| 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 | 44.2 | Very low | 48.1 | Very low | 242 Ų | 242 | 163.4 Ų | 163.4 | 100% | 1.192 | 88% | 0.881 | S | S | * | * | 0 | 140.8 | 0 | -88.2 | -179.9 | 161.8 | 0 | 0 | 108.2 | |||||
| 2 | L | 52.6 | Low | 48 | Very low | 174 Ų | 174 | 156.2 Ų | 156.2 | 91% | 0.911 | 87% | 0.874 | S | S | * | * | trans | 84.1 | 80.8 | -176.9 | -52.8 | 175.6 | 0 | 0 | 0 | 116 | ||||
| 3 | S | 41.9 | Very low | 48.6 | Very low | 124 Ų | 124 | 158.4 Ų | 158.4 | 87% | 0.867 | 87% | 0.868 | S | S | * | * | trans | -69.3 | 137.1 | 155.6 | -61 | 0 | 0 | 0 | 0 | 110 | ||||
| 4 | V | 54.4 | Low | 49.3 | Very low | 141 Ų | 141 | 155.6 Ų | 155.6 | 86% | 0.855 | 85% | 0.852 | S | S | * | * | trans | -121.8 | 120.9 | 159.7 | -85.3 | 0 | 0 | 0 | 0 | 109.4 | ||||
| 5 | N | 52.4 | Low | 49.8 | Very low | 164 Ų | 164 | 151.8 Ų | 151.8 | 88% | 0.877 | 84% | 0.841 | S | S | * | * | trans | -75.6 | 125.7 | -168.8 | -163.3 | 9.1 | 0 | 0 | 0 | 110.2 | G7 | N5-G7 PolarHBondContact O-N 3.46Š| ||
| 6 | V | 50.6 | Low | 50.3 | Low | 129 Ų | 129 | 147 Ų | 147 | 78% | 0.782 | 83% | 0.827 | S | S | * | * | trans | -74.2 | 114.2 | 175.6 | 177.3 | 0 | 0 | 0 | 0 | 108.1 | S8 | V6-S8 PolarHBondContact O-N 3.2Š| ||
| 7 | G | 46.3 | Very low | 50.9 | Low | 81 Ų | 81 | 147.2 Ų | 147.2 | 84% | 0.835 | 82% | 0.817 | S | S | * | * | trans | -61.1 | 97.6 | 176.1 | 0 | 0 | 0 | 0 | 0 | 112 | N5 | N5-G7 PolarHBondContact O-N 3.46Š| ||
| 8 | S | 42.3 | Very low | 51.6 | Low | 113 Ų | 113 | 143.1 Ų | 143.1 | 79% | 0.79 | 80% | 0.8 | S | S | * | * | trans | -91.4 | 100.4 | 158.9 | -178.7 | 0 | 0 | 0 | 0 | 107.8 | V6 | V6-S8 PolarHBondContact O-N 3.2Š| ||
| 9 | L | 48.5 | Very low | 52.6 | Low | 143 Ų | 143 | 139.5 Ų | 139.5 | 75% | 0.749 | 79% | 0.786 | S | S | * | * | trans | -162.5 | 131.3 | 157.3 | -141.3 | 65 | 0 | 0 | 0 | 112.5 | ||||
| 10 | R | 47.7 | Very low | 53.7 | Low | 230 Ų | 230 | 135.5 Ų | 135.5 | 87% | 0.868 | 77% | 0.767 | S | S | * | * | trans | 83.7 | 74.7 | 160.1 | -45.2 | -167.7 | -171.1 | -173.1 | 3.4 | 116.8 | ||||
| 11 | R | 48.2 | Very low | 55 | Low | 256 Ų | 256 | 132.3 Ų | 132.3 | 97% | 0.966 | 75% | 0.75 | S | S | * | * | trans | -125.7 | 97.1 | 151.2 | -136.1 | -175.7 | -84.6 | -141.3 | -0.8 | 107 | ||||
| 12 | G | 47.3 | Very low | 57.3 | Low | 77 Ų | 77 | 123.3 Ų | 123.3 | 79% | 0.794 | 72% | 0.715 | S | S | * | * | S | Bend | trans | 149.3 | 61.3 | 176.3 | 0 | 0 | 0 | 0 | 0 | 116.9 | ||
| 13 | K | 55.3 | Low | 59.2 | Low | 185 Ų | 185 | 123 Ų | 123 | 80% | 0.804 | 70% | 0.701 | S | S | * | * | S | Bend | trans | -158.2 | 17 | 156.3 | -152.1 | 161 | 175.5 | 171 | 0 | 115.5 | ||
| 14 | D | 58.5 | Low | 61.7 | Low | 119 Ų | 119 | 122.2 Ų | 122.2 | 64% | 0.636 | 68% | 0.684 | S | S | * | * | trans | -110.1 | -8.6 | -169.7 | -58.3 | -43.3 | 0 | 0 | 0 | 115.1 | A16 K17 S18 | D14-A16 PolarHBondContact O-N 3.41Å; D14-K17 PolarHBondContact O-N 3.19Å; D14-S18 PolarHBondContact O-N 2.98Å | ||
| 15 | S | 57.4 | Low | 63.7 | Low | 99 Ų | 99 | 121.4 Ų | 121.4 | 69% | 0.692 | 67% | 0.671 | S | S | * | * | H | α-helix | trans | -71.6 | -30.1 | -173.8 | 54.9 | 0 | 0 | 0 | 0 | 114.9 | S18 | S15-S18 PolarHBondContact O-OG 2.87Å |
| 16 | A | 56.9 | Low | 65.7 | Low | 75 Ų | 75 | 119.2 Ų | 119.2 | 62% | 0.62 | 65% | 0.654 | S | S | * | * | H | α-helix | trans | -76.5 | -29 | 178.2 | 0 | 0 | 0 | 0 | 0 | 112.6 | D14 S19 | D14-A16 PolarHBondContact O-N 3.41Å; A16-S19 PolarHBondContact O-OG 3.29Å; A16-S19 VanDerWaalsContact O-OG 3.07Å |
| 17 | K | 60 | Low | 67.9 | Low | 151 Ų | 151 | 115 Ų | 115 | 66% | 0.657 | 63% | 0.63 | S | S | * | * | H | α-helix | trans | -73 | -37.9 | 176.4 | -70.2 | -177.8 | 177.7 | -179.1 | 0 | 111.2 | D14 S19 S20 V21 | D14-K17 PolarHBondContact O-N 3.19Å; K17-S19 VanDerWaalsContact C-N 3.3Å; K17-S19 PolarHBondContact O-N 3.23Å; K17-S20 PolarHBondContact O-N 3.41Å; K17-V21 VanDerWaalsContact O-CG2 3.3Å; K17-V21 WeakPolarHBondContact O-CG2 3.43Å; K17-V21 PolarHBondContact O-N 3.35Å; K17-V21 VanDerWaalsContact O-N 3.13Å |
| 18 | S | 63.6 | Low | 70.3 | Confident | 73 Ų | 73 | 115.6 Ų | 115.6 | 51% | 0.51 | 61% | 0.614 | S | S | . | * | H | α-helix | trans | -64.1 | -32.9 | -179.6 | 60.1 | 0 | 0 | 0 | 0 | 113.2 | D14 S15 A22 | D14-S18 PolarHBondContact O-N 2.98Å; S15-S18 PolarHBondContact O-OG 2.87Å; S18-A22 WeakPolarHBondContact O-CB 3.45Å; S18-A22 PolarHBondContact O-N 3.05Å |
| 19 | S | 71.4 | Confident | 73 | Confident | 75 Ų | 75 | 114 Ų | 114 | 52% | 0.524 | 60% | 0.602 | S | S | . | * | H | α-helix | trans | -73.6 | -36.9 | 178.4 | 58.7 | 0 | 0 | 0 | 0 | 113.1 | A16 K17 A22 W23 | A16-S19 PolarHBondContact O-OG 3.29Å; A16-S19 VanDerWaalsContact O-OG 3.07Å; K17-S19 VanDerWaalsContact C-N 3.3Å; K17-S19 PolarHBondContact O-N 3.23Å; S19-A22 PolarHBondContact O-N 3.35Å; S19-W23 PolarHBondContact O-N 3.3Å |
| 20 | S | 75.2 | Confident | 75.3 | Confident | 58 Ų | 58 | 110 Ų | 110 | 41% | 0.406 | 59% | 0.586 | S | S | . | * | H | α-helix | trans | -64.8 | -46.3 | 175.5 | -161.3 | 0 | 0 | 0 | 0 | 110.4 | K17 A22 W23 E24 | K17-S20 PolarHBondContact O-N 3.41Å; S20-A22 VanDerWaalsContact C-N 3.32Å; S20-A22 PolarHBondContact O-N 2.93Å; S20-W23 PolarHBondContact O-N 3.18Å; S20-E24 WeakPolarHBondContact O-CG 3.35Å; S20-E24 PolarHBondContact O-N 2.92Å; S20-E24 PolarHBondContact OG-OE1 3.04Å; S20-E24 VanDerWaalsContact OG-OE1 3.08Å |
