low | 87 Ų | 87 | 96.3 Ų | 96.3 | 53% | 0.534 | 61% | 0.606 | S | S | . | * | H | α-helix | trans | -74.3 | -38.3 | 176.3 | 53.1 | 0 | 0 | 0 | 0 | 111.1 | G3 M9 V10 | G3-T6 PolarHBondContact O-OG1 3.37Å; T6-M9 PolarHBondContact O-N 3.17Å; T6-V10 WeakPolarHBondContact O-CB 3.36Å; T6-V10 WeakPolarHBondContact O-CG2 3.22Å; T6-V10 PolarHBondContact O-N 3.06Å |
| 7 | S | 60.9 | Low | 69.2 | Low | 79 Ų | 79 | 98.1 Ų | 98.1 | 55% | 0.552 | 61% | 0.609 | S | S | * | * | H | α-helix | trans | -65.2 | -40.2 | 178.3 | -163.9 | 0 | 0 | 0 | 0 | 112.8 | G3 V10 A11 | G3-S7 WeakPolarHBondContact O-CB 3.33Å; G3-S7 PolarHBondContact O-N 3.2Å; S7-V10 PolarHBondContact O-N 3.07Å; S7-A11 WeakPolarHBondContact O-CB 3.35Å; S7-A11 PolarHBondContact O-N 3.29Å |
| 8 | T | 66.2 | Low | 70.3 | Confident | 99 Ų | 99 | 100.4 Ų | 100.4 | 61% | 0.607 | 61% | 0.61 | S | S | * | * | H | α-helix | trans | -69 | -38.3 | 175.9 | 50.2 | 0 | 0 | 0 | 0 | 112.9 | A4 K5 G12 | A4-T8 PolarHBondContact O-N 2.96Å; A4-T8 PolarHBondContact O-OG1 3.29Å; K5-T8 PolarHBondContact O-OG1 3.12Å; K5-T8 VanDerWaalsContact O-OG1 3.12Å; T8-G12 PolarHBondContact O-N 3.46Å; T8-G12 VanDerWaalsContact O-N 3.07Å |
| 9 | M | 72.3 | Confident | 71.2 | Confident | 141 Ų | 141 | 101 Ų | 101 | 70% | 0.695 | 61% | 0.608 | S | S | * | * | H | α-helix | trans | -65.5 | -43 | 173.4 | -79.3 | -151 | 90.5 | 0 | 0 | 112.2 | K5 T6 G12 V13 | K5-M9 PolarHBondContact O-N 3.41Å; T6-M9 PolarHBondContact O-N 3.17Å; M9-G12 PolarHBondContact O-N 3.46Å; M9-V13 WeakPolarHBondContact O-CG2 3.42Å; M9-V13 PolarHBondContact O-N 2.95Å |
| 10 | V | 72.8 | Confident | 72 | Confident | 101 Ų | 101 | 98 Ų | 98 | 61% | 0.612 | 60% | 0.598 | S | S | * | * | H | α-helix | trans | -65.9 | -42 | 179.7 | 170.4 | 0 | 0 | 0 | 0 | 111.2 | T6 S7 G12 V13 A14 | T6-V10 WeakPolarHBondContact O-CB 3.36Å; T6-V10 WeakPolarHBondContact O-CG2 3.22Å; T6-V10 PolarHBondContact O-N 3.06Å; S7-V10 PolarHBondContact O-N 3.07Å; V10-G12 PolarHBondContact O-N 3.48Å; V10-V13 PolarHBondContact O-N 3.48Å; V10-A14 WeakPolarHBondContact O-CB 3.4Å; V10-A14 PolarHBondContact O-N 3.1Å |
| 11 | A | 73.4 | Confident | 72.7 | Confident | 65 Ų | 65 | 100.1 Ų | 100.1 | 54% | 0.537 | 60% | 0.596 | S | S | . | * | H | α-helix | trans | -63.9 | -38.6 | 176 | 0 | 0 | 0 | 0 | 0 | 112.5 | S7 G15 | S7-A11 WeakPolarHBondContact O-CB 3.35Å; S7-A11 PolarHBondContact O-N 3.29Å; A11-G15 PolarHBondContact O-N 3.04Å |
| 12 | G | 80.8 | Confident | 74.4 | Confident | 48 Ų | 48 | 92 Ų | 92 | 50% | 0.495 | 56% | 0.561 | S | S | . | * | H | α-helix | trans | -65.1 | -42.8 | 176.1 | 0 | 0 | 0 | 0 | 0 | 113.3 | T8 M9 V10 G15 A16 | T8-G12 PolarHBondContact O-N 3.46Å; T8-G12 VanDerWaalsContact O-N 3.07Å; M9-G12 PolarHBondContact O-N 3.46Å; V10-G12 PolarHBondContact O-N 3.48Å; G12-G15 PolarHBondContact O-N 3.35Å; G12-A16 PolarHBondContact O-N 2.97Å |
| 13 | V | 84.1 | Confident | 76 | Confident | 87 Ų | 87 | 88.6 Ų | 88.6 | 53% | 0.527 | 55% | 0.549 | S | S | . | . | H | α-helix | trans | -67.4 | -43.3 | 177.7 | 174.6 | 0 | 0 | 0 | 0 | 111.2 | M9 V10 G15 A16 L17 | M9-V13 WeakPolarHBondContact O-CG2 3.42Å; M9-V13 PolarHBondContact O-N 2.95Å; V10-V13 PolarHBondContact O-N 3.48Å; V13-G15 PolarHBondContact O-N 2.91Å; V13-A16 PolarHBondContact O-N 3.39Å; V13-L17 HydrophobicContact CG1-CD1 4.17Å; V13-L17 WeakPolarHBondContact O-CG 3.43Å; V13-L17 PolarHBondContact O-N 3Å; V13-L17 VanDerWaalsContact O-N 3.1Å |
| 14 | A | 80.6 | Confident | 77.4 | Confident | 58 Ų | 58 | 92.6 Ų | 92.6 | 48% | 0.479 | 55% | 0.549 | S | S | . | . | H | α-helix | trans | -62.8 | -41.4 | 176.5 | 0 | 0 | 0 | 0 | 0 | 112 | V10 L17 F18 | V10-A14 WeakPolarHBondContact O-CB 3.4Å; V10-A14 PolarHBondContact O-N 3.1Å; A14-L17 PolarHBondContact O-N 3.41Å; A14-F18 WeakPolarHBondContact O-CB 3.38Å; A14-F18 PolarHBondContact O-N 2.93Å |
| 15 | G | 84.9 | Confident | 78.3 | Confident | 31 Ų | 31 | 93.7 Ų | 93.7 | 32% | 0.32 | 54% | 0.54 | S | S | . | . | H | α-helix | trans | -63.3 | -43.3 | 176 | 0 | 0 | 0 | 0 | 0 | 113.2 | A11 G12 V13 F18 I19 | A11-G15 PolarHBondContact O-N 3.04Å; G12-G15 PolarHBondContact O-N 3.35Å; V13-G15 PolarHBondContact O-N 2.91Å; G15-F18 PolarHBondContact O-N 3.49Å; G15-I19 VanDerWaalsContact O-CG1 3.32Å; G15-I19 WeakPolarHBondContact O-CG1 3.36Å; G15-I19 PolarHBondContact O-N 2.89Å |
| 16 | A | 86.3 | Confident | 79.3 | Confident | 67 Ų | 67 | 89.3 Ų | 89.3 | 55% | 0.554 | 52% | 0.524 | S | S | * | . | H | α-helix | trans | -65.2 | -40.3 | 178.2 | 0 | 0 | 0 | 0 | 0 | 112.6 | G12 V13 G20 | G12-A16 PolarHBondContact O-N 2.97Å; V13-A16 PolarHBondContact O-N 3.39Å; A16-G20 PolarHBondContact O-N 3.49Å |
| 17 | L | 86.3 | Confident | 79.9 | Confident | 126 Ų | 126 | 94.5 Ų | 94.5 | 66% | 0.66 | 53% | 0.534 | S | S | * | . | H | α-helix | trans | -65.9 | -40.4 | 175 | -71.4 | 171.8 | 0 | 0 | 0 | 111.9 | V13 A14 G20 Y21 | V13-L17 HydrophobicContact CG1-CD1 4.17Å; V13-L17 WeakPolarHBondContact O-CG 3.43Å; V13-L17 PolarHBondContact O-N 3Å; V13-L17 VanDerWaalsContact O-N 3.1Å; A14-L17 PolarHBondContact O-N 3.41Å; L17-G20 PolarHBondContact O-N 3.26Å; L17-Y21 WeakPolarHBondContact O-CB 3.32Å; L17-Y21 PolarHBondContact O-N 2.85Å |
| 18 | F | 88.4 | Confident | 80.2 | Confident | 140 Ų | 140 | 97 Ų | 97 | 61% | 0.614 | 54% | 0.535 | S | S | * | . | H | α-helix | trans | -64.9 | -46.7 | 177.1 | -171.7 | -102.2 | 0 | 0 | 0 | 111.6 | A14 G15 G20 Y21 C22 | A14-F18 WeakPolarHBondContact O-CB 3.38Å; A14-F18 PolarHBondContact O-N 2.93Å; G15-F18 PolarHBondContact O-N 3.49Å; F18-G20 PolarHBondContact O-N 2.88Å; F18-Y21 PolarHBondContact O-N 3.33Å; F18-C22 WeakPolarHBondContact O-CB 3.32Å; F18-C22 PolarHBondContact O-N 3.42Å; F18-C22 PolarHBondContact O-SG 3.22Å |
| 19 | I | 87.3 | Confident | 80.1 | Confident | 112 Ų | 112 | 101.3 Ų | 101.3 | 57% | 0.574 | 54% | 0.54 | S | S | * | . | H | α-helix | trans | -63.1 | -43.1 | 176.3 | -66.6 | 173.9 | 0 | 0 | 0 | 110.7 | G15 Y21 C22 V23 | G15-I19 VanDerWaalsContact O-CG1 3.32Å; G15-I19 WeakPolarHBondContact O-CG1 3.36Å; G15-I19 PolarHBondContact O-N 2.89Å; I19-Y21 VanDerWaalsContact C-N 3.31Å; I19-Y21 PolarHBondContact O-N 2.99Å; I19-C22 PolarHBondContact O-N 3.48Å; I19-V23 HydrophobicContact CG2-CG2 4.34Å; I19-V23 WeakPolarHBondContact O-CG2 3.49Å; I19-V23 PolarHBondContact O-N 3.45Å |
| 20 | G | 88.3 | Confident | 79.5 | Confident | 41 Ų | 41 | 103.8 Ų | 103.8 | 42% | 0.423 | 54% | 0.541 | S | S | . | . | H | α-helix | trans | -58.9 | -41.6 | 174.7 | 0 | 0 | 0 | 0 | 0 | 112.7 | A16 L17 F18 V23 Y24 | A16-G20 PolarHBondContact O-N 3.49Å; L17-G20 PolarHBondContact O-N 3.26Å; F18-G20 PolarHBondContact O-N 2.88Å; G20-V23 PolarHBondContact O-N 2.93Å; G20-Y24 WeakPolarHBondContact O-CB 3.4Å; G20-Y24 PolarHBondContact O-N 3.23Å |
| 21 | Y | 86.6 | Confident | 78.7 | Confident | 142 Ų | 142 | 102.8 Ų | 102.8 | 56% | 0.557 | 54% | 0.539 | S | S | * | . | H | α-helix | trans | -67.2 | -42.2 | 175.6 | -175.3 | -103.8 | 0 | 0 | 0 | 112.2 | L17 F18 I19 Y24 F25 | L17-Y21 WeakPolarHBondContact O-CB 3.32Å; L17-Y21 PolarHBondContact O-N 2.85Å; F18-Y21 PolarHBondContact O-N 3.33Å; I19-Y21 VanDerWaalsContact C-N 3.31Å; I19-Y21 PolarHBondContact O-N 2.99Å; Y21-Y24 PolarHBondContact O-N 3.37Å; Y21-F25 WeakPolarHBondContact O-CB 3.31Å; Y21-F25 PolarHBondContact O-N 2.88Å |
| 22 | C | 84.1 | Confident | 77.9 | Confident | 56 Ų | 56 | 104.5 Ų | 104.5 | 38% | 0.378 | 54% | 0.539 | S | S | . | . | H | α-helix | trans | -61.9 | -43.2 | 175.2 | -69.5 | 0 | 0 | 0 | 0 | 112 | F18 I19 F25 D26 | F18-C22 WeakPolarHBondContact O-CB 3.32Å; F18-C22 PolarHBondContact O-N 3.42Å; F18-C22 PolarHBondContact O-SG 3.22Å; I19-C22 PolarHBondContact O-N 3.48Å; C22-F25 PolarHBondContact O-N 3.46Å; C22-D26 WeakPolarHBondContact O-CB 3.23Å; C22-D26 PolarHBondContact O-N 3.47Å |
| 23 | V | 84.4 | Confident | 76.7 | Confident | 90 Ų | 90 | 106.4 Ų | 106.4 | 55% | 0.545 | 54% | 0.543 | S | S | . | . | H | α-helix | trans | -67.1 | -41.9 | 176.8 | 172.2 | 0 | 0 | 0 | 0 | 111.2 | I19 G20 F25 R27 | I19-V23 HydrophobicContact CG2-CG2 4.34Å; I19-V23 WeakPolarHBondContact O-CG2 3.49Å; I19-V23 PolarHBondContact O-N 3.45Å; G20-V23 PolarHBondContact O-N 2.93Å; V23-F25 VanDerWaalsContact C-N 3.35Å; V23-F25 PolarHBondContact O-N 2.98Å; V23-R27 VanDerWaalsContact O-CB 3.23Å; V23-R27 WeakPolarHBondContact O-CB 3.33Å; V23-R27 PolarHBondContact O-N 2.88Å |
| 24 | Y | 85.2 | Confident | 75.4 | Confident | 137 Ų | 137 | 105.7 Ų | 105.7 | 54% | 0.537 | 54% | 0.536 | S | S | . | . | H | α-helix | trans | -60.6 | -44.3 | 174.5 | 170.8 | -104.3 | 0 | 0 | 0 | 111.7 | G20 Y21 R27 K28 | G20-Y24 WeakPolarHBondContact O-CB 3.4Å; G20-Y24 PolarHBondContact O-N 3.23Å; Y21-Y24 PolarHBondContact O-N 3.37Å; Y24-R27 PolarHBondContact O-N 2.73Å; Y24-K28 HydrophobicContact CE1-CD 4.28Å; Y24-K28 VanDerWaalsContact O-CB 3.31Å; Y24-K28 WeakPolarHBondContact O-CB 3.37Å; Y24-K28 PolarHBondContact O-N 3.49Å |
| 25 | F | 75.1 | Confident | 74.4 | Confident | 100 Ų | 100 | 110.5 Ų | 110.5 | 44% | 0.439 | 55% | 0.547 | S | S | . | . | H | α-helix | trans | -70.2 | -41.5 | -179.3 | -164.7 | -96.9 | 0 | 0 | 0 | 112.5 | Y21 C22 V23 R27 K28 R29 | Y21-F25 WeakPolarHBondContact O-CB 3.31Å; Y21-F25 PolarHBondContact O-N 2.88Å; C22-F25 PolarHBondContact O-N 3.46Å; V23-F25 VanDerWaalsContact C-N 3.35Å; V23-F25 PolarHBondContact O-N 2.98Å; F25-R27 VanDerWaalsContact C-N 3.31Å; F25-R27 PolarHBondContact O-N 3.02Å; F25-K28 PolarHBondContact O-N 2.95Å; F25-R29 VanDerWaalsContact O-CB 3.31Å; F25-R29 WeakPolarHBondContact O-CB 3.41Å; F25-R29 PolarHBondContact O-N 3.29Å |