| 21 | V | 80.6 | Confident | 77.6 | Confident | 70 Ų | 70 | 101.8 Ų | 101.8 | 42% | 0.424 | 57% | 0.567 | S | S | . | * | H | α-helix | trans | -59.5 | -43.7 | 177 | 174.7 | 0 | 0 | 0 | 0 | 110.8 | K17 W23 E24 E25 | K17-V21 VanDerWaalsContact O-CG2 3.3Å; K17-V21 WeakPolarHBondContact O-CG2 3.43Å; K17-V21 PolarHBondContact O-N 3.35Å; K17-V21 VanDerWaalsContact O-N 3.13Å; V21-W23 PolarHBondContact O-N 3.37Å; V21-E24 PolarHBondContact O-N 3.03Å; V21-E25 HydrophobicContact CG1-CG 4.28Å; V21-E25 WeakPolarHBondContact CG1-OE1 3.34Å; V21-E25 WeakPolarHBondContact O-CB 3.46Å; V21-E25 VanDerWaalsContact O-CG 3.27Å; V21-E25 WeakPolarHBondContact O-CG 3.39Å; V21-E25 PolarHBondContact O-N 3.39Å |
| 22 | A | 91.3 | Very high | 80 | Confident | 53 Ų | 53 | 96.9 Ų | 96.9 | 44% | 0.438 | 55% | 0.553 | S | S | . | * | H | α-helix | trans | -64.6 | -35.9 | 177.8 | 0 | 0 | 0 | 0 | 0 | 113.5 | S18 S19 S20 F26 | S18-A22 WeakPolarHBondContact O-CB 3.45Å; S18-A22 PolarHBondContact O-N 3.05Å; S19-A22 PolarHBondContact O-N 3.35Å; S20-A22 VanDerWaalsContact C-N 3.32Å; S20-A22 PolarHBondContact O-N 2.93Å; A22-F26 WeakPolarHBondContact O-CB 3.05Å; A22-F26 PolarHBondContact O-N 2.85Å |
| 23 | W | 93.6 | Very high | 82.4 | Confident | 167 Ų | 167 | 100.1 Ų | 100.1 | 63% | 0.633 | 55% | 0.545 | S | S | * | . | H | α-helix | trans | -69 | -44.6 | 176.5 | 170.6 | -111.6 | 0 | 0 | 0 | 111.8 | S19 S20 V21 F26 C27 | S19-W23 PolarHBondContact O-N 3.3Å; S20-W23 PolarHBondContact O-N 3.18Å; V21-W23 PolarHBondContact O-N 3.37Å; W23-F26 AromaticContact CE3-CD1 3.84Å; W23-F26 HydrophobicContact CE3-CD1 3.84Å; W23-F26 HydrophobicContact CE3-CE1 4.46Å; W23-F26 HydrophobicContact CH2-CD1 4.4Å; W23-F26 HydrophobicContact CH2-CE1 4.38Å; W23-F26 AromaticContact CZ3-CD1 3.58Å; W23-F26 HydrophobicContact CZ3-CD1 3.58Å; W23-F26 AromaticContact CZ3-CE1 3.76Å; W23-F26 HydrophobicContact CZ3-CE1 3.76Å; W23-F26 PolarHBondContact O-N 2.95Å; W23-C27 WeakPolarHBondContact CZ2-SG 3.45Å; W23-C27 PolarHBondContact O-N 2.94Å; W23-C27 PolarHBondContact O-SG 3.22Å |
| 24 | E | 94.5 | Very high | 84.4 | Confident | 107 Ų | 107 | 92.5 Ų | 92.5 | 50% | 0.5 | 52% | 0.517 | S | S | . | . | H | α-helix | trans | -62.8 | -46.4 | 176.5 | -71.4 | 166.9 | -145.9 | 0 | 0 | 111.2 | S20 V21 F26 C27 D28 | S20-E24 WeakPolarHBondContact O-CG 3.35Å; S20-E24 PolarHBondContact O-N 2.92Å; S20-E24 PolarHBondContact OG-OE1 3.04Å; S20-E24 VanDerWaalsContact OG-OE1 3.08Å; V21-E24 PolarHBondContact O-N 3.03Å; E24-F26 VanDerWaalsContact C-N 3.32Å; E24-F26 PolarHBondContact O-N 2.99Å; E24-C27 PolarHBondContact O-N 2.91Å; E24-C27 VanDerWaalsContact O-N 3.16Å; E24-D28 WeakPolarHBondContact O-CB 3.27Å; E24-D28 PolarHBondContact O-N 2.94Å |
| 25 | E | 95.9 | Very high | 86.3 | Confident | 125 Ų | 125 | 89.5 Ų | 89.5 | 58% | 0.584 | 51% | 0.508 | S | S | * | . | H | α-helix | trans | -60.5 | -39.4 | 175.9 | -74.9 | 177 | -178.8 | 0 | 0 | 112.7 | V21 S29 | V21-E25 HydrophobicContact CG1-CG 4.28Å; V21-E25 WeakPolarHBondContact CG1-OE1 3.34Å; V21-E25 WeakPolarHBondContact O-CB 3.46Å; V21-E25 VanDerWaalsContact O-CG 3.27Å; V21-E25 WeakPolarHBondContact O-CG 3.39Å; V21-E25 PolarHBondContact O-N 3.39Å; E25-S29 WeakPolarHBondContact O-CB 3.41Å; E25-S29 PolarHBondContact O-N 3.34Å |
| 26 | F | 95.4 | Very high | 88.3 | Confident | 117 Ų | 117 | 92 Ų | 92 | 51% | 0.513 | 50% | 0.504 | S | S | . | . | H | α-helix | trans | -61.9 | -48.8 | 173.8 | 168.2 | -100.7 | 0 | 0 | 0 | 111.1 | A22 W23 E24 D28 S29 C30 | A22-F26 WeakPolarHBondContact O-CB 3.05Å; A22-F26 PolarHBondContact O-N 2.85Å; W23-F26 AromaticContact CE3-CD1 3.84Å; W23-F26 HydrophobicContact CE3-CD1 3.84Å; W23-F26 HydrophobicContact CE3-CE1 4.46Å; W23-F26 HydrophobicContact CH2-CD1 4.4Å; W23-F26 HydrophobicContact CH2-CE1 4.38Å; W23-F26 AromaticContact CZ3-CD1 3.58Å; W23-F26 HydrophobicContact CZ3-CD1 3.58Å; W23-F26 AromaticContact CZ3-CE1 3.76Å; W23-F26 HydrophobicContact CZ3-CE1 3.76Å; W23-F26 PolarHBondContact O-N 2.95Å; E24-F26 VanDerWaalsContact C-N 3.32Å; E24-F26 PolarHBondContact O-N 2.99Å; F26-D28 VanDerWaalsContact C-N 3.35Å; F26-D28 PolarHBondContact O-N 3.18Å; F26-S29 PolarHBondContact O-N 2.95Å; F26-C30 PolarHBondContact O-N 3.49Å; F26-C30 PolarHBondContact O-SG 3.1Å |
| 27 | C | 96.9 | Very high | 90.2 | Very high | 42 Ų | 42 | 92.8 Ų | 92.8 | 28% | 0.284 | 50% | 0.497 | S | S | . | . | H | α-helix | trans | -61 | -44.6 | 178.4 | -67.4 | 0 | 0 | 0 | 0 | 111.4 | W23 E24 S29 C30 A31 | W23-C27 WeakPolarHBondContact CZ2-SG 3.45Å; W23-C27 PolarHBondContact O-N 2.94Å; W23-C27 PolarHBondContact O-SG 3.22Å; E24-C27 PolarHBondContact O-N 2.91Å; E24-C27 VanDerWaalsContact O-N 3.16Å; C27-S29 PolarHBondContact O-N 3.49Å; C27-C30 PolarHBondContact O-N 3.22Å; C27-A31 VanDerWaalsContact O-CB 3.29Å; C27-A31 WeakPolarHBondContact O-CB 3.09Å; C27-A31 PolarHBondContact O-N 3.26Å |
| 28 | D | 96.7 | Very high | 92 | Very high | 93 Ų | 93 | 88.2 Ų | 88.2 | 50% | 0.497 | 48% | 0.478 | S | S | . | . | H | α-helix | trans | -61.3 | -42.1 | 177.2 | -83.6 | -1.3 | 0 | 0 | 0 | 112.2 | E24 F26 A31 K32 | E24-D28 WeakPolarHBondContact O-CB 3.27Å; E24-D28 PolarHBondContact O-N 2.94Å; F26-D28 VanDerWaalsContact C-N 3.35Å; F26-D28 PolarHBondContact O-N 3.18Å; D28-A31 PolarHBondContact O-N 3.07Å; D28-K32 WeakPolarHBondContact O-CB 3.39Å; D28-K32 VanDerWaalsContact O-CG 3.24Å; D28-K32 WeakPolarHBondContact O-CG 3.44Å; D28-K32 PolarHBondContact O-N 3.48Å |
| 29 | S | 97.3 | Very high | 93.7 | Very high | 79 Ų | 79 | 87.2 Ų | 87.2 | 55% | 0.552 | 47% | 0.474 | S | S | * | . | H | α-helix | trans | -63.5 | -45.2 | 177.1 | -173.8 | 0 | 0 | 0 | 0 | 111.4 | E25 F26 C27 K32 F33 | E25-S29 WeakPolarHBondContact O-CB 3.41Å; E25-S29 PolarHBondContact O-N 3.34Å; F26-S29 PolarHBondContact O-N 2.95Å; C27-S29 PolarHBondContact O-N 3.49Å; S29-K32 PolarHBondContact O-N 2.82Å; S29-F33 PolarHBondContact O-N 3.08Å; S29-F33 VanDerWaalsContact O-N 3.1Å |
| 30 | C | 97.1 | Very high | 94.9 | Very high | 60 Ų | 60 | 87.9 Ų | 87.9 | 41% | 0.405 | 47% | 0.469 | S | S | . | . | H | α-helix | trans | -64.2 | -42.8 | 175.5 | -71.1 | 0 | 0 | 0 | 0 | 112.3 | F26 C27 F33 A34 | F26-C30 PolarHBondContact O-N 3.49Å; F26-C30 PolarHBondContact O-SG 3.1Å; C27-C30 PolarHBondContact O-N 3.22Å; C30-F33 PolarHBondContact O-N 3.06Å; C30-A34 WeakPolarHBondContact O-CB 3.44Å; C30-A34 PolarHBondContact O-N 3.45Å |
| 31 | A | 97.4 | Very high | 96 | Very high | 57 Ų | 57 | 88 Ų | 88 | 47% | 0.471 | 47% | 0.47 | S | S | . | . | H | α-helix | trans | -63.2 | -42.9 | 178.2 | 0 | 0 | 0 | 0 | 0 | 111.5 | C27 D28 F33 A34 A35 | C27-A31 VanDerWaalsContact O-CB 3.29Å; C27-A31 WeakPolarHBondContact O-CB 3.09Å; C27-A31 PolarHBondContact O-N 3.26Å; D28-A31 PolarHBondContact O-N 3.07Å; A31-F33 VanDerWaalsContact C-N 3.34Å; A31-F33 PolarHBondContact O-N 3.39Å; A31-A34 PolarHBondContact O-N 2.95Å; A31-A35 VanDerWaalsContact O-CB 3.27Å; A31-A35 WeakPolarHBondContact O-CB 3.27Å; A31-A35 PolarHBondContact O-N 2.98Å |
| 32 | K | 98 | Very high | 96.7 | Very high | 152 Ų | 152 | 87.1 Ų | 87.1 | 66% | 0.661 | 46% | 0.459 | S | S | * | . | H | α-helix | trans | -59.4 | -44.1 | 174.3 | -76.8 | 168.8 | -175.9 | 165.4 | 0 | 112 | D28 S29 Y36 | D28-K32 WeakPolarHBondContact O-CB 3.39Å; D28-K32 VanDerWaalsContact O-CG 3.24Å; D28-K32 WeakPolarHBondContact O-CG 3.44Å; D28-K32 PolarHBondContact O-N 3.48Å; S29-K32 PolarHBondContact O-N 2.82Å; K32-Y36 WeakPolarHBondContact O-CB 3.46Å; K32-Y36 PolarHBondContact O-N 3.34Å |
| 33 | F | 98 | Very high | 96.9 | Very high | 146 Ų | 146 | 90.1 Ų | 90.1 | 64% | 0.64 | 46% | 0.464 | S | S | * | . | H | α-helix | trans | -65.3 | -47.6 | 178 | -177.3 | -96.6 | 0 | 0 | 0 | 111.8 | S29 C30 A31 A35 Y36 D37 | S29-F33 PolarHBondContact O-N 3.08Å; S29-F33 VanDerWaalsContact O-N 3.1Å; C30-F33 PolarHBondContact O-N 3.06Å; A31-F33 VanDerWaalsContact C-N 3.34Å; A31-F33 PolarHBondContact O-N 3.39Å; F33-A35 VanDerWaalsContact C-N 3.34Å; F33-A35 PolarHBondContact O-N 3.43Å; F33-Y36 PolarHBondContact O-N 3.27Å; F33-D37 WeakPolarHBondContact O-CB 3.25Å; F33-D37 PolarHBondContact O-N 2.94Å |
| 34 | A | 97.6 | Very high | 97.1 | Very high | 24 Ų | 24 | 86.4 Ų | 86.4 | 20% | 0.198 | 46% | 0.456 | C | S | . | . | H | α-helix | trans | -62.1 | -40.1 | 178.2 | 0 | 0 | 0 | 0 | 0 | 112.4 | C30 A31 D37 F38 | C30-A34 WeakPolarHBondContact O-CB 3.44Å; C30-A34 PolarHBondContact O-N 3.45Å; A31-A34 PolarHBondContact O-N 2.95Å; A34-D37 PolarHBondContact O-N 3.44Å; A34-F38 VanDerWaalsContact O-CB 3.27Å; A34-F38 WeakPolarHBondContact O-CB 3.27Å; A34-F38 PolarHBondContact O-N 3.44Å |
| 35 | A | 98 | Very high | 97.2 | Very high | 56 Ų | 56 | 86.5 Ų | 86.5 | 46% | 0.463 | 45% | 0.453 | S | S | . | . | H | α-helix | trans | -64.5 | -42.5 | 176.1 | 0 | 0 | 0 | 0 | 0 | 112 | A31 F33 A39 | A31-A35 VanDerWaalsContact O-CB 3.27Å; A31-A35 WeakPolarHBondContact O-CB 3.27Å; A31-A35 PolarHBondContact O-N 2.98Å; F33-A35 VanDerWaalsContact C-N 3.34Å; F33-A35 PolarHBondContact O-N 3.43Å; A35-A39 VanDerWaalsContact O-CB 3.25Å; A35-A39 WeakPolarHBondContact O-CB 3.49Å; A35-A39 PolarHBondContact O-N 3.5Å |
| 36 | Y | 98.3 | Very high | 97.2 | Very high | 152 Ų | 152 | 82 Ų | 82 | 60% | 0.596 | 43% | 0.433 | S | S | * | . | H | α-helix | trans | -62.8 | -48.1 | 176.3 | 176.6 | -95.5 | 0 | 0 | 0 | 111.9 | K32 F33 A39 Q40 | K32-Y36 WeakPolarHBondContact O-CB 3.46Å; K32-Y36 PolarHBondContact O-N 3.34Å; F33-Y36 PolarHBondContact O-N 3.27Å; Y36-A39 PolarHBondContact O-N 3.05Å; Y36-Q40 HydrophobicContact CE1-CG 4.09Å; Y36-Q40 HydrophobicContact CE2-CG 4.44Å; Y36-Q40 WeakPolarHBondContact O-CG 3.29Å; Y36-Q40 PolarHBondContact O-N 3.07Å; Y36-Q40 VanDerWaalsContact O-N 3.07Å |
| 37 | D | 98 | Very high | 97.2 | Very high | 91 Ų | 91 | 80 Ų | 80 | 49% | 0.487 | 44% | 0.438 | S | S | . | . | H | α-helix | trans | -62.5 | -43.6 | 179.9 | -172.8 | 63.6 | 0 | 0 | 0 | 112.1 | F33 A34 Q40 S41 | F33-D37 WeakPolarHBondContact O-CB 3.25Å; F33-D37 PolarHBondContact O-N 2.94Å; A34-D37 PolarHBondContact O-N 3.44Å; D37-Q40 PolarHBondContact O-N 2.87Å; D37-S41 PolarHBondContact O-N 3.04Å; D37-S41 PolarHBondContact O-OG 3.42Å; D37-S41 VanDerWaalsContact O-OG 3.08Å |