| 26 | D | 77.6 | Confident | 73.3 | Confident | 68 Ų | 68 | 117.4 Ų | 117.4 | 36% | 0.364 | 57% | 0.568 | S | S | . | * | H | α-helix | trans | -63.7 | -38.8 | 174.9 | -169.5 | 64.5 | 0 | 0 | 0 | 111.4 | C22 R29 R30 | C22-D26 WeakPolarHBondContact O-CB 3.23Å; C22-D26 PolarHBondContact O-N 3.47Å; D26-R29 PolarHBondContact O-N 3.41Å; D26-R30 WeakPolarHBondContact O-CB 3.15Å; D26-R30 PolarHBondContact O-N 2.91Å; D26-R30 IonicContact OD1-CZ 3.67Å; D26-R30 IonicContact OD1-NE 3.67Å; D26-R30 IonicContact OD1-NH1 3.75Å; D26-R30 IonicContact OD2-CZ 3.38Å; D26-R30 IonicContact OD2-NE 3.64Å; D26-R30 IonicContact OD2-NH1 2.73Å; D26-R30 PolarHBondContact OD2-NH1 3.46Å |
| 27 | R | 72.4 | Confident | 72.2 | Confident | 196 Ų | 196 | 120.5 Ų | 120.5 | 74% | 0.74 | 57% | 0.569 | S | S | * | * | H | α-helix | trans | -66.5 | -40.7 | 175 | -159.9 | 174.3 | -178.6 | 161.7 | 0.6 | 111.8 | V23 Y24 F25 R29 R30 S31 | V23-R27 VanDerWaalsContact O-CB 3.23Å; V23-R27 WeakPolarHBondContact O-CB 3.33Å; V23-R27 PolarHBondContact O-N 2.88Å; Y24-R27 PolarHBondContact O-N 2.73Å; F25-R27 VanDerWaalsContact C-N 3.31Å; F25-R27 PolarHBondContact O-N 3.02Å; R27-R29 VanDerWaalsContact C-N 3.31Å; R27-R29 PolarHBondContact O-N 3.29Å; R27-R30 PolarHBondContact O-N 2.96Å; R27-S31 WeakPolarHBondContact O-CB 3.35Å; R27-S31 PolarHBondContact O-N 3.49Å; R27-S31 VanDerWaalsContact O-N 3.07Å; R27-S31 PolarHBondContact O-OG 2.88Å |
| 28 | K | 66.9 | Low | 71.1 | Confident | 132 Ų | 132 | 122.3 Ų | 122.3 | 57% | 0.574 | 57% | 0.567 | S | S | * | * | H | α-helix | trans | -67.3 | -29 | 174.6 | -173.9 | 167 | -178.4 | 172.9 | 0 | 112.9 | Y24 F25 S31 | Y24-K28 HydrophobicContact CE1-CD 4.28Å; Y24-K28 VanDerWaalsContact O-CB 3.31Å; Y24-K28 WeakPolarHBondContact O-CB 3.37Å; Y24-K28 PolarHBondContact O-N 3.49Å; F25-K28 PolarHBondContact O-N 2.95Å; K28-S31 PolarHBondContact O-OG 3.28Å |
| 29 | R | 63.5 | Low | 70 | Confident | 189 Ų | 189 | 119.2 Ų | 119.2 | 71% | 0.713 | 56% | 0.556 | S | S | * | * | H | α-helix | trans | -84.3 | -24.8 | 178.2 | -152.4 | 177.1 | -176.3 | -176.4 | 1.7 | 113.3 | F25 D26 R27 | F25-R29 VanDerWaalsContact O-CB 3.31Å; F25-R29 WeakPolarHBondContact O-CB 3.41Å; F25-R29 PolarHBondContact O-N 3.29Å; D26-R29 PolarHBondContact O-N 3.41Å; R27-R29 VanDerWaalsContact C-N 3.31Å; R27-R29 PolarHBondContact O-N 3.29Å |
| 30 | R | 60.4 | Low | 69.3 | Low | 193 Ų | 193 | 120.7 Ų | 120.7 | 73% | 0.728 | 56% | 0.561 | S | S | * | * | H | α-helix | trans | -98.1 | -10.8 | 178.5 | -72.8 | 176.5 | 170.3 | 165.8 | -8.3 | 114.6 | D26 R27 D32 | D26-R30 WeakPolarHBondContact O-CB 3.15Å; D26-R30 PolarHBondContact O-N 2.91Å; D26-R30 IonicContact OD1-CZ 3.67Å; D26-R30 IonicContact OD1-NE 3.67Å; D26-R30 IonicContact OD1-NH1 3.75Å; D26-R30 IonicContact OD2-CZ 3.38Å; D26-R30 IonicContact OD2-NE 3.64Å; D26-R30 IonicContact OD2-NH1 2.73Å; D26-R30 PolarHBondContact OD2-NH1 3.46Å; R27-R30 PolarHBondContact O-N 2.96Å; R30-D32 PolarHBondContact O-N 3.07Å |
| 31 | S | 55.5 | Low | 68.4 | Low | 80 Ų | 80 | 122.9 Ų | 122.9 | 56% | 0.559 | 56% | 0.56 | S | S | * | * | trans | -80.9 | 51 | 173 | 54.1 | 0 | 0 | 0 | 0 | 112.4 | R27 K28 P33 | R27-S31 WeakPolarHBondContact O-CB 3.35Å; R27-S31 PolarHBondContact O-N 3.49Å; R27-S31 VanDerWaalsContact O-N 3.07Å; R27-S31 PolarHBondContact O-OG 2.88Å; K28-S31 PolarHBondContact O-OG 3.28Å; S31-P33 WeakPolarHBondContact O-CD 3.31Å | ||
| 32 | D | 56.5 | Low | 67.4 | Low | 102 Ų | 102 | 125.1 Ų | 125.1 | 55% | 0.545 | 57% | 0.567 | S | S | . | * | trans | -91.5 | 101.7 | 172.6 | -130.4 | -51 | 0 | 0 | 0 | 108.7 | R30 N34 F35 | R30-D32 PolarHBondContact O-N 3.07Å; D32-N34 PolarHBondContact O-N 3.49Å; D32-N34 PolarHBondContact OD1-ND2 2.88Å; D32-F35 PolarHBondContact O-N 2.96Å | ||
| 33 | P | 57.4 | Low | 66.5 | Low | 88 Ų | 88 | 130.7 Ų | 130.7 | 57% | 0.571 | 58% | 0.58 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -64.2 | -5.8 | 177.3 | 28.3 | -35 | 0 | 0 | 0 | 112.2 | S31 | S31-P33 WeakPolarHBondContact O-CD 3.31Š|
| 34 | N | 56.5 | Low | 65.6 | Low | 72 Ų | 72 | 130 Ų | 130 | 39% | 0.385 | 58% | 0.58 | S | S | . | * | H | α-helix | trans | -74.9 | -20.7 | -177.4 | -72.8 | -53.4 | 0 | 0 | 0 | 114.1 | D32 K36 K37 R38 | D32-N34 PolarHBondContact O-N 3.49Å; D32-N34 PolarHBondContact OD1-ND2 2.88Å; N34-K36 PolarHBondContact O-N 3.25Å; N34-K37 PolarHBondContact O-N 2.77Å; N34-R38 HydrophobicContact CB-CG 4.33Å; N34-R38 WeakPolarHBondContact O-CB 3.47Å; N34-R38 WeakPolarHBondContact O-CG 3.17Å; N34-R38 PolarHBondContact O-N 3.31Å |
| 35 | F | 59.1 | Low | 64.6 | Low | 159 Ų | 159 | 129 Ų | 129 | 70% | 0.697 | 58% | 0.578 | S | S | * | * | H | α-helix | trans | -64.6 | -43.6 | -179.2 | -164.6 | -98.2 | 0 | 0 | 0 | 112 | D32 L39 | D32-F35 PolarHBondContact O-N 2.96Å; F35-L39 HydrophobicContact CD1-CD1 4.46Å; F35-L39 HydrophobicContact CE1-CD1 3.91Å; F35-L39 HydrophobicContact CZ-CD1 4.19Å; F35-L39 WeakPolarHBondContact O-CB 2.91Å; F35-L39 PolarHBondContact O-N 2.97Å |
| 36 | K | 62 | Low | 64 | Low | 176 Ų | 176 | 131 Ų | 131 | 77% | 0.765 | 59% | 0.589 | S | S | * | * | H | α-helix | trans | -67.5 | -41.7 | 174.8 | -110.4 | -178.3 | 176.2 | -179.4 | 0 | 112.1 | N34 L39 Q40 | N34-K36 PolarHBondContact O-N 3.25Å; K36-L39 PolarHBondContact O-N 2.92Å; K36-Q40 WeakPolarHBondContact O-CB 3.14Å; K36-Q40 PolarHBondContact O-N 3.02Å |
| 37 | K | 61.9 | Low | 63.1 | Low | 132 Ų | 132 | 134.8 Ų | 134.8 | 57% | 0.574 | 60% | 0.602 | S | S | * | * | H | α-helix | trans | -63.1 | -44.5 | 175.6 | -71.3 | -172.4 | 176.3 | -176.7 | 0 | 111.5 | N34 L39 Q40 E41 | N34-K37 PolarHBondContact O-N 2.77Å; K37-L39 VanDerWaalsContact C-N 3.31Å; K37-L39 PolarHBondContact O-N 3.41Å; K37-Q40 PolarHBondContact O-N 3.44Å; K37-E41 WeakPolarHBondContact O-CB 3.41Å; K37-E41 PolarHBondContact O-N 3.34Å |
| 38 | R | 63.4 | Low | 62.3 | Low | 163 Ų | 163 | 127.9 Ų | 127.9 | 62% | 0.615 | 58% | 0.583 | S | S | * | * | H | α-helix | trans | -62.7 | -36.5 | 175.9 | -65.6 | -108.9 | 168.9 | -151 | -4.7 | 111.4 | N34 R42 | N34-R38 HydrophobicContact CB-CG 4.33Å; N34-R38 WeakPolarHBondContact O-CB 3.47Å; N34-R38 WeakPolarHBondContact O-CG 3.17Å; N34-R38 PolarHBondContact O-N 3.31Å; R38-R42 VanDerWaalsContact O-CB 3.3Å; R38-R42 WeakPolarHBondContact O-CB 3.28Å; R38-R42 WeakPolarHBondContact O-CG 3.3Å; R38-R42 PolarHBondContact O-N 3.34Å |
| 39 | L | 66.6 | Low | 61.6 | Low | 75 Ų | 75 | 124.9 Ų | 124.9 | 39% | 0.393 | 58% | 0.579 | S | S | . | * | H | α-helix | trans | -68.9 | -43.2 | 174.8 | -130.8 | 87.2 | 0 | 0 | 0 | 112.2 | F35 K36 K37 R42 R43 | F35-L39 HydrophobicContact CD1-CD1 4.46Å; F35-L39 HydrophobicContact CE1-CD1 3.91Å; F35-L39 HydrophobicContact CZ-CD1 4.19Å; F35-L39 WeakPolarHBondContact O-CB 2.91Å; F35-L39 PolarHBondContact O-N 2.97Å; K36-L39 PolarHBondContact O-N 2.92Å; K37-L39 VanDerWaalsContact C-N 3.31Å; K37-L39 PolarHBondContact O-N 3.41Å; L39-R42 PolarHBondContact O-N 2.73Å; L39-R43 WeakPolarHBondContact O-CG 3.21Å; L39-R43 PolarHBondContact O-N 3.44Å |
| 40 | Q | 71.4 | Confident | 61.1 | Low | 144 Ų | 144 | 122.3 Ų | 122.3 | 67% | 0.673 | 58% | 0.576 | S | S | * | * | H | α-helix | trans | -70.1 | -39.1 | 179.6 | -165.9 | 171.2 | 12 | 0 | 0 | 111.3 | K36 K37 R43 S44 | K36-Q40 WeakPolarHBondContact O-CB 3.14Å; K36-Q40 PolarHBondContact O-N 3.02Å; K37-Q40 PolarHBondContact O-N 3.44Å; Q40-R43 PolarHBondContact O-N 2.96Å; Q40-S44 VanDerWaalsContact O-CB 3.32Å; Q40-S44 WeakPolarHBondContact O-CB 3.41Å; Q40-S44 PolarHBondContact O-N 2.81Å |
| 41 | E | 70.6 | Confident | 60.6 | Low | 86 Ų | 86 | 119 Ų | 119 | 40% | 0.402 | 57% | 0.568 | S | S | . | * | H | α-helix | trans | -66.1 | -38.8 | 174.2 | -159.4 | -171.3 | 165.1 | 0 | 0 | 111.2 | K37 S44 K45 | K37-E41 WeakPolarHBondContact O-CB 3.41Å; K37-E41 PolarHBondContact O-N 3.34Å; E41-S44 PolarHBondContact O-N 2.81Å; E41-K45 HydrophobicContact CG-CD 4.37Å; E41-K45 VanDerWaalsContact O-CB 3.28Å; E41-K45 WeakPolarHBondContact O-CB 3.49Å; E41-K45 VanDerWaalsContact O-CG 3.3Å; E41-K45 WeakPolarHBondContact O-CG 3.32Å; E41-K45 PolarHBondContact O-N 3.4Å; E41-K45 WeakPolarHBondContact OE1-CE 3.3Å; E41-K45 IonicContact OE1-NZ 2.74Å; E41-K45 PolarHBondContact OE1-NZ 2.81Å |
| 42 | R | 65.8 | Low | 60.2 | Low | 190 Ų | 190 | 122.8 Ų | 122.8 | 72% | 0.717 | 58% | 0.575 | S | S | * | * | H | α-helix | trans | -62.1 | -44.9 | 171.6 | -82.2 | -179 | 141.8 | -140.8 | -8.5 | 112.6 | R38 L39 K45 Q46 | R38-R42 VanDerWaalsContact O-CB 3.3Å; R38-R42 WeakPolarHBondContact O-CB 3.28Å; R38-R42 WeakPolarHBondContact O-CG 3.3Å; R38-R42 PolarHBondContact O-N 3.34Å; L39-R42 PolarHBondContact O-N 2.73Å; R42-K45 PolarHBondContact O-N 2.84Å; R42-Q46 WeakPolarHBondContact O-CB 3.29Å; R42-Q46 PolarHBondContact O-N 2.92Å |
| 43 | R | 64.5 | Low | 59.9 | Low | 173 Ų | 173 | 121.9 Ų | 121.9 | 65% | 0.653 | 57% | 0.573 | S | S | * | * | H | α-helix | trans | -67.7 | -36.9 | 176.3 | -72.8 | -177.2 | -179.3 | -171.9 | -0.2 | 112.4 | L39 Q40 K47 | L39-R43 WeakPolarHBondContact O-CG 3.21Å; L39-R43 PolarHBondContact O-N 3.44Å; Q40-R43 PolarHBondContact O-N 2.96Å; R43-K47 WeakPolarHBondContact O-CB 3.41Å; R43-K47 WeakPolarHBondContact O-CG 3.38Å; R43-K47 PolarHBondContact O-N 2.97Å |
| 44 | S | 64.9 | Low | 59.6 | Low | 76 Ų | 76 | 122.4 Ų | 122.4 | 53% | 0.531 | 57% | 0.574 | S | S | . | * | H | α-helix | trans | -69.4 | -40 | 176.3 | -163 | 0 | 0 | 0 | 0 | 111.6 | Q40 E41 K47 S48 | Q40-S44 VanDerWaalsContact O-CB 3.32Å; Q40-S44 WeakPolarHBondContact O-CB 3.41Å; Q40-S44 PolarHBondContact O-N 2.81Å; E41-S44 PolarHBondContact O-N 2.81Å; S44-K47 PolarHBondContact O-N 2.78Å; S44-S48 WeakPolarHBondContact O-CB 3.4Å; S44-S48 PolarHBondContact O-N 2.92Å; S44-S48 PolarHBondContact O-OG 3.29Å |