| 38 | F | 97.9 | Very high | 97.2 | Very high | 55 Ų | 55 | 85.4 Ų | 85.4 | 24% | 0.241 | 46% | 0.459 | C | S | . | . | H | α-helix | trans | -66.4 | -40.7 | 176.6 | -177.9 | -118 | 0 | 0 | 0 | 112.3 | A34 Q40 S41 W42 V61 F65 | A34-F38 VanDerWaalsContact O-CB 3.27Å; A34-F38 WeakPolarHBondContact O-CB 3.27Å; A34-F38 PolarHBondContact O-N 3.44Å; F38-Q40 VanDerWaalsContact C-N 3.33Å; F38-Q40 PolarHBondContact O-N 3.21Å; F38-S41 PolarHBondContact O-N 3.2Å; F38-W42 WeakPolarHBondContact O-CB 3.47Å; F38-W42 PolarHBondContact O-N 3.46Å; F38-V61 HydrophobicContact CE1-CG1 3.72Å; F38-V61 HydrophobicContact CZ-CG1 3.56Å; F38-F65 HydrophobicContact CB-CD2 4.29Å; F38-F65 HydrophobicContact CB-CE1 4.43Å; F38-F65 HydrophobicContact CB-CE2 3.91Å; F38-F65 HydrophobicContact CB-CZ 3.99Å; F38-F65 HydrophobicContact CD1-CB 4.01Å; F38-F65 HydrophobicContact CD1-CD1 4.01Å; F38-F65 AromaticContact CD1-CD2 3.83Å; F38-F65 HydrophobicContact CD1-CD2 3.83Å; F38-F65 HydrophobicContact CD1-CE1 4.46Å; F38-F65 HydrophobicContact CD1-CE2 4.29Å; F38-F65 AromaticContact CD1-CG 3.66Å; F38-F65 HydrophobicContact CD1-CG 3.66Å; F38-F65 AromaticContact CD2-CD2 3.35Å; F38-F65 HydrophobicContact CD2-CD2 3.35Å; F38-F65 AromaticContact CD2-CE2 3.6Å; F38-F65 HydrophobicContact CD2-CE2 3.6Å; F38-F65 HydrophobicContact CD2-CG 4.06Å; F38-F65 HydrophobicContact CD2-CZ 4.48Å; F38-F65 HydrophobicContact CE1-CB 3.45Å; F38-F65 VanDerWaalsContact CE1-CB 3.45Å; F38-F65 HydrophobicContact CE1-CD1 4.32Å; F38-F65 AromaticContact CE1-CD2 3.94Å; F38-F65 HydrophobicContact CE1-CD2 3.94Å; F38-F65 AromaticContact CE1-CG 3.64Å; F38-F65 HydrophobicContact CE1-CG 3.64Å; F38-F65 HydrophobicContact CE2-CB 4.15Å; F38-F65 AromaticContact CE2-CD2 3.49Å; F38-F65 HydrophobicContact CE2-CD2 3.49Å; F38-F65 VanDerWaalsContact CE2-CD2 3.49Å; F38-F65 HydrophobicContact CE2-CE2 4.21Å; F38-F65 HydrophobicContact CE2-CG 4.05Å; F38-F65 HydrophobicContact CG-CD1 4.3Å; F38-F65 AromaticContact CG-CD2 3.53Å; F38-F65 HydrophobicContact CG-CD2 3.53Å; F38-F65 HydrophobicContact CG-CE1 4.41Å; F38-F65 AromaticContact CG-CE2 3.66Å; F38-F65 HydrophobicContact CG-CE2 3.66Å; F38-F65 AromaticContact CG-CG 3.87Å; F38-F65 HydrophobicContact CG-CG 3.87Å; F38-F65 HydrophobicContact CG-CZ 4.11Å; F38-F65 HydrophobicContact CZ-CB 3.54Å; F38-F65 AromaticContact CZ-CD2 3.8Å; F38-F65 HydrophobicContact CZ-CD2 3.8Å; F38-F65 AromaticContact CZ-CG 3.86Å; F38-F65 HydrophobicContact CZ-CG 3.86Å |
| 39 | A | 97.6 | Very high | 97.1 | Very high | 53 Ų | 53 | 83.7 Ų | 83.7 | 44% | 0.438 | 45% | 0.45 | S | S | . | . | H | α-helix | trans | -62.9 | -38.3 | 176.8 | 0 | 0 | 0 | 0 | 0 | 112.5 | A35 Y36 W42 H43 | A35-A39 VanDerWaalsContact O-CB 3.25Å; A35-A39 WeakPolarHBondContact O-CB 3.49Å; A35-A39 PolarHBondContact O-N 3.5Å; Y36-A39 PolarHBondContact O-N 3.05Å; A39-W42 PolarHBondContact O-N 3.41Å; A39-H43 WeakPolarHBondContact O-CB 3.4Å; A39-H43 PolarHBondContact O-N 2.93Å |
| 40 | Q | 98 | Very high | 96.9 | Very high | 88 Ų | 88 | 83.9 Ų | 83.9 | 41% | 0.411 | 45% | 0.449 | S | S | . | . | H | α-helix | trans | -64.5 | -44.3 | 173.4 | -70.6 | -63.3 | -43.7 | 0 | 0 | 111.6 | Y36 D37 F38 W42 H43 N44 | Y36-Q40 HydrophobicContact CE1-CG 4.09Å; Y36-Q40 HydrophobicContact CE2-CG 4.44Å; Y36-Q40 WeakPolarHBondContact O-CG 3.29Å; Y36-Q40 PolarHBondContact O-N 3.07Å; Y36-Q40 VanDerWaalsContact O-N 3.07Å; D37-Q40 PolarHBondContact O-N 2.87Å; F38-Q40 VanDerWaalsContact C-N 3.33Å; F38-Q40 PolarHBondContact O-N 3.21Å; Q40-W42 VanDerWaalsContact C-N 3.35Å; Q40-W42 PolarHBondContact O-N 3.28Å; Q40-H43 PolarHBondContact O-N 3.5Å; Q40-N44 VanDerWaalsContact O-CG 3.28Å; Q40-N44 PolarHBondContact O-N 3.28Å; Q40-N44 PolarHBondContact O-ND2 2.94Å |
| 41 | S | 97.2 | Very high | 96.7 | Very high | 62 Ų | 62 | 85.8 Ų | 85.8 | 43% | 0.434 | 46% | 0.459 | S | S | . | . | H | α-helix | trans | -63.1 | -41 | 177 | -61.2 | 0 | 0 | 0 | 0 | 112 | D37 F38 N44 Y45 | D37-S41 PolarHBondContact O-N 3.04Å; D37-S41 PolarHBondContact O-OG 3.42Å; D37-S41 VanDerWaalsContact O-OG 3.08Å; F38-S41 PolarHBondContact O-N 3.2Å; S41-N44 PolarHBondContact O-N 2.9Å; S41-Y45 PolarHBondContact O-N 3.46Å |
| 42 | W | 95.9 | Very high | 96.5 | Very high | 50 Ų | 50 | 83.5 Ų | 83.5 | 19% | 0.189 | 44% | 0.44 | C | S | . | . | H | α-helix | trans | -63.1 | -44.9 | 174.6 | 173.6 | -120.1 | 0 | 0 | 0 | 112.2 | F38 A39 Q40 N44 Y45 L46 V61 | F38-W42 WeakPolarHBondContact O-CB 3.47Å; F38-W42 PolarHBondContact O-N 3.46Å; A39-W42 PolarHBondContact O-N 3.41Å; Q40-W42 VanDerWaalsContact C-N 3.35Å; Q40-W42 PolarHBondContact O-N 3.28Å; W42-N44 VanDerWaalsContact C-N 3.31Å; W42-N44 PolarHBondContact O-N 2.87Å; W42-Y45 AromaticContact CE3-CD1 3.63Å; W42-Y45 HydrophobicContact CE3-CD1 3.63Å; W42-Y45 HydrophobicContact CE3-CE1 4.33Å; W42-Y45 HydrophobicContact CE3-CG 4.31Å; W42-Y45 HydrophobicContact CH2-CD1 4.08Å; W42-Y45 HydrophobicContact CH2-CE1 4.13Å; W42-Y45 AromaticContact CZ3-CD1 3.25Å; W42-Y45 HydrophobicContact CZ3-CD1 3.25Å; W42-Y45 AromaticContact CZ3-CE1 3.51Å; W42-Y45 HydrophobicContact CZ3-CE1 3.51Å; W42-Y45 HydrophobicContact CZ3-CG 4.27Å; W42-Y45 WeakPolarHBondContact O-CB 3.49Å; W42-Y45 PolarHBondContact O-N 3.46Å; W42-L46 HydrophobicContact CD2-CD1 4.31Å; W42-L46 HydrophobicContact CD2-CG 4.1Å; W42-L46 HydrophobicContact CE3-CG 4.47Å; W42-L46 HydrophobicContact CH2-CD2 3.58Å; W42-L46 HydrophobicContact CH2-CG 4.11Å; W42-L46 HydrophobicContact CZ2-CD1 3.75Å; W42-L46 HydrophobicContact CZ2-CD2 3.45Å; W42-L46 VanDerWaalsContact CZ2-CD2 3.45Å; W42-L46 HydrophobicContact CZ2-CG 3.69Å; W42-L46 HydrophobicContact CZ3-CD2 4.23Å; W42-L46 HydrophobicContact CZ3-CG 4.48Å; W42-L46 PolarHBondContact O-N 3.1Å; W42-V61 HydrophobicContact CD2-CG1 4.02Å; W42-V61 HydrophobicContact CD2-CG2 4.43Å; W42-V61 HydrophobicContact CE3-CG1 4.04Å; W42-V61 HydrophobicContact CE3-CG2 4.44Å; W42-V61 HydrophobicContact CG-CG1 4.42Å; W42-V61 HydrophobicContact CH2-CG2 3.73Å; W42-V61 HydrophobicContact CZ2-CG2 3.69Å; W42-V61 HydrophobicContact CZ3-CG1 4.39Å; W42-V61 HydrophobicContact CZ3-CG2 4.1Å |
| 43 | H | 95.9 | Very high | 96.1 | Very high | 116 Ų | 116 | 80.5 Ų | 80.5 | 54% | 0.537 | 43% | 0.43 | S | S | . | . | H | α-helix | trans | -58.3 | -43.3 | 175.4 | 175.8 | -86.2 | 0 | 0 | 0 | 111.8 | A39 Q40 L46 A47 | A39-H43 WeakPolarHBondContact O-CB 3.4Å; A39-H43 PolarHBondContact O-N 2.93Å; Q40-H43 PolarHBondContact O-N 3.5Å; H43-L46 PolarHBondContact O-N 3.4Å; H43-A47 PolarHBondContact O-N 2.99Å |
| 44 | N | 96.9 | Very high | 95.6 | Very high | 89 Ų | 89 | 81 Ų | 81 | 48% | 0.476 | 44% | 0.44 | S | S | . | . | H | α-helix | trans | -65.3 | -41.5 | 176.2 | -65.3 | -21.1 | 0 | 0 | 0 | 111.8 | Q40 S41 W42 L46 A47 E48 | Q40-N44 VanDerWaalsContact O-CG 3.28Å; Q40-N44 PolarHBondContact O-N 3.28Å; Q40-N44 PolarHBondContact O-ND2 2.94Å; S41-N44 PolarHBondContact O-N 2.9Å; W42-N44 VanDerWaalsContact C-N 3.31Å; W42-N44 PolarHBondContact O-N 2.87Å; N44-L46 VanDerWaalsContact C-N 3.32Å; N44-L46 PolarHBondContact O-N 3.39Å; N44-A47 WeakPolarHBondContact O-CB 3.48Å; N44-A47 PolarHBondContact O-N 3.29Å; N44-E48 PolarHBondContact O-N 2.93Å |
| 45 | Y | 97 | Very high | 95.4 | Very high | 110 Ų | 110 | 87 Ų | 87 | 43% | 0.431 | 46% | 0.461 | S | S | . | . | H | α-helix | trans | -58.9 | -42 | 174.4 | 173.1 | -91.9 | 0 | 0 | 0 | 112.3 | S41 W42 E48 N49 A52 | S41-Y45 PolarHBondContact O-N 3.46Å; W42-Y45 AromaticContact CE3-CD1 3.63Å; W42-Y45 HydrophobicContact CE3-CD1 3.63Å; W42-Y45 HydrophobicContact CE3-CE1 4.33Å; W42-Y45 HydrophobicContact CE3-CG 4.31Å; W42-Y45 HydrophobicContact CH2-CD1 4.08Å; W42-Y45 HydrophobicContact CH2-CE1 4.13Å; W42-Y45 AromaticContact CZ3-CD1 3.25Å; W42-Y45 HydrophobicContact CZ3-CD1 3.25Å; W42-Y45 AromaticContact CZ3-CE1 3.51Å; W42-Y45 HydrophobicContact CZ3-CE1 3.51Å; W42-Y45 HydrophobicContact CZ3-CG 4.27Å; W42-Y45 WeakPolarHBondContact O-CB 3.49Å; W42-Y45 PolarHBondContact O-N 3.46Å; Y45-E48 PolarHBondContact O-N 3.45Å; Y45-N49 HydrophobicContact CE1-CB 4.15Å; Y45-N49 WeakPolarHBondContact CE2-ND2 3.35Å; Y45-N49 WeakPolarHBondContact O-CB 3.41Å; Y45-N49 PolarHBondContact O-N 2.91Å; Y45-N49 PolarHBondContact O-ND2 3.39Å; Y45-A52 HydrophobicContact CE1-CB 4.09Å |
| 46 | L | 96.3 | Very high | 95.1 | Very high | 30 Ų | 30 | 86.5 Ų | 86.5 | 16% | 0.157 | 45% | 0.452 | C | S | . | . | H | α-helix | trans | -66.8 | -35.5 | 176.6 | -73.6 | -177.7 | 0 | 0 | 0 | 112.9 | W42 H43 N44 E48 N49 P50 A52 I53 | W42-L46 HydrophobicContact CD2-CD1 4.31Å; W42-L46 HydrophobicContact CD2-CG 4.1Å; W42-L46 HydrophobicContact CE3-CG 4.47Å; W42-L46 HydrophobicContact CH2-CD2 3.58Å; W42-L46 HydrophobicContact CH2-CG 4.11Å; W42-L46 HydrophobicContact CZ2-CD1 3.75Å; W42-L46 HydrophobicContact CZ2-CD2 3.45Å; W42-L46 VanDerWaalsContact CZ2-CD2 3.45Å; W42-L46 HydrophobicContact CZ2-CG 3.69Å; W42-L46 HydrophobicContact CZ3-CD2 4.23Å; W42-L46 HydrophobicContact CZ3-CG 4.48Å; W42-L46 PolarHBondContact O-N 3.1Å; H43-L46 PolarHBondContact O-N 3.4Å; N44-L46 VanDerWaalsContact C-N 3.32Å; N44-L46 PolarHBondContact O-N 3.39Å; L46-E48 PolarHBondContact O-N 3.47Å; L46-N49 CarbonylContact O-C 3.18Å; L46-N49 PolarHBondContact O-N 3.27Å; L46-P50 WeakPolarHBondContact O-CA 3.36Å; L46-A52 HydrophobicContact CD2-CB 3.93Å; L46-I53 HydrophobicContact CB-CG1 4.21Å; L46-I53 HydrophobicContact CD1-CG1 4.29Å; L46-I53 HydrophobicContact CD2-CG1 3.85Å; L46-I53 HydrophobicContact CG-CG1 4.35Å |
| 47 | A | 95.7 | Very high | 94.9 | Very high | 76 Ų | 76 | 82.1 Ų | 82.1 | 63% | 0.628 | 44% | 0.444 | S | S | * | . | H | α-helix | trans | -62.6 | -34.7 | 174.7 | 0 | 0 | 0 | 0 | 0 | 111.9 | H43 N44 | H43-A47 PolarHBondContact O-N 2.99Å; N44-A47 WeakPolarHBondContact O-CB 3.48Å; N44-A47 PolarHBondContact O-N 3.29Å |
| 48 | E | 96.2 | Very high | 94.7 | Very high | 154 Ų | 154 | 84.9 Ų | 84.9 | 72% | 0.72 | 45% | 0.454 | S | S | * | . | H | α-helix | trans | -81.8 | -27.4 | 175 | -65.6 | 176.7 | -176.9 | 0 | 0 | 112.8 | N44 Y45 L46 P50 | N44-E48 PolarHBondContact O-N 2.93Å; Y45-E48 PolarHBondContact O-N 3.45Å; L46-E48 PolarHBondContact O-N 3.47Å; E48-P50 VanDerWaalsContact C-CD 3.49Å; E48-P50 WeakPolarHBondContact O-CD 3.24Å |