| 45 | K | 65.3 | Low | 59.1 | Low | 116 Ų | 116 | 125.3 Ų | 125.3 | 50% | 0.504 | 59% | 0.589 | S | S | . | * | H | α-helix | trans | -65.5 | -45 | 174.3 | -77.3 | 175.5 | 177.2 | 171.1 | 0 | 111.4 | E41 R42 K47 S48 S49 | E41-K45 HydrophobicContact CG-CD 4.37Å; E41-K45 VanDerWaalsContact O-CB 3.28Å; E41-K45 WeakPolarHBondContact O-CB 3.49Å; E41-K45 VanDerWaalsContact O-CG 3.3Å; E41-K45 WeakPolarHBondContact O-CG 3.32Å; E41-K45 PolarHBondContact O-N 3.4Å; E41-K45 WeakPolarHBondContact OE1-CE 3.3Å; E41-K45 IonicContact OE1-NZ 2.74Å; E41-K45 PolarHBondContact OE1-NZ 2.81Å; R42-K45 PolarHBondContact O-N 2.84Å; K45-K47 PolarHBondContact O-N 2.97Å; K45-S48 WeakPolarHBondContact CA-OG 3.49Å; K45-S48 PolarHBondContact O-N 3.47Å; K45-S48 PolarHBondContact O-OG 3.46Å; K45-S49 VanDerWaalsContact O-CB 3.29Å; K45-S49 WeakPolarHBondContact O-CB 3.46Å; K45-S49 PolarHBondContact O-N 3.45Å; K45-S49 PolarHBondContact O-OG 2.97Å |
| 46 | Q | 61 | Low | 58.5 | Low | 140 Ų | 140 | 126.2 Ų | 126.2 | 65% | 0.654 | 59% | 0.588 | S | S | * | * | H | α-helix | trans | -60.3 | -44 | 173.8 | -87.8 | -172.7 | -46.8 | 0 | 0 | 112.5 | R42 S49 Q50 | R42-Q46 WeakPolarHBondContact O-CB 3.29Å; R42-Q46 PolarHBondContact O-N 2.92Å; Q46-S49 PolarHBondContact O-N 3.35Å; Q46-Q50 WeakPolarHBondContact O-CB 3.16Å; Q46-Q50 PolarHBondContact O-N 3.05Å |
| 47 | K | 58.4 | Low | 57.8 | Low | 149 Ų | 149 | 122.8 Ų | 122.8 | 65% | 0.648 | 58% | 0.577 | S | S | * | * | H | α-helix | trans | -64.1 | -43.8 | 175.1 | -76.4 | -172.9 | 175.7 | -164.4 | 0 | 112.1 | R43 S44 K45 S49 Q50 E51 | R43-K47 WeakPolarHBondContact O-CB 3.41Å; R43-K47 WeakPolarHBondContact O-CG 3.38Å; R43-K47 PolarHBondContact O-N 2.97Å; S44-K47 PolarHBondContact O-N 2.78Å; K45-K47 PolarHBondContact O-N 2.97Å; K47-S49 PolarHBondContact O-N 3.48Å; K47-Q50 PolarHBondContact O-N 3.16Å; K47-E51 WeakPolarHBondContact O-CB 3.28Å; K47-E51 PolarHBondContact O-N 3.49Å |
| 48 | S | 55.8 | Low | 57.2 | Low | 50 Ų | 50 | 118.3 Ų | 118.3 | 35% | 0.35 | 56% | 0.562 | S | S | . | * | H | α-helix | trans | -69.3 | -32.6 | 178.4 | 66 | 0 | 0 | 0 | 0 | 113.1 | S44 K45 K52 | S44-S48 WeakPolarHBondContact O-CB 3.4Å; S44-S48 PolarHBondContact O-N 2.92Å; S44-S48 PolarHBondContact O-OG 3.29Å; K45-S48 WeakPolarHBondContact CA-OG 3.49Å; K45-S48 PolarHBondContact O-N 3.47Å; K45-S48 PolarHBondContact O-OG 3.46Å; S48-K52 WeakPolarHBondContact O-CB 3.2Å; S48-K52 WeakPolarHBondContact O-CG 3.18Å; S48-K52 PolarHBondContact O-N 2.92Å |
| 49 | S | 53.9 | Low | 56.5 | Low | 70 Ų | 70 | 115.7 Ų | 115.7 | 49% | 0.49 | 56% | 0.56 | S | S | . | * | H | α-helix | trans | -71.4 | -42.4 | 174.5 | -64.8 | 0 | 0 | 0 | 0 | 110.4 | K45 Q46 K47 K52 T53 | K45-S49 VanDerWaalsContact O-CB 3.29Å; K45-S49 WeakPolarHBondContact O-CB 3.46Å; K45-S49 PolarHBondContact O-N 3.45Å; K45-S49 PolarHBondContact O-OG 2.97Å; Q46-S49 PolarHBondContact O-N 3.35Å; K47-S49 PolarHBondContact O-N 3.48Å; S49-K52 PolarHBondContact O-N 3.45Å; S49-T53 WeakPolarHBondContact O-CG2 3.19Å; S49-T53 PolarHBondContact O-N 2.94Å; S49-T53 PolarHBondContact O-OG1 2.8Å; S49-T53 VanDerWaalsContact O-OG1 3.04Å |
| 50 | Q | 51.7 | Low | 56 | Low | 135 Ų | 135 | 118 Ų | 118 | 63% | 0.631 | 57% | 0.572 | S | S | * | * | H | α-helix | trans | -66.7 | -40.3 | 176.5 | -168.4 | 173 | 26 | 0 | 0 | 112 | Q46 K47 T53 V54 | Q46-Q50 WeakPolarHBondContact O-CB 3.16Å; Q46-Q50 PolarHBondContact O-N 3.05Å; K47-Q50 PolarHBondContact O-N 3.16Å; Q50-T53 VanDerWaalsContact C-OG1 3.31Å; Q50-T53 VanDerWaalsContact CA-OG1 3.28Å; Q50-T53 WeakPolarHBondContact CA-OG1 3.36Å; Q50-T53 PolarHBondContact O-N 2.77Å; Q50-T53 PolarHBondContact O-OG1 3.39Å; Q50-V54 VanDerWaalsContact O-CG2 3.24Å; Q50-V54 WeakPolarHBondContact O-CG2 3.24Å; Q50-V54 PolarHBondContact O-N 3.38Å |
| 51 | E | 49.5 | Very low | 55.2 | Low | 124 Ų | 124 | 119.6 Ų | 119.6 | 58% | 0.579 | 58% | 0.577 | S | S | * | * | H | α-helix | trans | -72.1 | -36.6 | 177.3 | -165.1 | 179 | 131.8 | 0 | 0 | 111.5 | K47 V54 L55 | K47-E51 WeakPolarHBondContact O-CB 3.28Å; K47-E51 PolarHBondContact O-N 3.49Å; E51-V54 PolarHBondContact O-N 2.87Å; E51-L55 HydrophobicContact CG-CD1 3.79Å; E51-L55 WeakPolarHBondContact O-CB 3.33Å; E51-L55 PolarHBondContact O-N 3.04Å |
| 52 | K | 48.8 | Very low | 54.8 | Low | 158 Ų | 158 | 120.2 Ų | 120.2 | 69% | 0.687 | 58% | 0.583 | S | S | * | * | H | α-helix | trans | -67.3 | -33.2 | 170.7 | -79.6 | 179.3 | 177 | -174.6 | 0 | 113 | S48 S49 R56 | S48-K52 WeakPolarHBondContact O-CB 3.2Å; S48-K52 WeakPolarHBondContact O-CG 3.18Å; S48-K52 PolarHBondContact O-N 2.92Å; S49-K52 PolarHBondContact O-N 3.45Å; K52-R56 WeakPolarHBondContact O-CB 3.49Å |
| 53 | T | 50 | Low | 54.8 | Low | 83 Ų | 83 | 115 Ų | 115 | 51% | 0.509 | 58% | 0.58 | S | S | . | * | H | α-helix | trans | -73 | -29.7 | 174.1 | 48.8 | 0 | 0 | 0 | 0 | 112.7 | S49 Q50 | S49-T53 WeakPolarHBondContact O-CG2 3.19Å; S49-T53 PolarHBondContact O-N 2.94Å; S49-T53 PolarHBondContact O-OG1 2.8Å; S49-T53 VanDerWaalsContact O-OG1 3.04Å; Q50-T53 VanDerWaalsContact C-OG1 3.31Å; Q50-T53 VanDerWaalsContact CA-OG1 3.28Å; Q50-T53 WeakPolarHBondContact CA-OG1 3.36Å; Q50-T53 PolarHBondContact O-N 2.77Å; Q50-T53 PolarHBondContact O-OG1 3.39Å |
| 54 | V | 50.4 | Low | 55 | Low | 100 Ų | 100 | 114.3 Ų | 114.3 | 61% | 0.606 | 58% | 0.584 | S | S | * | * | H | α-helix | trans | -85.7 | -31.1 | -179.2 | 174.3 | 0 | 0 | 0 | 0 | 112.3 | Q50 E51 | Q50-V54 VanDerWaalsContact O-CG2 3.24Å; Q50-V54 WeakPolarHBondContact O-CG2 3.24Å; Q50-V54 PolarHBondContact O-N 3.38Å; E51-V54 PolarHBondContact O-N 2.87Å |
| 55 | L | 45.6 | Very low | 55.2 | Low | 133 Ų | 133 | 112.2 Ų | 112.2 | 70% | 0.696 | 57% | 0.571 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -88 | 0.3 | 179.7 | -73.3 | 169 | 0 | 0 | 0 | 114.9 | E51 | E51-L55 HydrophobicContact CG-CD1 3.79Å; E51-L55 WeakPolarHBondContact O-CB 3.33Å; E51-L55 PolarHBondContact O-N 3.04Å |
| 56 | R | 47.9 | Very low | 55.5 | Low | 178 Ų | 178 | 108.2 Ų | 108.2 | 67% | 0.672 | 56% | 0.557 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -122.8 | 16.1 | 178.6 | -96.3 | -155.9 | -176.7 | -168 | 0.3 | 114.2 | K52 P58 | K52-R56 WeakPolarHBondContact O-CB 3.49Å; R56-P58 WeakPolarHBondContact O-CD 3.39Å |
| 57 | L | 46.7 | Very low | 55.8 | Low | 103 Ų | 103 | 107.5 Ų | 107.5 | 54% | 0.539 | 55% | 0.553 | S | S | . | * | trans | -69.4 | 113.2 | 163.7 | -63.1 | 177.3 | 0 | 0 | 0 | 106.5 | ||||
| 58 | P | 49.4 | Very low | 56.8 | Low | 38 Ų | 38 | 107.9 Ų | 107.9 | 25% | 0.247 | 56% | 0.555 | C | S | . | * | trans | -56.1 | 149.4 | 164.4 | -8.1 | 24.6 | 0 | 0 | 0 | 106.8 | R56 L60 A65 F69 | R56-P58 WeakPolarHBondContact O-CD 3.39Å; P58-L60 PolarHBondContact O-N 3.39Å; P58-A65 HydrophobicContact CB-CB 3.7Å; P58-A65 HydrophobicContact CG-CB 4.41Å; P58-F69 HydrophobicContact CG-CB 4.29Å | ||
| 59 | D | 49.2 | Very low | 58 | Low | 108 Ų | 108 | 107.3 Ų | 107.3 | 58% | 0.578 | 55% | 0.546 | S | S | * | . | trans | -47.2 | 113.6 | 173.2 | -167.7 | -1.4 | 0 | 0 | 0 | 108.2 | K61 D62 | D59-K61 PolarHBondContact O-N 2.76Å; D59-D62 PolarHBondContact O-N 3.14Å | ||
| 60 | L | 54.5 | Low | 59.2 | Low | 123 Ų | 123 | 105.5 Ų | 105.5 | 64% | 0.644 | 53% | 0.53 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -64.5 | 6.2 | -173.3 | -66.6 | 179.1 | 0 | 0 | 0 | 112.5 | P58 V66 | P58-L60 PolarHBondContact O-N 3.39Å; L60-V66 HydrophobicContact CD2-CG2 4.46Å |
| 61 | K | 55.5 | Low | 60.5 | Low | 178 Ų | 178 | 103.2 Ų | 103.2 | 77% | 0.774 | 52% | 0.521 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -86.7 | -25.8 | 174.4 | -66.2 | -179.8 | 177.1 | -179.8 | 0 | 113.3 | D59 A63 | D59-K61 PolarHBondContact O-N 2.76Å; K61-A63 PolarHBondContact O-N 2.97Å |
| 62 | D | 63.1 | Low | 62.2 | Low | 100 Ų | 100 | 101.8 Ų | 101.8 | 54% | 0.535 | 52% | 0.515 | S | S | . | . | trans | -94.6 | 99.4 | 179.3 | -87.3 | -34.6 | 0 | 0 | 0 | 111.3 | D59 E64 A65 V66 | D59-D62 PolarHBondContact O-N 3.14Å; D62-E64 PolarHBondContact O-N 2.81Å; D62-E64 VanDerWaalsContact O-N 3.12Å; D62-A65 HydrophobicContact CB-CB 3.89Å; D62-A65 PolarHBondContact O-N 3.17Å; D62-V66 PolarHBondContact O-N 3.45Å; D62-V66 VanDerWaalsContact O-N 3.09Å | ||
| 63 | A | 64.3 | Low | 63.8 | Low | 79 Ų | 79 | 95.3 Ų | 95.3 | 65% | 0.653 | 49% | 0.487 | S | S | * | . | H | α-helix | trans | -53.3 | -31.4 | 174.2 | 0 | 0 | 0 | 0 | 0 | 112.7 | K61 Q67 | K61-A63 PolarHBondContact O-N 2.97Å; A63-Q67 WeakPolarHBondContact O-CB 3.26Å; A63-Q67 PolarHBondContact O-N 2.99Å |
| 64 | E | 68.7 | Low | 65.3 | Low | 160 Ų | 160 | 92.4 Ų | 92.4 | 75% | 0.748 | 47% | 0.468 | S | S | * | . | H | α-helix | trans | -70.4 | -38.5 | 177.4 | -162.2 | 176.2 | -172.1 | 0 | 0 | 112.3 | D62 Q67 K68 | D62-E64 PolarHBondContact O-N 2.81Å; D62-E64 VanDerWaalsContact O-N 3.12Å; E64-Q67 PolarHBondContact O-N 3.26Å; E64-K68 WeakPolarHBondContact O-CB 3.18Å; E64-K68 PolarHBondContact O-N 3.39Å |
| 65 | A | 70.7 | Confident | 66.9 | Low | 31 Ų | 31 | 93.5 Ų | 93.5 | 26% | 0.256 | 47% | 0.467 | S | S | . | . | H | α-helix | trans | -71.3 | -39.9 | 177.8 | 0 | 0 | 0 | 0 | 0 | 111.8 | P58 D62 K68 F69 | P58-A65 HydrophobicContact CB-CB 3.7Å; P58-A65 HydrophobicContact CG-CB 4.41Å; D62-A65 HydrophobicContact CB-CB 3.89Å; D62-A65 PolarHBondContact O-N 3.17Å; A65-K68 PolarHBondContact O-N 2.78Å; A65-F69 WeakPolarHBondContact O-CB 3.43Å; A65-F69 PolarHBondContact O-N 3.45Å |
| 66 | V | 70.8 | Confident | 68.8 | Low | 32 Ų | 32 | 90.5 Ų | 90.5 | 19% | 0.194 | 45% | 0.451 | C | S | . | . | H | α-helix | trans | -59.4 | -46.6 | 172.1 | 165.9 | 0 | 0 | 0 | 0 | 110.4 | L60 D62 K68 F69 F70 V99 | L60-V66 HydrophobicContact CD2-CG2 4.46Å; D62-V66 PolarHBondContact O-N 3.45Å; D62-V66 VanDerWaalsContact O-N 3.09Å; V66-K68 VanDerWaalsContact C-N 3.34Å; V66-K68 PolarHBondContact O-N 2.96Å; V66-F69 PolarHBondContact O-N 3.36Å; V66-F70 VanDerWaalsContact O-CB 3.24Å; V66-F70 WeakPolarHBondContact O-CB 3.39Å; V66-F70 PolarHBondContact O-N 2.92Å; V66-V99 HydrophobicContact CB-CG1 4.21Å; V66-V99 HydrophobicContact CG1-CG1 3.37Å; V66-V99 HydrophobicContact CG2-CG1 4.38Å |