| 49 | N | 95.7 | Very high | 94.6 | Very high | 58 Ų | 58 | 90.1 Ų | 90.1 | 31% | 0.31 | 48% | 0.479 | S | S | . | . | trans | -126.7 | 67 | -174.9 | -60.3 | -86.3 | 0 | 0 | 0 | 111.3 | Y45 L46 T51 A52 | Y45-N49 HydrophobicContact CE1-CB 4.15Å; Y45-N49 WeakPolarHBondContact CE2-ND2 3.35Å; Y45-N49 WeakPolarHBondContact O-CB 3.41Å; Y45-N49 PolarHBondContact O-N 2.91Å; Y45-N49 PolarHBondContact O-ND2 3.39Å; L46-N49 CarbonylContact O-C 3.18Å; L46-N49 PolarHBondContact O-N 3.27Å; N49-T51 PolarHBondContact O-N 3.2Å; N49-A52 HydrophobicContact CB-CB 4.36Å; N49-A52 WeakPolarHBondContact O-CB 3.44Å; N49-A52 PolarHBondContact O-N 3.23Å | ||
| 50 | P | 92.7 | Very high | 94.5 | Very high | 82 Ų | 82 | 92.3 Ų | 92.3 | 53% | 0.532 | 48% | 0.48 | S | S | . | . | G | 310 helix | trans | -61.2 | -24.8 | -174.3 | 23.3 | -34.3 | 0 | 0 | 0 | 113 | L46 E48 A52 I53 | L46-P50 WeakPolarHBondContact O-CA 3.36Å; E48-P50 VanDerWaalsContact C-CD 3.49Å; E48-P50 WeakPolarHBondContact O-CD 3.24Å; P50-A52 PolarHBondContact O-N 3.22Å; P50-I53 HydrophobicContact CB-CD1 4.36Å; P50-I53 WeakPolarHBondContact O-CG1 3.47Å; P50-I53 PolarHBondContact O-N 3.4Å |
| 51 | T | 93.3 | Very high | 94.4 | Very high | 100 Ų | 100 | 88.9 Ų | 88.9 | 61% | 0.613 | 47% | 0.466 | S | S | * | . | G | 310 helix | trans | -67 | -13.5 | 176.2 | 72.7 | 0 | 0 | 0 | 0 | 113.8 | N49 K55 | N49-T51 PolarHBondContact O-N 3.2Å; T51-K55 WeakPolarHBondContact O-CD 3.27Å; T51-K55 WeakPolarHBondContact O-CE 3.15Å; T51-K55 VanDerWaalsContact O-CG 3.27Å; T51-K55 WeakPolarHBondContact O-CG 3.38Å |
| 52 | A | 91.7 | Very high | 94.4 | Very high | 9 Ų | 9 | 88.2 Ų | 88.2 | 7% | 0.074 | 46% | 0.463 | C | S | . | . | G | 310 helix | trans | -86.5 | -17.1 | 179.3 | 0 | 0 | 0 | 0 | 0 | 113.4 | Y45 L46 N49 P50 D54 K55 V56 | Y45-A52 HydrophobicContact CE1-CB 4.09Å; L46-A52 HydrophobicContact CD2-CB 3.93Å; N49-A52 HydrophobicContact CB-CB 4.36Å; N49-A52 WeakPolarHBondContact O-CB 3.44Å; N49-A52 PolarHBondContact O-N 3.23Å; P50-A52 PolarHBondContact O-N 3.22Å; A52-D54 VanDerWaalsContact C-N 3.3Å; A52-D54 PolarHBondContact O-N 3.01Å; A52-K55 PolarHBondContact O-N 3.2Å; A52-K55 VanDerWaalsContact O-N 3.1Å; A52-V56 PolarHBondContact O-N 3.39Å |
| 53 | I | 89.3 | Confident | 94.4 | Very high | 90 Ų | 90 | 89 Ų | 89 | 46% | 0.462 | 48% | 0.477 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -54.5 | -45.7 | -173.3 | -65.4 | 172.1 | 0 | 0 | 0 | 111.4 | L46 P50 | L46-I53 HydrophobicContact CB-CG1 4.21Å; L46-I53 HydrophobicContact CD1-CG1 4.29Å; L46-I53 HydrophobicContact CD2-CG1 3.85Å; L46-I53 HydrophobicContact CG-CG1 4.35Å; P50-I53 HydrophobicContact CB-CD1 4.36Å; P50-I53 WeakPolarHBondContact O-CG1 3.47Å; P50-I53 PolarHBondContact O-N 3.4Å |
| 54 | D | 89.1 | Confident | 94.5 | Very high | 157 Ų | 157 | 90 Ų | 90 | 84% | 0.84 | 48% | 0.48 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -97.4 | 0.3 | -176.6 | -56.2 | -45.2 | 0 | 0 | 0 | 113.5 | A52 | A52-D54 VanDerWaalsContact C-N 3.3Å; A52-D54 PolarHBondContact O-N 3.01Å |
| 55 | K | 93 | Very high | 94.5 | Very high | 149 Ų | 149 | 88.4 Ų | 88.4 | 65% | 0.648 | 47% | 0.469 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -93.7 | -30.1 | -175.2 | -70.9 | -178.1 | -174.3 | 169.6 | 0 | 113.2 | T51 A52 | T51-K55 WeakPolarHBondContact O-CD 3.27Å; T51-K55 WeakPolarHBondContact O-CE 3.15Å; T51-K55 VanDerWaalsContact O-CG 3.27Å; T51-K55 WeakPolarHBondContact O-CG 3.38Å; A52-K55 PolarHBondContact O-N 3.2Å; A52-K55 VanDerWaalsContact O-N 3.1Å |
| 56 | V | 92.3 | Very high | 94.6 | Very high | 45 Ų | 45 | 87 Ų | 87 | 27% | 0.273 | 47% | 0.471 | S | S | . | . | S | Bend | trans | -129 | 119.9 | -170.6 | -164.5 | 0 | 0 | 0 | 0 | 108.8 | A52 E60 V61 | A52-V56 PolarHBondContact O-N 3.39Å; V56-E60 HydrophobicContact CG1-CB 4.05Å; V56-E60 HydrophobicContact CG1-CG 4.05Å; V56-V61 HydrophobicContact CB-CG2 4.18Å; V56-V61 HydrophobicContact CG1-CG2 3.48Å; V56-V61 VanDerWaalsContact CG1-CG2 3.48Å |
| 57 | S | 94 | Very high | 94.6 | Very high | 60 Ų | 60 | 89.7 Ų | 89.7 | 42% | 0.42 | 49% | 0.485 | S | S | . | . | trans | -68.8 | 149.7 | 175.2 | 68.4 | 0 | 0 | 0 | 0 | 111.2 | Q59 E60 V61 | S57-Q59 PolarHBondContact O-N 3.23Å; S57-E60 WeakPolarHBondContact O-CB 3.48Å; S57-E60 PolarHBondContact O-N 2.75Å; S57-E60 WeakPolarHBondContact OG-CB 3.1Å; S57-E60 PolarHBondContact OG-N 3.33Å; S57-V61 WeakPolarHBondContact O-CG2 3.37Å; S57-V61 PolarHBondContact O-N 2.98Å; S57-V61 VanDerWaalsContact O-N 3.07Å | ||
| 58 | E | 93.4 | Very high | 94.7 | Very high | 149 Ų | 149 | 87.2 Ų | 87.2 | 70% | 0.696 | 47% | 0.465 | S | S | * | . | H | α-helix | trans | -59.3 | -32.6 | 177.2 | -61.2 | 89.2 | 159.5 | 0 | 0 | 111.8 | V61 A62 | E58-V61 PolarHBondContact O-N 3.23Å; E58-A62 VanDerWaalsContact O-CB 3.29Å; E58-A62 WeakPolarHBondContact O-CB 3.22Å; E58-A62 PolarHBondContact O-N 3.46Å |
| 59 | Q | 95.5 | Very high | 94.8 | Very high | 165 Ų | 165 | 84.3 Ų | 84.3 | 77% | 0.771 | 45% | 0.451 | S | S | * | . | H | α-helix | trans | -65.7 | -40.5 | 175.8 | -174.4 | 176.6 | -2.7 | 0 | 0 | 112.1 | S57 A62 S63 | S57-Q59 PolarHBondContact O-N 3.23Å; Q59-A62 PolarHBondContact O-N 3.1Å; Q59-S63 WeakPolarHBondContact O-CB 3.38Å; Q59-S63 PolarHBondContact O-N 3.28Å |
| 60 | E | 96 | Very high | 94.8 | Very high | 99 Ų | 99 | 84.7 Ų | 84.7 | 46% | 0.463 | 46% | 0.455 | S | S | . | . | H | α-helix | trans | -65.6 | -44.8 | 175.6 | -177 | 178.3 | 174.1 | 0 | 0 | 111 | V56 S57 A62 S63 K64 | V56-E60 HydrophobicContact CG1-CB 4.05Å; V56-E60 HydrophobicContact CG1-CG 4.05Å; S57-E60 WeakPolarHBondContact O-CB 3.48Å; S57-E60 PolarHBondContact O-N 2.75Å; S57-E60 WeakPolarHBondContact OG-CB 3.1Å; S57-E60 PolarHBondContact OG-N 3.33Å; E60-A62 VanDerWaalsContact C-N 3.34Å; E60-A62 PolarHBondContact O-N 3.04Å; E60-S63 PolarHBondContact O-N 3.44Å; E60-K64 WeakPolarHBondContact O-CG 3.44Å; E60-K64 PolarHBondContact O-N 2.8Å |
| 61 | V | 95.8 | Very high | 95 | Very high | 17 Ų | 17 | 87.9 Ų | 87.9 | 10% | 0.103 | 46% | 0.456 | C | S | . | . | H | α-helix | trans | -59.6 | -45.3 | 175.7 | -179.4 | 0 | 0 | 0 | 0 | 110.8 | F38 W42 V56 S57 E58 K64 F65 | F38-V61 HydrophobicContact CE1-CG1 3.72Å; F38-V61 HydrophobicContact CZ-CG1 3.56Å; W42-V61 HydrophobicContact CD2-CG1 4.02Å; W42-V61 HydrophobicContact CD2-CG2 4.43Å; W42-V61 HydrophobicContact CE3-CG1 4.04Å; W42-V61 HydrophobicContact CE3-CG2 4.44Å; W42-V61 HydrophobicContact CG-CG1 4.42Å; W42-V61 HydrophobicContact CH2-CG2 3.73Å; W42-V61 HydrophobicContact CZ2-CG2 3.69Å; W42-V61 HydrophobicContact CZ3-CG1 4.39Å; W42-V61 HydrophobicContact CZ3-CG2 4.1Å; V56-V61 HydrophobicContact CB-CG2 4.18Å; V56-V61 HydrophobicContact CG1-CG2 3.48Å; V56-V61 VanDerWaalsContact CG1-CG2 3.48Å; S57-V61 WeakPolarHBondContact O-CG2 3.37Å; S57-V61 PolarHBondContact O-N 2.98Å; S57-V61 VanDerWaalsContact O-N 3.07Å; E58-V61 PolarHBondContact O-N 3.23Å; V61-K64 PolarHBondContact O-N 3.3Å; V61-F65 WeakPolarHBondContact O-CB 3.5Å; V61-F65 PolarHBondContact O-N 3.46Å |
| 62 | A | 96.7 | Very high | 95.1 | Very high | 47 Ų | 47 | 91 Ų | 91 | 39% | 0.388 | 46% | 0.458 | S | S | . | . | H | α-helix | trans | -62.7 | -43.7 | 177.5 | 0 | 0 | 0 | 0 | 0 | 112.1 | E58 Q59 E60 K64 F65 V66 | E58-A62 VanDerWaalsContact O-CB 3.29Å; E58-A62 WeakPolarHBondContact O-CB 3.22Å; E58-A62 PolarHBondContact O-N 3.46Å; Q59-A62 PolarHBondContact O-N 3.1Å; E60-A62 VanDerWaalsContact C-N 3.34Å; E60-A62 PolarHBondContact O-N 3.04Å; A62-K64 PolarHBondContact O-N 3.02Å; A62-F65 WeakPolarHBondContact O-CB 3.31Å; A62-F65 PolarHBondContact O-N 3.29Å; A62-V66 WeakPolarHBondContact O-CG2 3.29Å; A62-V66 PolarHBondContact O-N 3.47Å |
| 63 | S | 97.2 | Very high | 95.4 | Very high | 67 Ų | 67 | 96.3 Ų | 96.3 | 47% | 0.469 | 48% | 0.479 | S | S | . | . | H | α-helix | trans | -60.7 | -47 | 176.8 | -170.4 | 0 | 0 | 0 | 0 | 111.4 | Q59 E60 F65 V66 D67 | Q59-S63 WeakPolarHBondContact O-CB 3.38Å; Q59-S63 PolarHBondContact O-N 3.28Å; E60-S63 PolarHBondContact O-N 3.44Å; S63-F65 VanDerWaalsContact C-N 3.3Å; S63-F65 PolarHBondContact O-N 2.94Å; S63-V66 PolarHBondContact O-N 3.39Å; S63-D67 PolarHBondContact O-N 3.35Å |
| 64 | K | 97.1 | Very high | 95.7 | Very high | 138 Ų | 138 | 96.9 Ų | 96.9 | 60% | 0.6 | 48% | 0.48 | S | S | * | . | H | α-helix | trans | -62.4 | -38.6 | 177.4 | -69.5 | -67.3 | -176.4 | -174.9 | 0 | 112.2 | E60 V61 A62 A68 | E60-K64 WeakPolarHBondContact O-CG 3.44Å; E60-K64 PolarHBondContact O-N 2.8Å; V61-K64 PolarHBondContact O-N 3.3Å; A62-K64 PolarHBondContact O-N 3.02Å; K64-A68 WeakPolarHBondContact O-CB 3.15Å; K64-A68 PolarHBondContact O-N 3.34Å; K64-A68 VanDerWaalsContact O-N 3.1Å |
| 65 | F | 97.7 | Very high | 96 | Very high | 55 Ų | 55 | 94 Ų | 94 | 24% | 0.241 | 47% | 0.465 | C | S | . | . | H | α-helix | trans | -62.7 | -47.7 | 175.2 | 173.3 | -103.1 | 0 | 0 | 0 | 111.7 | F38 V61 A62 S63 D67 A68 F69 | F38-F65 HydrophobicContact CB-CD2 4.29Å; F38-F65 HydrophobicContact CB-CE1 4.43Å; F38-F65 HydrophobicContact CB-CE2 3.91Å; F38-F65 HydrophobicContact CB-CZ 3.99Å; F38-F65 HydrophobicContact CD1-CB 4.01Å; F38-F65 HydrophobicContact CD1-CD1 4.01Å; F38-F65 AromaticContact CD1-CD2 3.83Å; F38-F65 HydrophobicContact CD1-CD2 3.83Å; F38-F65 HydrophobicContact CD1-CE1 4.46Å; F38-F65 HydrophobicContact CD1-CE2 4.29Å; F38-F65 AromaticContact CD1-CG 3.66Å; F38-F65 HydrophobicContact CD1-CG 3.66Å; F38-F65 AromaticContact CD2-CD2 3.35Å; F38-F65 HydrophobicContact CD2-CD2 3.35Å; F38-F65 AromaticContact CD2-CE2 3.6Å; F38-F65 HydrophobicContact CD2-CE2 3.6Å; F38-F65 HydrophobicContact CD2-CG 4.06Å; F38-F65 HydrophobicContact CD2-CZ 4.48Å; F38-F65 HydrophobicContact CE1-CB 3.45Å; F38-F65 VanDerWaalsContact CE1-CB 3.45Å; F38-F65 HydrophobicContact CE1-CD1 4.32Å; F38-F65 AromaticContact CE1-CD2 3.94Å; F38-F65 HydrophobicContact CE1-CD2 3.94Å; F38-F65 AromaticContact CE1-CG 3.64Å; F38-F65 HydrophobicContact CE1-CG 3.64Å; F38-F65 HydrophobicContact CE2-CB 4.15Å; F38-F65 AromaticContact CE2-CD2 3.49Å; F38-F65 HydrophobicContact CE2-CD2 3.49Å; F38-F65 VanDerWaalsContact CE2-CD2 3.49Å; F38-F65 HydrophobicContact CE2-CE2 4.21Å; F38-F65 HydrophobicContact CE2-CG 4.05Å; F38-F65 HydrophobicContact CG-CD1 4.3Å; F38-F65 AromaticContact CG-CD2 3.53Å; F38-F65 HydrophobicContact CG-CD2 3.53Å; F38-F65 HydrophobicContact CG-CE1 4.41Å; F38-F65 AromaticContact CG-CE2 3.66Å; F38-F65 HydrophobicContact CG-CE2 3.66Å; F38-F65 AromaticContact CG-CG 3.87Å; F38-F65 HydrophobicContact CG-CG 3.87Å; F38-F65 HydrophobicContact CG-CZ 4.11Å; F38-F65 HydrophobicContact CZ-CB 3.54Å; F38-F65 AromaticContact CZ-CD2 3.8Å; F38-F65 HydrophobicContact CZ-CD2 3.8Å; F38-F65 AromaticContact CZ-CG 3.86Å; F38-F65 HydrophobicContact CZ-CG 3.86Å; V61-F65 WeakPolarHBondContact O-CB 3.5Å; V61-F65 PolarHBondContact O-N 3.46Å; A62-F65 WeakPolarHBondContact O-CB 3.31Å; A62-F65 PolarHBondContact O-N 3.29Å; S63-F65 VanDerWaalsContact C-N 3.3Å; S63-F65 PolarHBondContact O-N 2.94Å; F65-D67 PolarHBondContact O-N 3.47Å; F65-A68 PolarHBondContact O-N 2.84Å; F65-F69 HydrophobicContact CE1-CB 4.39Å; F65-F69 HydrophobicContact CE1-CD2 4.46Å; F65-F69 HydrophobicContact CZ-CB 4.4Å; F65-F69 HydrophobicContact CZ-CD2 4.03Å; F65-F69 WeakPolarHBondContact O-CB 3.46Å; F65-F69 PolarHBondContact O-N 2.96Å |