| 67 | Q | 67.8 | Low | 70.6 | Confident | 125 Ų | 125 | 82 Ų | 82 | 58% | 0.584 | 42% | 0.419 | S | S | * | . | H | α-helix | trans | -65.3 | -37.1 | 178.5 | -173.3 | 176.7 | -11.1 | 0 | 0 | 112.4 | A63 E64 F70 L71 | A63-Q67 WeakPolarHBondContact O-CB 3.26Å; A63-Q67 PolarHBondContact O-N 2.99Å; E64-Q67 PolarHBondContact O-N 3.26Å; Q67-F70 WeakPolarHBondContact O-CB 3.41Å; Q67-F70 PolarHBondContact O-N 3.42Å; Q67-L71 HydrophobicContact CG-CD1 4.41Å; Q67-L71 PolarHBondContact O-N 3.06Å |
| 68 | K | 79 | Confident | 72.2 | Confident | 158 Ų | 158 | 80.5 Ų | 80.5 | 69% | 0.687 | 41% | 0.409 | S | S | * | . | H | α-helix | trans | -68.7 | -44.2 | 177.7 | -156.3 | 178.9 | -172.4 | -178.9 | 0 | 111.9 | E64 A65 V66 F70 L71 E72 | E64-K68 WeakPolarHBondContact O-CB 3.18Å; E64-K68 PolarHBondContact O-N 3.39Å; A65-K68 PolarHBondContact O-N 2.78Å; V66-K68 VanDerWaalsContact C-N 3.34Å; V66-K68 PolarHBondContact O-N 2.96Å; K68-F70 VanDerWaalsContact C-N 3.31Å; K68-F70 PolarHBondContact O-N 3.49Å; K68-L71 PolarHBondContact O-N 3.24Å; K68-E72 WeakPolarHBondContact O-CB 3.31Å; K68-E72 PolarHBondContact O-N 3.28Å |
| 69 | F | 80.7 | Confident | 73.9 | Confident | 38 Ų | 38 | 84.3 Ų | 84.3 | 17% | 0.167 | 42% | 0.424 | C | S | . | . | H | α-helix | trans | -60.7 | -42.5 | 173.8 | -178.7 | -98 | 0 | 0 | 0 | 111.5 | P58 A65 V66 E72 E73 V99 | P58-F69 HydrophobicContact CG-CB 4.29Å; A65-F69 WeakPolarHBondContact O-CB 3.43Å; A65-F69 PolarHBondContact O-N 3.45Å; V66-F69 PolarHBondContact O-N 3.36Å; F69-E72 PolarHBondContact O-N 3.24Å; F69-E73 HydrophobicContact CD1-CG 4.09Å; F69-E73 HydrophobicContact CE1-CG 3.6Å; F69-E73 HydrophobicContact CE2-CG 4.1Å; F69-E73 HydrophobicContact CZ-CG 3.6Å; F69-E73 WeakPolarHBondContact O-CB 3.32Å; F69-E73 WeakPolarHBondContact O-CG 3.18Å; F69-E73 PolarHBondContact O-N 2.81Å; F69-V99 HydrophobicContact CD1-CG1 4.46Å; F69-V99 HydrophobicContact CD1-CG2 4.09Å; F69-V99 HydrophobicContact CE1-CG2 3.98Å |
| 70 | F | 79.4 | Confident | 75.5 | Confident | 31 Ų | 31 | 80.6 Ų | 80.6 | 14% | 0.136 | 40% | 0.403 | C | S | . | . | H | α-helix | trans | -58.1 | -48.5 | 175.6 | 166.9 | -94.4 | 0 | 0 | 0 | 112.6 | V66 Q67 K68 E72 E73 I74 A96 L106 | V66-F70 VanDerWaalsContact O-CB 3.24Å; V66-F70 WeakPolarHBondContact O-CB 3.39Å; V66-F70 PolarHBondContact O-N 2.92Å; Q67-F70 WeakPolarHBondContact O-CB 3.41Å; Q67-F70 PolarHBondContact O-N 3.42Å; K68-F70 VanDerWaalsContact C-N 3.31Å; K68-F70 PolarHBondContact O-N 3.49Å; F70-E72 VanDerWaalsContact C-N 3.34Å; F70-E72 PolarHBondContact O-N 3.5Å; F70-E73 PolarHBondContact O-N 2.74Å; F70-I74 HydrophobicContact CD2-CD1 4.44Å; F70-I74 HydrophobicContact CE1-CD1 3.64Å; F70-I74 HydrophobicContact CE2-CD1 3.5Å; F70-I74 VanDerWaalsContact CE2-CD1 3.5Å; F70-I74 HydrophobicContact CE2-CG1 4.07Å; F70-I74 HydrophobicContact CZ-CD1 3Å; F70-I74 HydrophobicContact CZ-CG1 3.98Å; F70-I74 WeakPolarHBondContact O-CG1 3.41Å; F70-I74 PolarHBondContact O-N 3.45Å; F70-I74 VanDerWaalsContact O-N 3.08Å; F70-A96 HydrophobicContact CD2-CB 3.66Å; F70-A96 WeakPolarHBondContact CD2-O 3.43Å; F70-A96 HydrophobicContact CE2-CB 3.84Å; F70-L106 HydrophobicContact CD2-CD1 3.98Å; F70-L106 HydrophobicContact CE1-CD1 3.9Å; F70-L106 HydrophobicContact CE1-CG 4.45Å; F70-L106 HydrophobicContact CE2-CD1 3.13Å; F70-L106 HydrophobicContact CE2-CD2 3.31Å; F70-L106 HydrophobicContact CE2-CG 3.64Å; F70-L106 HydrophobicContact CZ-CD1 3.07Å; F70-L106 HydrophobicContact CZ-CD2 3.38Å; F70-L106 HydrophobicContact CZ-CG 3.4Å; F70-L106 VanDerWaalsContact CZ-CG 3.4Å |
| 71 | L | 79.4 | Confident | 76.8 | Confident | 87 Ų | 87 | 76 Ų | 76 | 46% | 0.455 | 38% | 0.379 | S | S | . | . | H | α-helix | trans | -63.9 | -39.4 | 177.7 | -79.3 | 161.7 | 0 | 0 | 0 | 112 | Q67 K68 I74 Q75 | Q67-L71 HydrophobicContact CG-CD1 4.41Å; Q67-L71 PolarHBondContact O-N 3.06Å; K68-L71 PolarHBondContact O-N 3.24Å; L71-I74 PolarHBondContact O-N 3.18Å; L71-Q75 WeakPolarHBondContact O-CG 3.13Å; L71-Q75 PolarHBondContact O-N 3.46Å |
| 72 | E | 83.9 | Confident | 77.9 | Confident | 95 Ų | 95 | 71.9 Ų | 71.9 | 44% | 0.444 | 38% | 0.378 | S | S | . | . | H | α-helix | trans | -65.6 | -44.4 | 178.4 | -168.7 | 176.5 | 179.3 | 0 | 0 | 111.8 | K68 F69 F70 Q75 L76 | K68-E72 WeakPolarHBondContact O-CB 3.31Å; K68-E72 PolarHBondContact O-N 3.28Å; F69-E72 PolarHBondContact O-N 3.24Å; F70-E72 VanDerWaalsContact C-N 3.34Å; F70-E72 PolarHBondContact O-N 3.5Å; E72-Q75 PolarHBondContact O-N 3.25Å; E72-L76 HydrophobicContact CG-CD1 4.34Å; E72-L76 WeakPolarHBondContact O-CB 3.39Å; E72-L76 PolarHBondContact O-N 2.98Å |
| 73 | E | 83.9 | Confident | 78.9 | Confident | 22 Ų | 22 | 73.4 Ų | 73.4 | 10% | 0.103 | 38% | 0.383 | C | S | . | . | H | α-helix | trans | -65.8 | -36.6 | 177 | -74.9 | -73.1 | 136.9 | 0 | 0 | 112.3 | F69 F70 G77 H92 A96 | F69-E73 HydrophobicContact CD1-CG 4.09Å; F69-E73 HydrophobicContact CE1-CG 3.6Å; F69-E73 HydrophobicContact CE2-CG 4.1Å; F69-E73 HydrophobicContact CZ-CG 3.6Å; F69-E73 WeakPolarHBondContact O-CB 3.32Å; F69-E73 WeakPolarHBondContact O-CG 3.18Å; F69-E73 PolarHBondContact O-N 2.81Å; F70-E73 PolarHBondContact O-N 2.74Å; E73-G77 PolarHBondContact O-N 3.41Å; E73-H92 IonicContact OE1-ND1 3.49Å; E73-H92 PolarHBondContact OE1-ND1 3.21Å; E73-H92 WeakPolarHBondContact OE2-CA 3.3Å; E73-H92 IonicContact OE2-CE1 2.81Å; E73-H92 IonicContact OE2-CG 3.84Å; E73-H92 IonicContact OE2-ND1 3.5Å; E73-H92 PolarHBondContact OE2-ND1 3.11Å; E73-A96 HydrophobicContact CB-CB 3.83Å |
| 74 | I | 81.5 | Confident | 79.5 | Confident | 21 Ų | 21 | 72.4 Ų | 72.4 | 11% | 0.108 | 38% | 0.38 | C | S | . | . | H | α-helix | trans | -64.9 | -47.1 | 173.3 | -72.9 | -169.5 | 0 | 0 | 0 | 111.4 | F70 L71 L76 G77 E78 L93 A96 L106 L110 | F70-I74 HydrophobicContact CD2-CD1 4.44Å; F70-I74 HydrophobicContact CE1-CD1 3.64Å; F70-I74 HydrophobicContact CE2-CD1 3.5Å; F70-I74 VanDerWaalsContact CE2-CD1 3.5Å; F70-I74 HydrophobicContact CE2-CG1 4.07Å; F70-I74 HydrophobicContact CZ-CD1 3Å; F70-I74 HydrophobicContact CZ-CG1 3.98Å; F70-I74 WeakPolarHBondContact O-CG1 3.41Å; F70-I74 PolarHBondContact O-N 3.45Å; F70-I74 VanDerWaalsContact O-N 3.08Å; L71-I74 PolarHBondContact O-N 3.18Å; I74-L76 VanDerWaalsContact C-N 3.34Å; I74-L76 PolarHBondContact O-N 3.43Å; I74-G77 PolarHBondContact O-N 3.14Å; I74-G77 VanDerWaalsContact O-N 3.14Å; I74-E78 HydrophobicContact CG2-CG 4.26Å; I74-E78 WeakPolarHBondContact O-CG 3.47Å; I74-E78 PolarHBondContact O-N 3.12Å; I74-L93 HydrophobicContact CG1-CD2 4.19Å; I74-A96 HydrophobicContact CG1-CB 3.95Å; I74-L106 HydrophobicContact CD1-CD2 4.35Å; I74-L110 HydrophobicContact CD1-CD2 3.96Å |
| 75 | Q | 82.9 | Confident | 80.1 | Confident | 124 Ų | 124 | 68 Ų | 68 | 58% | 0.579 | 36% | 0.361 | S | S | * | . | H | α-helix | trans | -60.6 | -45 | -179.9 | -75.6 | 176.2 | 4.1 | 0 | 0 | 111.5 | L71 E72 G77 E78 E79 | L71-Q75 WeakPolarHBondContact O-CG 3.13Å; L71-Q75 PolarHBondContact O-N 3.46Å; E72-Q75 PolarHBondContact O-N 3.25Å; Q75-G77 VanDerWaalsContact C-N 3.32Å; Q75-G77 PolarHBondContact O-N 2.88Å; Q75-E78 PolarHBondContact O-N 3.06Å; Q75-E79 WeakPolarHBondContact O-CB 3.07Å; Q75-E79 PolarHBondContact O-N 3.2Å |
| 76 | L | 85.1 | Confident | 80.5 | Confident | 70 Ų | 70 | 68.9 Ų | 68.9 | 37% | 0.366 | 37% | 0.365 | S | S | . | . | H | α-helix | trans | -60.1 | -42.9 | 173.8 | -85.9 | 161.4 | 0 | 0 | 0 | 111.8 | E72 I74 E79 L80 | E72-L76 HydrophobicContact CG-CD1 4.34Å; E72-L76 WeakPolarHBondContact O-CB 3.39Å; E72-L76 PolarHBondContact O-N 2.98Å; I74-L76 VanDerWaalsContact C-N 3.34Å; I74-L76 PolarHBondContact O-N 3.43Å; L76-E79 PolarHBondContact O-N 3.47Å; L76-L80 WeakPolarHBondContact O-CB 3.48Å; L76-L80 WeakPolarHBondContact O-CD1 3.24Å; L76-L80 VanDerWaalsContact O-CG 3.24Å; L76-L80 WeakPolarHBondContact O-CG 3.45Å; L76-L80 PolarHBondContact O-N 3.43Å |
| 77 | G | 85.9 | Confident | 80.9 | Confident | 0 Ų | 0 | 74.5 Ų | 74.5 | 0% | 0 | 39% | 0.389 | C | S | . | . | H | α-helix | trans | -59.5 | -49.9 | 175.9 | 0 | 0 | 0 | 0 | 0 | 112.6 | E73 I74 Q75 L80 L81 G89 | E73-G77 PolarHBondContact O-N 3.41Å; I74-G77 PolarHBondContact O-N 3.14Å; I74-G77 VanDerWaalsContact O-N 3.14Å; Q75-G77 VanDerWaalsContact C-N 3.32Å; Q75-G77 PolarHBondContact O-N 2.88Å; G77-L80 PolarHBondContact O-N 3.27Å; G77-L81 WeakPolarHBondContact O-CB 3.35Å; G77-L81 VanDerWaalsContact O-CD1 3.28Å; G77-L81 WeakPolarHBondContact O-CD1 3.45Å; G77-L81 WeakPolarHBondContact O-CG 3.28Å; G77-L81 PolarHBondContact O-N 2.97Å; G77-G89 WeakPolarHBondContact CA-O 3.48Å |
| 78 | E | 80.8 | Confident | 81.5 | Confident | 71 Ų | 71 | 71.1 Ų | 71.1 | 33% | 0.332 | 38% | 0.377 | S | S | . | . | H | α-helix | trans | -64.5 | -38.7 | 178.7 | -74.1 | -175.7 | 165.7 | 0 | 0 | 112.5 | I74 Q75 L81 A82 L114 | I74-E78 HydrophobicContact CG2-CG 4.26Å; I74-E78 WeakPolarHBondContact O-CG 3.47Å; I74-E78 PolarHBondContact O-N 3.12Å; Q75-E78 PolarHBondContact O-N 3.06Å; E78-L81 WeakPolarHBondContact O-CB 3.4Å; E78-L81 PolarHBondContact O-N 3.46Å; E78-A82 WeakPolarHBondContact O-CB 3.49Å; E78-A82 PolarHBondContact O-N 2.94Å; E78-L114 HydrophobicContact CG-CD2 4.06Å |
| 79 | E | 83.8 | Confident | 81.7 | Confident | 118 Ų | 118 | 63.6 Ų | 63.6 | 55% | 0.551 | 34% | 0.344 | S | S | * | . | H | α-helix | trans | -67.9 | -42.6 | 177 | 179.6 | 154.1 | -152.5 | 0 | 0 | 111.9 | Q75 L76 L81 A82 Q83 | Q75-E79 WeakPolarHBondContact O-CB 3.07Å; Q75-E79 PolarHBondContact O-N 3.2Å; L76-E79 PolarHBondContact O-N 3.47Å; E79-L81 VanDerWaalsContact C-N 3.31Å; E79-L81 PolarHBondContact O-N 3.38Å; E79-A82 PolarHBondContact O-N 3.45Å; E79-Q83 VanDerWaalsContact O-CG 3.28Å; E79-Q83 WeakPolarHBondContact O-CG 3.47Å; E79-Q83 PolarHBondContact O-N 3.22Å |
| 80 | L | 84.5 | Confident | 81.7 | Confident | 30 Ų | 30 | 61.9 Ų | 61.9 | 16% | 0.157 | 34% | 0.337 | C | S | . | . | H | α-helix | trans | -64.1 | -37.8 | 174 | -71.8 | 167 | 0 | 0 | 0 | 111.7 | L76 G77 Q83 G84 D85 T88 H92 | L76-L80 WeakPolarHBondContact O-CB 3.48Å; L76-L80 WeakPolarHBondContact O-CD1 3.24Å; L76-L80 VanDerWaalsContact O-CG 3.24Å; L76-L80 WeakPolarHBondContact O-CG 3.45Å; L76-L80 PolarHBondContact O-N 3.43Å; G77-L80 PolarHBondContact O-N 3.27Å; L80-Q83 PolarHBondContact O-N 3.05Å; L80-G84 PolarHBondContact O-N 3.23Å; L80-D85 PolarHBondContact O-N 2.95Å; L80-T88 HydrophobicContact CD1-CG2 3.77Å; L80-H92 WeakPolarHBondContact CD1-CD2 3.44Å |
| 81 | L | 81.1 | Confident | 81.8 | Confident | 25 Ų | 25 | 64.3 Ų | 64.3 | 13% | 0.131 | 35% | 0.352 | C | S | . | . | H | α-helix | trans | -63.2 | -42 | 172.6 | -77.3 | 160.6 | 0 | 0 | 0 | 112.2 | G77 E78 E79 Q83 G84 C86 L93 L114 V118 | G77-L81 WeakPolarHBondContact O-CB 3.35Å; G77-L81 VanDerWaalsContact O-CD1 3.28Å; G77-L81 WeakPolarHBondContact O-CD1 3.45Å; G77-L81 WeakPolarHBondContact O-CG 3.28Å; G77-L81 PolarHBondContact O-N 2.97Å; E78-L81 WeakPolarHBondContact O-CB 3.4Å; E78-L81 PolarHBondContact O-N 3.46Å; E79-L81 VanDerWaalsContact C-N 3.31Å; E79-L81 PolarHBondContact O-N 3.38Å; L81-Q83 VanDerWaalsContact C-N 3.27Å; L81-Q83 PolarHBondContact O-N 3.39Å; L81-G84 PolarHBondContact O-N 3.48Å; L81-C86 HydrophobicContact CD2-CB 4.21Å; L81-L93 HydrophobicContact CD1-CD1 3.51Å; L81-L114 HydrophobicContact CD1-CD2 4.2Å; L81-V118 HydrophobicContact CD1-CG1 3.58Å; L81-V118 HydrophobicContact CD2-CB 4.15Å; L81-V118 HydrophobicContact CD2-CG1 3.34Å; L81-V118 HydrophobicContact CD2-CG2 3.68Å; L81-V118 HydrophobicContact CG-CG1 4.11Å |
| 82 | A | 78.9 | Confident | 82.1 | Confident | 92 Ų | 92 | 62.3 Ų | 62.3 | 76% | 0.76 | 34% | 0.34 | S | S | * | . | H | α-helix | trans | -65.5 | -31 | 175.9 | 0 | 0 | 0 | 0 | 0 | 112.3 | E78 E79 G84 | E78-A82 WeakPolarHBondContact O-CB 3.49Å; E78-A82 PolarHBondContact O-N 2.94Å; E79-A82 PolarHBondContact O-N 3.45Å; A82-G84 PolarHBondContact O-N 3.33Å |
| 83 | Q | 83.9 | Confident | 82 | Confident | 133 Ų | 133 | 57.8 Ų | 57.8 | 62% | 0.621 | 32% | 0.319 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -76.8 | -7.9 | 173.5 | -68 | 173.9 | 29.6 | 0 | 0 | 113.3 | E79 L80 L81 | E79-Q83 VanDerWaalsContact O-CG 3.28Å; E79-Q83 WeakPolarHBondContact O-CG 3.47Å; E79-Q83 PolarHBondContact O-N 3.22Å; L80-Q83 PolarHBondContact O-N 3.05Å; L81-Q83 VanDerWaalsContact C-N 3.27Å; L81-Q83 PolarHBondContact O-N 3.39Å |
| 84 | G | 77.5 | Confident | 81.7 | Confident | 58 Ų | 58 | 57.3 Ų | 57.3 | 60% | 0.598 | 32% | 0.317 | S | S | * | . | T | Hydrogen-bonded Turn | trans | 86.9 | 6.2 | -178.6 | 0 | 0 | 0 | 0 | 0 | 114.7 | L80 L81 A82 C86 | L80-G84 PolarHBondContact O-N 3.23Å; L81-G84 PolarHBondContact O-N 3.48Å; A82-G84 PolarHBondContact O-N 3.33Å; G84-C86 PolarHBondContact O-N 2.98Å |
| 85 | D | 79.9 | Confident | 81.6 | Confident | 66 Ų | 66 | 59.5 Ų | 59.5 | 35% | 0.353 | 33% | 0.329 | S | S | . | . | trans | -89.8 | 77.2 | 173.8 | -169.2 | -2.5 | 0 | 0 | 0 | 110.7 | L80 E87 T88 G89 | L80-D85 PolarHBondContact O-N 2.95Å; D85-E87 VanDerWaalsContact C-N 3.34Å; D85-E87 PolarHBondContact O-N 3.36Å; D85-T88 VanDerWaalsContact CG-OG1 3.23Å; D85-T88 PolarHBondContact OD1-N 2.97Å; D85-T88 PolarHBondContact OD1-OG1 3.39Å; D85-T88 WeakPolarHBondContact OD2-CB 3.47Å; D85-T88 PolarHBondContact OD2-OG1 2.77Å; D85-G89 PolarHBondContact O-N 3.31Å; D85-G89 VanDerWaalsContact O-N 3.12Å | ||
| 86 | C | 79.4 | Confident | 81.5 | Confident | 50 Ų | 50 | 53.6 Ų | 53.6 | 34% | 0.338 | 30% | 0.302 | S | S | . | . | H | α-helix | trans | -68.8 | -29.9 | -175.7 | -56.1 | 0 | 0 | 0 | 0 | 113.2 | L81 G84 V90 M121 | L81-C86 HydrophobicContact CD2-CB 4.21Å; G84-C86 PolarHBondContact O-N 2.98Å; C86-V90 WeakPolarHBondContact O-CB 3.29Å; C86-V90 VanDerWaalsContact O-CG2 3.31Å; C86-V90 WeakPolarHBondContact O-CG2 3.31Å; C86-V90 PolarHBondContact O-N 2.84Å; C86-M121 HydrophobicContact CB-CE 3.52Å; C86-M121 WeakPolarHBondContact O-CE 3.45Å |
| 87 | E | 79.5 | Confident | 81.1 | Confident | 151 Ų | 151 | 50.6 Ų | 50.6 | 71% | 0.706 | 29% | 0.286 | S | S | * | . | H | α-helix | trans | -67.6 | -52.9 | -179.2 | -70.7 | -157.3 | 148.2 | 0 | 0 | 110.6 | D85 G89 V90 D91 | D85-E87 VanDerWaalsContact C-N 3.34Å; D85-E87 PolarHBondContact O-N 3.36Å; E87-G89 PolarHBondContact O-N 3.39Å; E87-V90 PolarHBondContact O-N 2.79Å; E87-D91 PolarHBondContact O-N 3.46Å |
| 88 | T | 79.9 | Confident | 80.6 | Confident | 53 Ų | 53 | 52.6 Ų | 52.6 | 33% | 0.325 | 30% | 0.302 | S | S | . | . | H | α-helix | trans | -67.9 | -37.3 | -178.8 | -42.5 | 0 | 0 | 0 | 0 | 111.3 | L80 D85 V90 D91 H92 | L80-T88 HydrophobicContact CD1-CG2 3.77Å; D85-T88 VanDerWaalsContact CG-OG1 3.23Å; D85-T88 PolarHBondContact OD1-N 2.97Å; D85-T88 PolarHBondContact OD1-OG1 3.39Å; D85-T88 WeakPolarHBondContact OD2-CB 3.47Å; D85-T88 PolarHBondContact OD2-OG1 2.77Å; T88-V90 PolarHBondContact O-N 3.05Å; T88-D91 PolarHBondContact O-N 2.95Å; T88-H92 PolarHBondContact O-CD2 3.27Å; T88-H92 VanDerWaalsContact O-CD2 3.28Å; T88-H92 PolarHBondContact O-N 3.36Å |
| 89 | G | 83.1 | Confident | 80.2 | Confident | 0 Ų | 0 | 51.1 Ų | 51.1 | 0% | 0 | 30% | 0.298 | C | S | . | . | H | α-helix | trans | -63 | -39.5 | 177.9 | 0 | 0 | 0 | 0 | 0 | 113.5 | G77 D85 E87 D91 H92 L93 | G77-G89 WeakPolarHBondContact CA-O 3.48Å; D85-G89 PolarHBondContact O-N 3.31Å; D85-G89 VanDerWaalsContact O-N 3.12Å; E87-G89 PolarHBondContact O-N 3.39Å; G89-D91 VanDerWaalsContact C-N 3.35Å; G89-H92 PolarHBondContact O-N 2.69Å; G89-L93 WeakPolarHBondContact O-CD1 3.38Å; G89-L93 PolarHBondContact O-N 3.21Å; G89-L93 VanDerWaalsContact O-N 3.14Å |
| 90 | V | 81.3 | Confident | 79.4 | Confident | 2 Ų | 2 | 47.4 Ų | 47.4 | 1% | 0.012 | 29% | 0.285 | C | S | . | . | H | α-helix | trans | -70.9 | -29.7 | 176.4 | 171 | 0 | 0 | 0 | 0 | 112.4 | C86 E87 T88 T94 V118 M121 L122 K125 | C86-V90 WeakPolarHBondContact O-CB 3.29Å; C86-V90 VanDerWaalsContact O-CG2 3.31Å; C86-V90 WeakPolarHBondContact O-CG2 3.31Å; C86-V90 PolarHBondContact O-N 2.84Å; E87-V90 PolarHBondContact O-N 2.79Å; T88-V90 PolarHBondContact O-N 3.05Å; V90-T94 WeakPolarHBondContact O-CB 3.3Å; V90-T94 PolarHBondContact O-N 3.25Å; V90-T94 PolarHBondContact O-OG1 2.97Å; V90-V118 HydrophobicContact CG2-CG1 4.35Å; V90-M121 HydrophobicContact CB-CE 4.08Å; V90-M121 HydrophobicContact CG2-CB 4.46Å; V90-M121 HydrophobicContact CG2-CE 3.42Å; V90-M121 VanDerWaalsContact CG2-CE 3.42Å; V90-L122 HydrophobicContact CG1-CB 4.28Å; V90-K125 HydrophobicContact CG1-CG 4.14Å |
| 91 | D | 82 | Confident | 78.5 | Confident | 83 Ų | 83 | 49.7 Ų | 49.7 | 44% | 0.444 | 32% | 0.315 | S | S | . | . | H | α-helix | trans | -66.5 | -39.1 | 174.1 | -78.3 | -14 | 0 | 0 | 0 | 111.9 | E87 T88 G89 T94 N95 | E87-D91 PolarHBondContact O-N 3.46Å; T88-D91 PolarHBondContact O-N 2.95Å; G89-D91 VanDerWaalsContact C-N 3.35Å; D91-T94 WeakPolarHBondContact O-CB 3.11Å; D91-T94 PolarHBondContact O-N 3.1Å; D91-N95 VanDerWaalsContact O-CG 3.23Å; D91-N95 PolarHBondContact O-N 3.35Å; D91-N95 PolarHBondContact O-ND2 2.78Å |
| 92 | H | 85 | Confident | 77.6 | Confident | 44 Ų | 44 | 54.7 Ų | 54.7 | 20% | 0.204 | 34% | 0.338 | C | S | . | . | H | α-helix | trans | -68.1 | -45.4 | 174.8 | -78.4 | -70.7 | 0 | 0 | 0 | 112.6 | E73 L80 T88 G89 T94 N95 A96 | E73-H92 IonicContact OE1-ND1 3.49Å; E73-H92 PolarHBondContact OE1-ND1 3.21Å; E73-H92 WeakPolarHBondContact OE2-CA 3.3Å; E73-H92 IonicContact OE2-CE1 2.81Å; E73-H92 IonicContact OE2-CG 3.84Å; E73-H92 IonicContact OE2-ND1 3.5Å; E73-H92 PolarHBondContact OE2-ND1 3.11Å; L80-H92 WeakPolarHBondContact CD1-CD2 3.44Å; T88-H92 PolarHBondContact O-CD2 3.27Å; T88-H92 VanDerWaalsContact O-CD2 3.28Å; T88-H92 PolarHBondContact O-N 3.36Å; G89-H92 PolarHBondContact O-N 2.69Å; H92-T94 PolarHBondContact O-N 3.32Å; H92-N95 PolarHBondContact O-N 2.89Å; H92-N95 VanDerWaalsContact O-N 3.13Å; H92-A96 PolarHBondContact O-N 3.06Å |
| 93 | L | 81.4 | Confident | 76.9 | Confident | 0 Ų | 0 | 53.1 Ų | 53.1 | 0% | 0 | 32% | 0.32 | C | S | . | . | H | α-helix | trans | -58.4 | -37.5 | 172.9 | -79.6 | 155.8 | 0 | 0 | 0 | 112.3 | I74 L81 G89 A96 I97 L110 L114 L122 | I74-L93 HydrophobicContact CG1-CD2 4.19Å; L81-L93 HydrophobicContact CD1-CD1 3.51Å; G89-L93 WeakPolarHBondContact O-CD1 3.38Å; G89-L93 PolarHBondContact O-N 3.21Å; G89-L93 VanDerWaalsContact O-N 3.14Å; L93-A96 WeakPolarHBondContact O-CB 3.33Å; L93-A96 PolarHBondContact O-N 3.26Å; L93-I97 WeakPolarHBondContact O-CG1 3.5Å; L93-I97 PolarHBondContact O-N 3.18Å; L93-I97 VanDerWaalsContact O-N 3.11Å; L93-L110 HydrophobicContact CD2-CD1 4.16Å; L93-L110 HydrophobicContact CD2-CD2 3.65Å; L93-L114 HydrophobicContact CD1-CD1 4.04Å; L93-L114 HydrophobicContact CD2-CD1 4.25Å; L93-L122 HydrophobicContact CB-CD1 3.61Å; L93-L122 HydrophobicContact CD1-CD1 4.14Å; L93-L122 HydrophobicContact CD2-CD1 4.44Å; L93-L122 HydrophobicContact CG-CD1 4.3Å |
| 94 | T | 79.1 | Confident | 75.8 | Confident | 13 Ų | 13 | 54.8 Ų | 54.8 | 8% | 0.08 | 33% | 0.328 | C | S | . | . | H | α-helix | trans | -62.3 | -45.6 | 174.9 | -75.7 | 0 | 0 | 0 | 0 | 112.2 | V90 D91 H92 A96 I97 A98 I129 | V90-T94 WeakPolarHBondContact O-CB 3.3Å; V90-T94 PolarHBondContact O-N 3.25Å; V90-T94 PolarHBondContact O-OG1 2.97Å; D91-T94 WeakPolarHBondContact O-CB 3.11Å; D91-T94 PolarHBondContact O-N 3.1Å; H92-T94 PolarHBondContact O-N 3.32Å; T94-A96 VanDerWaalsContact C-N 3.32Å; T94-A96 PolarHBondContact O-N 3.35Å; T94-I97 PolarHBondContact O-N 3.45Å; T94-A98 PolarHBondContact O-N 3.3Å; T94-I129 HydrophobicContact CG2-CB 4.44Å; T94-I129 HydrophobicContact CG2-CD1 3.09Å; T94-I129 HydrophobicContact CG2-CG1 3.44Å; T94-I129 VanDerWaalsContact CG2-CG1 3.44Å; T94-I129 HydrophobicContact CG2-CG2 4.35Å |
| 95 | N | 78.8 | Confident | 75.2 | Confident | 67 Ų | 67 | 58.4 Ų | 58.4 | 36% | 0.358 | 33% | 0.329 | S | S | . | . | H | α-helix | trans | -63.6 | -40.3 | 178.1 | -64.8 | -28 | 0 | 0 | 0 | 111.1 | D91 H92 I97 A98 V99 | D91-N95 VanDerWaalsContact O-CG 3.23Å; D91-N95 PolarHBondContact O-N 3.35Å; D91-N95 PolarHBondContact O-ND2 2.78Å; H92-N95 PolarHBondContact O-N 2.89Å; H92-N95 VanDerWaalsContact O-N 3.13Å; N95-I97 VanDerWaalsContact C-N 3.34Å; N95-I97 PolarHBondContact O-N 2.89Å; N95-A98 PolarHBondContact O-N 3.11Å; N95-V99 WeakPolarHBondContact O-CG2 3.46Å; N95-V99 PolarHBondContact O-N 3.43Å |
| 96 | A | 80.4 | Confident | 74.6 | Confident | 0 Ų | 0 | 56.2 Ų | 56.2 | 0% | 0 | 32% | 0.317 | C | S | . | . | H | α-helix | trans | -58.7 | -45 | 175.3 | 0 | 0 | 0 | 0 | 0 | 111.7 | F70 E73 I74 H92 L93 T94 A98 V99 C100 | F70-A96 HydrophobicContact CD2-CB 3.66Å; F70-A96 WeakPolarHBondContact CD2-O 3.43Å; F70-A96 HydrophobicContact CE2-CB 3.84Å; E73-A96 HydrophobicContact CB-CB 3.83Å; I74-A96 HydrophobicContact CG1-CB 3.95Å; H92-A96 PolarHBondContact O-N 3.06Å; L93-A96 WeakPolarHBondContact O-CB 3.33Å; L93-A96 PolarHBondContact O-N 3.26Å; T94-A96 VanDerWaalsContact C-N 3.32Å; T94-A96 PolarHBondContact O-N 3.35Å; A96-A98 VanDerWaalsContact C-N 3.32Å; A96-A98 PolarHBondContact O-N 3.49Å; A96-V99 PolarHBondContact O-N 3.03Å; A96-C100 PolarHBondContact O-N 3.13Å |
| 97 | I | 76.6 | Confident | 74.1 | Confident | 7 Ų | 7 | 55.8 Ų | 55.8 | 4% | 0.036 | 31% | 0.311 | C | S | . | . | H | α-helix | trans | -65.8 | -35.7 | 177.4 | -64.8 | 164.8 | 0 | 0 | 0 | 111.4 | L93 T94 N95 V99 C100 P103 L106 L110 L122 L126 | L93-I97 WeakPolarHBondContact O-CG1 3.5Å; L93-I97 PolarHBondContact O-N 3.18Å; L93-I97 VanDerWaalsContact O-N 3.11Å; T94-I97 PolarHBondContact O-N 3.45Å; N95-I97 VanDerWaalsContact C-N 3.34Å; N95-I97 PolarHBondContact O-N 2.89Å; I97-V99 PolarHBondContact O-N 3.04Å; I97-C100 PolarHBondContact O-N 3.45Å; I97-C100 VanDerWaalsContact O-N 3.15Å; I97-P103 HydrophobicContact CG2-CB 4.17Å; I97-L106 HydrophobicContact CG1-CD2 4.17Å; I97-L110 HydrophobicContact CD1-CD1 4.16Å; I97-L110 HydrophobicContact CG1-CD1 4.37Å; I97-L122 HydrophobicContact CD1-CD1 4.11Å; I97-L122 HydrophobicContact CD1-CD2 3.8Å; I97-L122 HydrophobicContact CD1-CG 4.32Å; I97-L126 HydrophobicContact CD1-CD2 4.25Å; I97-L126 HydrophobicContact CG2-CD2 4.03Å |
| 98 | A | 75.5 | Confident | 73.6 | Confident | 41 Ų | 41 | 54.7 Ų | 54.7 | 34% | 0.339 | 31% | 0.306 | S | S | . | . | H | α-helix | trans | -65.6 | -28.1 | 179.8 | 0 | 0 | 0 | 0 | 0 | 113.8 | T94 N95 A96 I129 I133 | T94-A98 PolarHBondContact O-N 3.3Å; N95-A98 PolarHBondContact O-N 3.11Å; A96-A98 VanDerWaalsContact C-N 3.32Å; A96-A98 PolarHBondContact O-N 3.49Å; A98-I129 HydrophobicContact CB-CG2 4.16Å; A98-I133 HydrophobicContact CB-CD1 4.03Å; A98-I133 HydrophobicContact CB-CG1 4.24Å |
| 99 | V | 73.6 | Confident | 73.2 | Confident | 40 Ų | 40 | 56.7 Ų | 56.7 | 24% | 0.242 | 32% | 0.318 | C | S | . | . | H | α-helix | trans | -85.1 | -15.5 | 178.1 | 176.8 | 0 | 0 | 0 | 0 | 111.6 | V66 F69 N95 A96 I97 | V66-V99 HydrophobicContact CB-CG1 4.21Å; V66-V99 HydrophobicContact CG1-CG1 3.37Å; V66-V99 HydrophobicContact CG2-CG1 4.38Å; F69-V99 HydrophobicContact CD1-CG1 4.46Å; F69-V99 HydrophobicContact CD1-CG2 4.09Å; F69-V99 HydrophobicContact CE1-CG2 3.98Å; N95-V99 WeakPolarHBondContact O-CG2 3.46Å; N95-V99 PolarHBondContact O-N 3.43Å; A96-V99 PolarHBondContact O-N 3.03Å; I97-V99 PolarHBondContact O-N 3.04Å |
| 100 | C | 66.9 | Low | 72.6 | Confident | 41 Ų | 41 | 56.9 Ų | 56.9 | 28% | 0.277 | 32% | 0.319 | S | S | . | . | trans | -89.4 | 119 | -178.8 | -150.9 | 0 | 0 | 0 | 0 | 111.9 | A96 I97 Q102 L106 | A96-C100 PolarHBondContact O-N 3.13Å; I97-C100 PolarHBondContact O-N 3.45Å; I97-C100 VanDerWaalsContact O-N 3.15Å; C100-Q102 PolarHBondContact O-N 3.29Å; C100-L106 HydrophobicContact CB-CD1 3.83Å; C100-L106 WeakPolarHBondContact SG-CD1 3.31Å | ||
| 101 | G | 65.4 | Low | 72 | Confident | 77 Ų | 77 | 62 Ų | 62 | 79% | 0.794 | 34% | 0.343 | S | S | * | . | S | Bend | trans | -66.4 | -13 | 176.7 | 0 | 0 | 0 | 0 | 0 | 114.8 | ||
| 102 | Q | 60.7 | Low | 71.6 | Confident | 130 Ų | 130 | 65.4 Ų | 65.4 | 61% | 0.607 | 36% | 0.356 | S | S | * | . | trans | -128 | 85.3 | 177.7 | -78.9 | -178.7 | -16.3 | 0 | 0 | 111.4 | C100 Q104 | C100-Q102 PolarHBondContact O-N 3.29Å; Q102-Q104 VanDerWaalsContact C-N 3.27Å; Q102-Q104 PolarHBondContact O-N 3.02Å | ||
| 103 | P | 64.8 | Low | 70.9 | Confident | 59 Ų | 59 | 67 Ų | 67 | 38% | 0.383 | 37% | 0.369 | S | S | . | . | H | α-helix | trans | -66.7 | -25.5 | -177.6 | 24.9 | -33.9 | 0 | 0 | 0 | 113.5 | I97 L107 | I97-P103 HydrophobicContact CG2-CB 4.17Å; P103-L107 VanDerWaalsContact O-CB 3.31Å; P103-L107 WeakPolarHBondContact O-CB 3.4Å; P103-L107 PolarHBondContact O-N 3.25Å |
| 104 | Q | 60.9 | Low | 70.1 | Confident | 169 Ų | 169 | 67.8 Ų | 67.8 | 79% | 0.79 | 37% | 0.373 | S | S | * | . | H | α-helix | trans | -67.3 | -46 | -173.4 | -70.1 | -175.3 | -35 | 0 | 0 | 113.6 | Q102 L106 Q108 | Q102-Q104 VanDerWaalsContact C-N 3.27Å; Q102-Q104 PolarHBondContact O-N 3.02Å; Q104-L106 PolarHBondContact O-N 3.14Å; Q104-Q108 PolarHBondContact O-N 3.45Å |
| 105 | Q | 65.9 | Low | 69.7 | Low | 133 Ų | 133 | 70.7 Ų | 70.7 | 62% | 0.621 | 39% | 0.392 | S | S | * | . | H | α-helix | trans | -69.4 | -31.7 | -177.2 | -154.6 | 163.1 | 1.8 | 0 | 0 | 111.1 | V109 | Q105-V109 PolarHBondContact O-N 3.11Å |
| 106 | L | 67.4 | Low | 69.2 | Low | 20 Ų | 20 | 72.5 Ų | 72.5 | 11% | 0.105 | 41% | 0.408 | C | S | . | . | H | α-helix | trans | -77.8 | -40.9 | -178.9 | -145.1 | 134.2 | 0 | 0 | 0 | 112.8 | F70 I74 I97 C100 Q104 Q108 V109 L110 | F70-L106 HydrophobicContact CD2-CD1 3.98Å; F70-L106 HydrophobicContact CE1-CD1 3.9Å; F70-L106 HydrophobicContact CE1-CG 4.45Å; F70-L106 HydrophobicContact CE2-CD1 3.13Å; F70-L106 HydrophobicContact CE2-CD2 3.31Å; F70-L106 HydrophobicContact CE2-CG 3.64Å; F70-L106 HydrophobicContact CZ-CD1 3.07Å; F70-L106 HydrophobicContact CZ-CD2 3.38Å; F70-L106 HydrophobicContact CZ-CG 3.4Å; F70-L106 VanDerWaalsContact CZ-CG 3.4Å; I74-L106 HydrophobicContact CD1-CD2 4.35Å; I97-L106 HydrophobicContact CG1-CD2 4.17Å; C100-L106 HydrophobicContact CB-CD1 3.83Å; C100-L106 WeakPolarHBondContact SG-CD1 3.31Å; Q104-L106 PolarHBondContact O-N 3.14Å; L106-Q108 PolarHBondContact O-N 3.37Å; L106-V109 PolarHBondContact O-N 3.33Å; L106-L110 HydrophobicContact CD2-CD1 3.61Å; L106-L110 HydrophobicContact CD2-CG 4.11Å; L106-L110 WeakPolarHBondContact O-CB 3.46Å; L106-L110 WeakPolarHBondContact O-CG 3.44Å; L106-L110 PolarHBondContact O-N 3.35Å |
| 107 | L | 67.8 | Low | 68.8 | Low | 41 Ų | 41 | 77 Ų | 77 | 22% | 0.215 | 44% | 0.437 | C | S | . | . | H | α-helix | trans | -54.9 | -38.6 | 170.4 | -103.6 | 152.6 | 0 | 0 | 0 | 111.6 | P103 Q111 F119 L123 L126 | P103-L107 VanDerWaalsContact O-CB 3.31Å; P103-L107 WeakPolarHBondContact O-CB 3.4Å; P103-L107 PolarHBondContact O-N 3.25Å; L107-Q111 WeakPolarHBondContact O-CB 3.5Å; L107-Q111 PolarHBondContact O-N 3.49Å; L107-F119 HydrophobicContact CD2-CE2 3.63Å; L107-F119 HydrophobicContact CD2-CZ 3.48Å; L107-F119 VanDerWaalsContact CD2-CZ 3.48Å; L107-L123 HydrophobicContact CD2-CD2 4.31Å; L107-L126 HydrophobicContact CD1-CD1 4.14Å; L107-L126 HydrophobicContact CD2-CD1 4.08Å; L107-L126 HydrophobicContact CG-CD1 4.48Å |
| 108 | Q | 68.5 | Low | 68.3 | Low | 129 Ų | 129 | 77.6 Ų | 77.6 | 60% | 0.603 | 44% | 0.441 | S | S | * | . | H | α-helix | trans | -69.2 | -40.1 | -179.5 | -167.1 | 168.6 | 9.1 | 0 | 0 | 112.5 | Q104 L106 Q112 | Q104-Q108 PolarHBondContact O-N 3.45Å; L106-Q108 PolarHBondContact O-N 3.37Å; Q108-Q112 WeakPolarHBondContact O-CG 3.28Å; Q108-Q112 PolarHBondContact O-N 3.39Å |
| 109 | V | 72.9 | Confident | 68.2 | Low | 94 Ų | 94 | 77 Ų | 77 | 57% | 0.57 | 43% | 0.431 | S | S | * | . | H | α-helix | trans | -67.8 | -47 | 174.7 | 177.4 | 0 | 0 | 0 | 0 | 110.5 | Q105 L106 Q111 Q112 T113 | Q105-V109 PolarHBondContact O-N 3.11Å; L106-V109 PolarHBondContact O-N 3.33Å; V109-Q111 VanDerWaalsContact C-N 3.26Å; V109-Q111 PolarHBondContact O-N 2.91Å; V109-Q112 WeakPolarHBondContact O-CB 3.19Å; V109-Q112 PolarHBondContact O-N 2.92Å; V109-T113 HydrophobicContact CG1-CG2 4.37Å; V109-T113 PolarHBondContact O-N 3.48Å; V109-T113 VanDerWaalsContact O-N 3.11Å |
| 110 | L | 68.7 | Low | 68.1 | Low | 4 Ų | 4 | 81.5 Ų | 81.5 | 2% | 0.021 | 45% | 0.449 | C | S | . | . | H | α-helix | trans | -60.7 | -33.8 | 178.3 | -75.3 | 176.3 | 0 | 0 | 0 | 112.9 | I74 L93 I97 L106 Q112 T113 L114 | I74-L110 HydrophobicContact CD1-CD2 3.96Å; L93-L110 HydrophobicContact CD2-CD1 4.16Å; L93-L110 HydrophobicContact CD2-CD2 3.65Å; I97-L110 HydrophobicContact CD1-CD1 4.16Å; I97-L110 HydrophobicContact CG1-CD1 4.37Å; L106-L110 HydrophobicContact CD2-CD1 3.61Å; L106-L110 HydrophobicContact CD2-CG 4.11Å; L106-L110 WeakPolarHBondContact O-CB 3.46Å; L106-L110 WeakPolarHBondContact O-CG 3.44Å; L106-L110 PolarHBondContact O-N 3.35Å; L110-Q112 PolarHBondContact O-N 2.92Å; L110-T113 PolarHBondContact O-N 3.3Å; L110-T113 PolarHBondContact O-OG1 3.49Å; L110-L114 HydrophobicContact CB-CD1 4.36Å; L110-L114 HydrophobicContact CD2-CD1 4.07Å; L110-L114 HydrophobicContact CD2-CG 4.48Å; L110-L114 VanDerWaalsContact O-CB 3.29Å; L110-L114 WeakPolarHBondContact O-CB 3.48Å; L110-L114 WeakPolarHBondContact O-CG 3.38Å; L110-L114 PolarHBondContact O-N 3.08Å |
| 111 | Q | 69.9 | Low | 68.3 | Low | 109 Ų | 109 | 82.5 Ų | 82.5 | 51% | 0.509 | 45% | 0.45 | S | S | . | . | H | α-helix | trans | -64.3 | -29.9 | 174.2 | -172.2 | -177.1 | 11 | 0 | 0 | 112.5 | L107 V109 F119 | L107-Q111 WeakPolarHBondContact O-CB 3.5Å; L107-Q111 PolarHBondContact O-N 3.49Å; V109-Q111 VanDerWaalsContact C-N 3.26Å; V109-Q111 PolarHBondContact O-N 2.91Å; Q111-F119 HydrophobicContact CB-CD2 4.45Å; Q111-F119 HydrophobicContact CB-CE2 3.89Å; Q111-F119 HydrophobicContact CB-CZ 3.92Å; Q111-F119 HydrophobicContact CG-CE1 4.25Å; Q111-F119 HydrophobicContact CG-CE2 4.46Å; Q111-F119 HydrophobicContact CG-CZ 4.15Å |
| 112 | Q | 72.3 | Confident | 68.6 | Low | 156 Ų | 156 | 78.8 Ų | 78.8 | 73% | 0.729 | 41% | 0.413 | S | S | * | . | H | α-helix | trans | -84.1 | -26.7 | 178.4 | -63 | -64.7 | -52 | 0 | 0 | 112.4 | Q108 V109 L110 | Q108-Q112 WeakPolarHBondContact O-CG 3.28Å; Q108-Q112 PolarHBondContact O-N 3.39Å; V109-Q112 WeakPolarHBondContact O-CB 3.19Å; V109-Q112 PolarHBondContact O-N 2.92Å; L110-Q112 PolarHBondContact O-N 2.92Å |
| 113 | T | 71.8 | Confident | 69.1 | Low | 77 Ų | 77 | 76.4 Ų | 76.4 | 47% | 0.472 | 40% | 0.404 | S | S | . | . | H | α-helix | trans | -94.1 | -26.2 | -177.5 | 63.3 | 0 | 0 | 0 | 0 | 113.6 | V109 L110 | V109-T113 HydrophobicContact CG1-CG2 4.37Å; V109-T113 PolarHBondContact O-N 3.48Å; V109-T113 VanDerWaalsContact O-N 3.11Å; L110-T113 PolarHBondContact O-N 3.3Å; L110-T113 PolarHBondContact O-OG1 3.49Å |
| 114 | L | 64.7 | Low | 69.6 | Low | 17 Ų | 17 | 78.1 Ų | 78.1 | 9% | 0.089 | 41% | 0.413 | C | S | . | . | S | Bend | trans | -102.4 | 143.4 | -174.7 | -63.1 | 177.8 | 0 | 0 | 0 | 113.8 | E78 L81 L93 L110 V118 | E78-L114 HydrophobicContact CG-CD2 4.06Å; L81-L114 HydrophobicContact CD1-CD2 4.2Å; L93-L114 HydrophobicContact CD1-CD1 4.04Å; L93-L114 HydrophobicContact CD2-CD1 4.25Å; L110-L114 HydrophobicContact CB-CD1 4.36Å; L110-L114 HydrophobicContact CD2-CD1 4.07Å; L110-L114 HydrophobicContact CD2-CG 4.48Å; L110-L114 VanDerWaalsContact O-CB 3.29Å; L110-L114 WeakPolarHBondContact O-CB 3.48Å; L110-L114 WeakPolarHBondContact O-CG 3.38Å; L110-L114 PolarHBondContact O-N 3.08Å; L114-V118 HydrophobicContact CD1-CG1 4.36Å |
| 115 | P | 69.3 | Low | 70 | Confident | 73 Ų | 73 | 74.6 Ų | 74.6 | 47% | 0.474 | 40% | 0.395 | S | S | . | . | trans | -60.1 | 144.8 | 170 | -22.7 | 33 | 0 | 0 | 0 | 112.6 | P117 V118 F119 | P115-P117 HydrophobicContact CB-CG 4.4Å; P115-V118 PolarHBondContact O-N 2.92Å; P115-V118 VanDerWaalsContact O-N 3.11Å; P115-F119 PolarHBondContact O-N 3.45Å | ||
| 116 | P | 69.4 | Low | 70.1 | Confident | 105 Ų | 105 | 69.6 Ų | 69.6 | 68% | 0.682 | 37% | 0.372 | S | S | * | . | H | α-helix | trans | -48.5 | -42.1 | -178.8 | -25.5 | 32.1 | 0 | 0 | 0 | 116.8 | V118 F119 Q120 | P116-V118 VanDerWaalsContact C-N 3.32Å; P116-V118 PolarHBondContact O-N 3.01Å; P116-F119 PolarHBondContact O-N 2.98Å; P116-Q120 PolarHBondContact O-N 3.35Å; P116-Q120 VanDerWaalsContact O-N 3.07Å |
| 117 | P | 72.1 | Confident | 70 | Confident | 95 Ų | 95 | 72.2 Ų | 72.2 | 62% | 0.617 | 39% | 0.39 | S | S | * | . | H | α-helix | trans | -67.3 | -30.6 | -177.6 | 23.4 | -32.8 | 0 | 0 | 0 | 113.5 | P115 M121 | P115-P117 HydrophobicContact CB-CG 4.4Å; P117-M121 PolarHBondContact O-N 3.06Å |
| 118 | V | 66.8 | Low | 69.8 | Low | 20 Ų | 20 | 73.6 Ų | 73.6 | 12% | 0.121 | 40% | 0.401 | C | S | . | . | H | α-helix | trans | -74.3 | -44.2 | 178.4 | 176.3 | 0 | 0 | 0 | 0 | 110.2 | L81 V90 L114 P115 P116 Q120 M121 L122 | L81-V118 HydrophobicContact CD1-CG1 3.58Å; L81-V118 HydrophobicContact CD2-CB 4.15Å; L81-V118 HydrophobicContact CD2-CG1 3.34Å; L81-V118 HydrophobicContact CD2-CG2 3.68Å; L81-V118 HydrophobicContact CG-CG1 4.11Å; V90-V118 HydrophobicContact CG2-CG1 4.35Å; L114-V118 HydrophobicContact CD1-CG1 4.36Å; P115-V118 PolarHBondContact O-N 2.92Å; P115-V118 VanDerWaalsContact O-N 3.11Å; P116-V118 VanDerWaalsContact C-N 3.32Å; P116-V118 PolarHBondContact O-N 3.01Å; V118-Q120 VanDerWaalsContact C-N 3.28Å; V118-Q120 PolarHBondContact O-N 3.34Å; V118-M121 WeakPolarHBondContact O-CB 3.34Å; V118-M121 PolarHBondContact O-N 2.84Å; V118-M121 VanDerWaalsContact O-N 3.14Å; V118-L122 PolarHBondContact O-N 2.89Å |
| 119 | F | 71.8 | Confident | 69.5 | Low | 28 Ų | 28 | 68.3 Ų | 68.3 | 12% | 0.123 | 38% | 0.376 | C | S | . | . | H | α-helix | trans | -60.3 | -39.2 | 177.5 | -171.6 | -105.7 | 0 | 0 | 0 | 111.9 | L107 Q111 P115 P116 M121 L122 L123 | L107-F119 HydrophobicContact CD2-CE2 3.63Å; L107-F119 HydrophobicContact CD2-CZ 3.48Å; L107-F119 VanDerWaalsContact CD2-CZ 3.48Å; Q111-F119 HydrophobicContact CB-CD2 4.45Å; Q111-F119 HydrophobicContact CB-CE2 3.89Å; Q111-F119 HydrophobicContact CB-CZ 3.92Å; Q111-F119 HydrophobicContact CG-CE1 4.25Å; Q111-F119 HydrophobicContact CG-CE2 4.46Å; Q111-F119 HydrophobicContact CG-CZ 4.15Å; P115-F119 PolarHBondContact O-N 3.45Å; P116-F119 PolarHBondContact O-N 2.98Å; F119-M121 VanDerWaalsContact C-N 3.33Å; F119-M121 PolarHBondContact O-N 3.14Å; F119-L122 WeakPolarHBondContact O-CB 3.41Å; F119-L122 PolarHBondContact O-N 3.37Å; F119-L123 HydrophobicContact CD1-CD1 3.77Å; F119-L123 HydrophobicContact CD1-CG 4.15Å; F119-L123 HydrophobicContact CE1-CD1 3.64Å; F119-L123 HydrophobicContact CE1-CD2 4.23Å; F119-L123 HydrophobicContact CE1-CG 3.98Å; F119-L123 HydrophobicContact CZ-CD2 4.41Å; F119-L123 WeakPolarHBondContact O-CG 3.27Å; F119-L123 PolarHBondContact O-N 3.18Å |
| 120 | Q | 72.4 | Confident | 68.9 | Low | 134 Ų | 134 | 67 Ų | 67 | 63% | 0.626 | 37% | 0.371 | S | S | * | . | H | α-helix | trans | -65.6 | -36.7 | 177.2 | -162.2 | 164.7 | 11.6 | 0 | 0 | 112.4 | P116 V118 L123 T124 | P116-Q120 PolarHBondContact O-N 3.35Å; P116-Q120 VanDerWaalsContact O-N 3.07Å; V118-Q120 VanDerWaalsContact C-N 3.28Å; V118-Q120 PolarHBondContact O-N 3.34Å; Q120-L123 PolarHBondContact O-N 3.15Å; Q120-T124 PolarHBondContact O-N 3.48Å; Q120-T124 VanDerWaalsContact O-N 3.11Å |
| 121 | M | 71.8 | Confident | 68.4 | Low | 62 Ų | 62 | 73.6 Ų | 73.6 | 31% | 0.305 | 40% | 0.402 | S | S | . | . | H | α-helix | trans | -66.5 | -39.9 | 174.8 | -153.3 | 168.2 | 71.5 | 0 | 0 | 111.3 | C86 V90 P117 V118 F119 T124 K125 | C86-M121 HydrophobicContact CB-CE 3.52Å; C86-M121 WeakPolarHBondContact O-CE 3.45Å; V90-M121 HydrophobicContact CB-CE 4.08Å; V90-M121 HydrophobicContact CG2-CB 4.46Å; V90-M121 HydrophobicContact CG2-CE 3.42Å; V90-M121 VanDerWaalsContact CG2-CE 3.42Å; P117-M121 PolarHBondContact O-N 3.06Å; V118-M121 WeakPolarHBondContact O-CB 3.34Å; V118-M121 PolarHBondContact O-N 2.84Å; V118-M121 VanDerWaalsContact O-N 3.14Å; F119-M121 VanDerWaalsContact C-N 3.33Å; F119-M121 PolarHBondContact O-N 3.14Å; M121-T124 PolarHBondContact O-N 3.38Å; M121-T124 PolarHBondContact O-OG1 3.07Å; M121-K125 PolarHBondContact O-N 3.31Å |
| 122 | L | 71.3 | Confident | 67.9 | Low | 0 Ų | 0 | 76.4 Ų | 76.4 | 0% | 0 | 41% | 0.408 | C | S | . | . | H | α-helix | trans | -61.8 | -42.9 | 172.3 | -172 | 147.7 | 0 | 0 | 0 | 112 | V90 L93 I97 V118 F119 T124 K125 L126 | V90-L122 HydrophobicContact CG1-CB 4.28Å; L93-L122 HydrophobicContact CB-CD1 3.61Å; L93-L122 HydrophobicContact CD1-CD1 4.14Å; L93-L122 HydrophobicContact CD2-CD1 4.44Å; L93-L122 HydrophobicContact CG-CD1 4.3Å; I97-L122 HydrophobicContact CD1-CD1 4.11Å; I97-L122 HydrophobicContact CD1-CD2 3.8Å; I97-L122 HydrophobicContact CD1-CG 4.32Å; V118-L122 PolarHBondContact O-N 2.89Å; F119-L122 WeakPolarHBondContact O-CB 3.41Å; F119-L122 PolarHBondContact O-N 3.37Å; L122-T124 VanDerWaalsContact C-N 3.3Å; L122-T124 PolarHBondContact O-N 3.47Å; L122-K125 PolarHBondContact O-N 2.86Å; L122-K125 VanDerWaalsContact O-N 3.1Å; L122-L126 HydrophobicContact CD2-CD1 3.55Å; L122-L126 HydrophobicContact CD2-CG 3.9Å; L122-L126 PolarHBondContact O-N 3.42Å |
| 123 | L | 70.9 | Confident | 67.3 | Low | 80 Ų | 80 | 71 Ų | 71 | 42% | 0.419 | 38% | 0.383 | S | S | . | . | H | α-helix | trans | -60.1 | -36 | 175.2 | -73.3 | 173.3 | 0 | 0 | 0 | 113.1 | L107 F119 Q120 K125 L126 P127 | L107-L123 HydrophobicContact CD2-CD2 4.31Å; F119-L123 HydrophobicContact CD1-CD1 3.77Å; F119-L123 HydrophobicContact CD1-CG 4.15Å; F119-L123 HydrophobicContact CE1-CD1 3.64Å; F119-L123 HydrophobicContact CE1-CD2 4.23Å; F119-L123 HydrophobicContact CE1-CG 3.98Å; F119-L123 HydrophobicContact CZ-CD2 4.41Å; F119-L123 WeakPolarHBondContact O-CG 3.27Å; F119-L123 PolarHBondContact O-N 3.18Å; Q120-L123 PolarHBondContact O-N 3.15Å; L123-K125 VanDerWaalsContact C-N 3.29Å; L123-K125 PolarHBondContact O-N 3.34Å; L123-L126 HydrophobicContact CD2-CD1 3.98Å; L123-P127 WeakPolarHBondContact O-CD 3.39Å |
| 124 | T | 75.9 | Confident | 66.7 | Low | 94 Ų | 94 | 71.7 Ų | 71.7 | 58% | 0.577 | 39% | 0.387 | S | S | * | . | H | α-helix | trans | -69.5 | -27 | 176.3 | 59.5 | 0 | 0 | 0 | 0 | 113.5 | Q120 M121 L122 | Q120-T124 PolarHBondContact O-N 3.48Å; Q120-T124 VanDerWaalsContact O-N 3.11Å; M121-T124 PolarHBondContact O-N 3.38Å; M121-T124 PolarHBondContact O-OG1 3.07Å; L122-T124 VanDerWaalsContact C-N 3.3Å; L122-T124 PolarHBondContact O-N 3.47Å |
| 125 | K | 68 | Low | 66.4 | Low | 96 Ų | 96 | 73.7 Ų | 73.7 | 42% | 0.417 | 40% | 0.403 | S | S | . | . | H | α-helix | trans | -84.7 | -38.5 | 179.2 | -65.1 | -74.9 | -178.5 | 150.9 | 0 | 111.3 | V90 M121 L122 L123 P127 T128 I129 | V90-K125 HydrophobicContact CG1-CG 4.14Å; M121-K125 PolarHBondContact O-N 3.31Å; L122-K125 PolarHBondContact O-N 2.86Å; L122-K125 VanDerWaalsContact O-N 3.1Å; L123-K125 VanDerWaalsContact C-N 3.29Å; L123-K125 PolarHBondContact O-N 3.34Å; K125-P127 VanDerWaalsContact C-CD 3.48Å; K125-T128 VanDerWaalsContact O-CB 3.31Å; K125-T128 WeakPolarHBondContact O-CB 3.46Å; K125-T128 PolarHBondContact O-N 3Å; K125-I129 HydrophobicContact CB-CD1 4.07Å; K125-I129 VanDerWaalsContact O-CD1 3.3Å; K125-I129 WeakPolarHBondContact O-CD1 3.38Å |
| 126 | L | 68.1 | Low | 65.6 | Low | 28 Ų | 28 | 73.1 Ų | 73.1 | 15% | 0.147 | 40% | 0.404 | C | S | . | . | H | α-helix | trans | -41.6 | -49.5 | -178.1 | -94.4 | 172.9 | 0 | 0 | 0 | 116.6 | I97 L107 L122 L123 T128 I129 S130 | I97-L126 HydrophobicContact CD1-CD2 4.25Å; I97-L126 HydrophobicContact CG2-CD2 4.03Å; L107-L126 HydrophobicContact CD1-CD1 4.14Å; L107-L126 HydrophobicContact CD2-CD1 4.08Å; L107-L126 HydrophobicContact CG-CD1 4.48Å; L122-L126 HydrophobicContact CD2-CD1 3.55Å; L122-L126 HydrophobicContact CD2-CG 3.9Å; L122-L126 PolarHBondContact O-N 3.42Å; L123-L126 HydrophobicContact CD2-CD1 3.98Å; L126-T128 PolarHBondContact O-N 3.12Å; L126-I129 PolarHBondContact O-N 2.99Å; L126-S130 PolarHBondContact O-N 3.09Å |
| 127 | P | 65.3 | Low | 64.8 | Low | 74 Ų | 74 | 73.6 Ų | 73.6 | 48% | 0.481 | 40% | 0.397 | S | S | . | . | H | α-helix | trans | -62.7 | -29.7 | -178.9 | 20.8 | -31.3 | 0 | 0 | 0 | 113.2 | L123 K125 I129 Q131 | L123-P127 WeakPolarHBondContact O-CD 3.39Å; K125-P127 VanDerWaalsContact C-CD 3.48Å; P127-I129 VanDerWaalsContact C-N 3.32Å; P127-Q131 WeakPolarHBondContact O-CG 3.32Å; P127-Q131 PolarHBondContact O-N 3.45Å |
| 128 | T | 64.3 | Low | 63.8 | Low | 70 Ų | 70 | 72.2 Ų | 72.2 | 43% | 0.429 | 39% | 0.39 | S | S | . | . | H | α-helix | trans | -69.4 | -33.5 | 176 | -50 | 0 | 0 | 0 | 0 | 111.3 | K125 L126 R132 | K125-T128 VanDerWaalsContact O-CB 3.31Å; K125-T128 WeakPolarHBondContact O-CB 3.46Å; K125-T128 PolarHBondContact O-N 3Å; L126-T128 PolarHBondContact O-N 3.12Å; T128-R132 WeakPolarHBondContact O-CG 3.46Å; T128-R132 PolarHBondContact O-N 3.45Å |
| 129 | I | 62.8 | Low | 62.9 | Low | 19 Ų | 19 | 77.6 Ų | 77.6 | 10% | 0.097 | 42% | 0.417 | C | S | . | . | H | α-helix | trans | -84 | -39.8 | -179.9 | -62.7 | 124.9 | 0 | 0 | 0 | 111 | T94 A98 K125 L126 P127 Q131 R132 I133 | T94-I129 HydrophobicContact CG2-CB 4.44Å; T94-I129 HydrophobicContact CG2-CD1 3.09Å; T94-I129 HydrophobicContact CG2-CG1 3.44Å; T94-I129 VanDerWaalsContact CG2-CG1 3.44Å; T94-I129 HydrophobicContact CG2-CG2 4.35Å; A98-I129 HydrophobicContact CB-CG2 4.16Å; K125-I129 HydrophobicContact CB-CD1 4.07Å; K125-I129 VanDerWaalsContact O-CD1 3.3Å; K125-I129 WeakPolarHBondContact O-CD1 3.38Å; L126-I129 PolarHBondContact O-N 2.99Å; P127-I129 VanDerWaalsContact C-N 3.32Å; I129-Q131 PolarHBondContact O-N 3.46Å; I129-R132 CarbonylContact O-C 3.52Å; I129-R132 WeakPolarHBondContact O-CA 3.24Å; I129-R132 WeakPolarHBondContact O-CB 3.5Å; I129-R132 PolarHBondContact O-N 3.47Å; I129-I133 HydrophobicContact CG2-CD1 3.67Å; I129-I133 HydrophobicContact CG2-CG1 4.01Å; I129-I133 VanDerWaalsContact O-CG1 3.31Å; I129-I133 WeakPolarHBondContact O-CG1 3.46Å; I129-I133 PolarHBondContact O-N 3.04Å |
| 130 | S | 58.9 | Low | 61.8 | Low | 65 Ų | 65 | 79.6 Ų | 79.6 | 46% | 0.455 | 44% | 0.439 | S | S | . | . | H | α-helix | trans | -52.5 | -45.4 | 171.1 | 158.7 | 0 | 0 | 0 | 0 | 111.3 | L126 R132 I133 V134 | L126-S130 PolarHBondContact O-N 3.09Å; S130-R132 VanDerWaalsContact C-N 3.34Å; S130-R132 PolarHBondContact O-N 3.49Å; S130-I133 PolarHBondContact O-N 2.94Å; S130-V134 WeakPolarHBondContact O-CB 3.29Å; S130-V134 VanDerWaalsContact O-CG2 3.27Å; S130-V134 WeakPolarHBondContact O-CG2 3.39Å; S130-V134 PolarHBondContact O-N 2.98Å |
| 131 | Q | 59.6 | Low | 60.6 | Low | 143 Ų | 143 | 80.9 Ų | 80.9 | 67% | 0.668 | 45% | 0.445 | S | S | * | . | H | α-helix | trans | -61.6 | -40.9 | 174.5 | -74.8 | -178.4 | -14.6 | 0 | 0 | 112.4 | P127 I129 S135 | P127-Q131 WeakPolarHBondContact O-CG 3.32Å; P127-Q131 PolarHBondContact O-N 3.45Å; I129-Q131 PolarHBondContact O-N 3.46Å; Q131-S135 WeakPolarHBondContact O-CB 3.34Å; Q131-S135 PolarHBondContact O-N 3.28Å; Q131-S135 PolarHBondContact O-OG 3.29Å |
| 132 | R | 58.4 | Low | 59.1 | Low | 169 Ų | 169 | 84.8 Ų | 84.8 | 64% | 0.638 | 47% | 0.467 | S | S | * | . | H | α-helix | trans | -66.7 | -42.3 | 176.9 | -76 | -177.9 | -178.1 | 168.5 | 2.9 | 113 | T128 I129 S130 S135 A136 | T128-R132 WeakPolarHBondContact O-CG 3.46Å; T128-R132 PolarHBondContact O-N 3.45Å; I129-R132 CarbonylContact O-C 3.52Å; I129-R132 WeakPolarHBondContact O-CA 3.24Å; I129-R132 WeakPolarHBondContact O-CB 3.5Å; I129-R132 PolarHBondContact O-N 3.47Å; S130-R132 VanDerWaalsContact C-N 3.34Å; S130-R132 PolarHBondContact O-N 3.49Å; R132-S135 VanDerWaalsContact CA-OG 3.26Å; R132-S135 WeakPolarHBondContact CA-OG 3.31Å; R132-S135 PolarHBondContact O-N 3.41Å; R132-S135 PolarHBondContact O-OG 3.24Å; R132-A136 WeakPolarHBondContact O-CB 3.23Å; R132-A136 PolarHBondContact O-N 3.39Å |
| 133 | I | 60 | Low | 57.6 | Low | 42 Ų | 42 | 92 Ų | 92 | 22% | 0.215 | 51% | 0.506 | C | S | . | . | H | α-helix | trans | -64 | -48 | 178.1 | -65.3 | 164.2 | 0 | 0 | 0 | 109.3 | A98 I129 S130 S135 A136 Q137 | A98-I133 HydrophobicContact CB-CD1 4.03Å; A98-I133 HydrophobicContact CB-CG1 4.24Å; I129-I133 HydrophobicContact CG2-CD1 3.67Å; I129-I133 HydrophobicContact CG2-CG1 4.01Å; I129-I133 VanDerWaalsContact O-CG1 3.31Å; I129-I133 WeakPolarHBondContact O-CG1 3.46Å; I129-I133 PolarHBondContact O-N 3.04Å; S130-I133 PolarHBondContact O-N 2.94Å; I133-S135 VanDerWaalsContact C-N 3.31Å; I133-S135 PolarHBondContact O-N 3.31Å; I133-A136 PolarHBondContact O-N 3.3Å; I133-Q137 HydrophobicContact CG2-CG 4.19Å; I133-Q137 VanDerWaalsContact O-CB 3.3Å; I133-Q137 WeakPolarHBondContact O-CB 3.32Å; I133-Q137 VanDerWaalsContact O-CG 3.29Å; I133-Q137 WeakPolarHBondContact O-CG 3.44Å; I133-Q137 PolarHBondContact O-N 2.94Å |
| 134 | V | 58.9 | Low | 56.5 | Low | 91 Ų | 91 | 94.4 Ų | 94.4 | 55% | 0.552 | 52% | 0.524 | S | S | * | . | H | α-helix | trans | -59.6 | -43.2 | 176.7 | 172.5 | 0 | 0 | 0 | 0 | 110.8 | S130 S138 | S130-V134 WeakPolarHBondContact O-CB 3.29Å; S130-V134 VanDerWaalsContact O-CG2 3.27Å; S130-V134 WeakPolarHBondContact O-CG2 3.39Å; S130-V134 PolarHBondContact O-N 2.98Å; V134-S138 WeakPolarHBondContact O-CB 3.46Å; V134-S138 PolarHBondContact O-N 3.45Å; V134-S138 PolarHBondContact O-OG 3.11Å |
| 135 | S | 57.8 | Low | 54.7 | Low | 60 Ų | 60 | 102.6 Ų | 102.6 | 42% | 0.42 | 56% | 0.555 | S | S | . | * | H | α-helix | trans | -70.6 | -29.8 | 176.8 | 60.3 | 0 | 0 | 0 | 0 | 114.5 | Q131 R132 I133 S138 L139 | Q131-S135 WeakPolarHBondContact O-CB 3.34Å; Q131-S135 PolarHBondContact O-N 3.28Å; Q131-S135 PolarHBondContact O-OG 3.29Å; R132-S135 VanDerWaalsContact CA-OG 3.26Å; R132-S135 WeakPolarHBondContact CA-OG 3.31Å; R132-S135 PolarHBondContact O-N 3.41Å; R132-S135 PolarHBondContact O-OG 3.24Å; I133-S135 VanDerWaalsContact C-N 3.31Å; I133-S135 PolarHBondContact O-N 3.31Å; S135-S138 WeakPolarHBondContact CA-OG 3.44Å; S135-S138 PolarHBondContact O-OG 2.96Å; S135-L139 PolarHBondContact O-N 2.93Å |
| 136 | A | 53.9 | Low | 54 | Low | 60 Ų | 60 | 102.9 Ų | 102.9 | 50% | 0.496 | 56% | 0.562 | S | S | . | * | H | α-helix | trans | -78.9 | -34.6 | 177.3 | 0 | 0 | 0 | 0 | 0 | 111.3 | R132 I133 L139 A140 | R132-A136 WeakPolarHBondContact O-CB 3.23Å; R132-A136 PolarHBondContact O-N 3.39Å; I133-A136 PolarHBondContact O-N 3.3Å; A136-L139 PolarHBondContact O-N 2.96Å; A136-A140 PolarHBondContact O-N 3.39Å |
| 137 | Q | 52.2 | Low | 53.2 | Low | 116 Ų | 116 | 106.8 Ų | 106.8 | 54% | 0.542 | 58% | 0.584 | S | S | . | * | H | α-helix | trans | -69 | -41.8 | 173 | -75.1 | 177.5 | -20.5 | 0 | 0 | 111 | I133 L139 A140 | I133-Q137 HydrophobicContact CG2-CG 4.19Å; I133-Q137 VanDerWaalsContact O-CB 3.3Å; I133-Q137 WeakPolarHBondContact O-CB 3.32Å; I133-Q137 VanDerWaalsContact O-CG 3.29Å; I133-Q137 WeakPolarHBondContact O-CG 3.44Å; I133-Q137 PolarHBondContact O-N 2.94Å; Q137-L139 PolarHBondContact O-N 3.36Å; Q137-A140 PolarHBondContact O-N 3.48Å |
| 138 | S | 50.5 | Low | 52.6 | Low | 65 Ų | 65 | 108.7 Ų | 108.7 | 46% | 0.455 | 59% | 0.589 | S | S | . | * | H | α-helix | trans | -63.2 | -26.6 | 176.3 | 65 | 0 | 0 | 0 | 0 | 113.6 | V134 S135 | V134-S138 WeakPolarHBondContact O-CB 3.46Å; V134-S138 PolarHBondContact O-N 3.45Å; V134-S138 PolarHBondContact O-OG 3.11Å; S135-S138 WeakPolarHBondContact CA-OG 3.44Å; S135-S138 PolarHBondContact O-OG 2.96Å |
| 139 | L | 48.5 | Very low | 51.9 | Low | 133 Ų | 133 | 110.9 Ų | 110.9 | 70% | 0.696 | 60% | 0.599 | S | S | * | * | H | α-helix | trans | -81.2 | -18.4 | 175.6 | -78.9 | 167 | 0 | 0 | 0 | 113.4 | S135 A136 Q137 | S135-L139 PolarHBondContact O-N 2.93Å; A136-L139 PolarHBondContact O-N 2.96Å; Q137-L139 PolarHBondContact O-N 3.36Å |
| 140 | A | 48.5 | Very low | 51.2 | Low | 71 Ų | 71 | 116.7 Ų | 116.7 | 59% | 0.587 | 63% | 0.63 | S | S | * | * | H | α-helix | trans | -86.9 | -12.4 | 179.8 | 0 | 0 | 0 | 0 | 0 | 113 | A136 Q137 | A136-A140 PolarHBondContact O-N 3.39Å; Q137-A140 PolarHBondContact O-N 3.48Å |
| 141 | E | 46.1 | Very low | 50.7 | Low | 161 Ų | 161 | 120.1 Ų | 120.1 | 75% | 0.752 | 64% | 0.642 | S | S | * | * | S | Bend | trans | -92 | -15.5 | -179.9 | -64.2 | -168.4 | 133.8 | 0 | 0 | 113.7 | ||
| 142 | D | 40.8 | Very low | 50.1 | Low | 143 Ų | 143 | 118.5 Ų | 118.5 | 77% | 0.765 | 64% | 0.64 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -90 | -2.1 | -178.6 | -90.5 | -42.5 | 0 | 0 | 0 | 114.8 | ||
| 143 | D | 40.7 | Very low | 49.4 | Very low | 153 Ų | 153 | 114.6 Ų | 114.6 | 82% | 0.818 | 64% | 0.64 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -101.8 | 21.2 | 177.7 | -137.3 | -84.6 | 0 | 0 | 0 | 112.2 | ||
| 144 | V | 46.8 | Very low | 48.5 | Very low | 130 Ų | 130 | 120.7 Ų | 120.7 | 79% | 0.788 | 68% | 0.676 | S | S | * | * | trans | -133.4 | 62.2 | 172.2 | -169.3 | 0 | 0 | 0 | 0 | 109.5 | ||||
| 145 | E | 37.6 | Very low | 47.6 | Very low | 265 Ų | 265 | 123.4 Ų | 123.4 | 100% | 1.238 | 69% | 0.687 | S | S | * | * | trans | -137.3 | 0 | 155.5 | -151.3 | -178.4 | 153.3 | 0 | 0 | 111.2 |
Retrieved 145 of 145 residues in 69.7 ms
(Link to these results)