| 66 | V | 97.7 | Very high | 96.1 | Very high | 79 Ų | 79 | 90.7 Ų | 90.7 | 48% | 0.479 | 45% | 0.451 | S | S | . | . | H | α-helix | trans | -61.3 | -45.1 | 179.4 | 172.9 | 0 | 0 | 0 | 0 | 110.9 | A62 S63 A68 F69 V70 | A62-V66 WeakPolarHBondContact O-CG2 3.29Å; A62-V66 PolarHBondContact O-N 3.47Å; S63-V66 PolarHBondContact O-N 3.39Å; V66-A68 VanDerWaalsContact C-N 3.29Å; V66-A68 PolarHBondContact O-N 2.62Å; V66-F69 PolarHBondContact O-N 3.42Å; V66-V70 HydrophobicContact CG1-CG2 4.42Å; V66-V70 WeakPolarHBondContact O-CG2 3.3Å; V66-V70 PolarHBondContact O-N 2.79Å |
| 67 | D | 96.8 | Very high | 96.2 | Very high | 87 Ų | 87 | 90 Ų | 90 | 47% | 0.465 | 45% | 0.451 | S | S | . | . | H | α-helix | trans | -60.5 | -37.2 | 177.4 | -70.9 | -19.7 | 0 | 0 | 0 | 112.8 | S63 F65 R71 | S63-D67 PolarHBondContact O-N 3.35Å; F65-D67 PolarHBondContact O-N 3.47Å; D67-R71 WeakPolarHBondContact O-CG 3.27Å; D67-R71 PolarHBondContact O-NE 3.34Å |
| 68 | A | 97.7 | Very high | 96.1 | Very high | 25 Ų | 25 | 92.8 Ų | 92.8 | 21% | 0.207 | 45% | 0.452 | C | S | . | . | H | α-helix | trans | -74.2 | -46.1 | 174.7 | 0 | 0 | 0 | 0 | 0 | 111.4 | K64 F65 V66 V70 R71 Y72 | K64-A68 WeakPolarHBondContact O-CB 3.15Å; K64-A68 PolarHBondContact O-N 3.34Å; K64-A68 VanDerWaalsContact O-N 3.1Å; F65-A68 PolarHBondContact O-N 2.84Å; V66-A68 VanDerWaalsContact C-N 3.29Å; V66-A68 PolarHBondContact O-N 2.62Å; A68-V70 PolarHBondContact O-N 2.77Å; A68-R71 PolarHBondContact O-N 3.4Å; A68-Y72 HydrophobicContact CB-CD2 4.35Å; A68-Y72 HydrophobicContact CB-CE2 4.35Å; A68-Y72 WeakPolarHBondContact O-CD2 3.38Å; A68-Y72 PolarHBondContact O-N 3.29Å |
| 69 | F | 97.5 | Very high | 96.1 | Very high | 93 Ų | 93 | 90.9 Ų | 90.9 | 41% | 0.408 | 44% | 0.438 | S | S | . | . | H | α-helix | trans | -56.2 | -48.5 | -177.9 | 178.1 | -90.4 | 0 | 0 | 0 | 111.1 | F65 V66 R71 Y72 F73 | F65-F69 HydrophobicContact CE1-CB 4.39Å; F65-F69 HydrophobicContact CE1-CD2 4.46Å; F65-F69 HydrophobicContact CZ-CB 4.4Å; F65-F69 HydrophobicContact CZ-CD2 4.03Å; F65-F69 WeakPolarHBondContact O-CB 3.46Å; F65-F69 PolarHBondContact O-N 2.96Å; V66-F69 PolarHBondContact O-N 3.42Å; F69-R71 VanDerWaalsContact C-N 3.34Å; F69-R71 PolarHBondContact O-N 3.41Å; F69-Y72 PolarHBondContact O-N 2.92Å; F69-F73 HydrophobicContact CD1-CB 4.32Å; F69-F73 HydrophobicContact CE1-CB 4.03Å; F69-F73 HydrophobicContact CE1-CD2 4.46Å; F69-F73 HydrophobicContact CE1-CG 4.2Å; F69-F73 HydrophobicContact CZ-CB 4.28Å; F69-F73 HydrophobicContact CZ-CD2 4.22Å; F69-F73 HydrophobicContact CZ-CG 4.37Å; F69-F73 WeakPolarHBondContact O-CB 3.3Å; F69-F73 PolarHBondContact O-N 2.77Å |
| 70 | V | 97 | Very high | 96 | Very high | 65 Ų | 65 | 87.1 Ų | 87.1 | 39% | 0.394 | 42% | 0.423 | S | S | . | . | H | α-helix | trans | -58.1 | -47.6 | 179.4 | 173.4 | 0 | 0 | 0 | 0 | 110.8 | V66 A68 Y72 F73 E74 | V66-V70 HydrophobicContact CG1-CG2 4.42Å; V66-V70 WeakPolarHBondContact O-CG2 3.3Å; V66-V70 PolarHBondContact O-N 2.79Å; A68-V70 PolarHBondContact O-N 2.77Å; V70-Y72 PolarHBondContact O-N 3.46Å; V70-F73 PolarHBondContact O-N 3.46Å; V70-E74 HydrophobicContact CG1-CG 4.35Å; V70-E74 WeakPolarHBondContact O-CB 3.46Å; V70-E74 VanDerWaalsContact O-CG 3.3Å; V70-E74 WeakPolarHBondContact O-CG 3.33Å; V70-E74 PolarHBondContact O-N 3.32Å |
| 71 | R | 96 | Very high | 95.6 | Very high | 150 Ų | 150 | 85.7 Ų | 85.7 | 57% | 0.566 | 42% | 0.423 | S | S | * | . | H | α-helix | trans | -61.1 | -45.9 | 179.6 | -70.6 | -176.7 | -71.8 | 144.7 | -5.2 | 112.6 | D67 A68 F69 N75 | D67-R71 WeakPolarHBondContact O-CG 3.27Å; D67-R71 PolarHBondContact O-NE 3.34Å; A68-R71 PolarHBondContact O-N 3.4Å; F69-R71 VanDerWaalsContact C-N 3.34Å; F69-R71 PolarHBondContact O-N 3.41Å; R71-N75 PolarHBondContact O-N 3Å; R71-N75 PolarHBondContact O-ND2 3.19Å |
| 72 | Y | 96.8 | Very high | 95 | Very high | 164 Ų | 164 | 91.9 Ų | 91.9 | 64% | 0.643 | 44% | 0.444 | S | S | * | . | H | α-helix | trans | -72 | -41.8 | 179.8 | -74.1 | -67 | 0 | 0 | 0 | 112.2 | A68 F69 V70 N75 E76 | A68-Y72 HydrophobicContact CB-CD2 4.35Å; A68-Y72 HydrophobicContact CB-CE2 4.35Å; A68-Y72 WeakPolarHBondContact O-CD2 3.38Å; A68-Y72 PolarHBondContact O-N 3.29Å; F69-Y72 PolarHBondContact O-N 2.92Å; V70-Y72 PolarHBondContact O-N 3.46Å; Y72-N75 PolarHBondContact O-N 3.06Å; Y72-E76 VanDerWaalsContact O-CB 3.3Å; Y72-E76 WeakPolarHBondContact O-CB 3.36Å; Y72-E76 PolarHBondContact O-N 2.98Å |
| 73 | F | 96.5 | Very high | 94.2 | Very high | 122 Ų | 122 | 92.6 Ų | 92.6 | 54% | 0.535 | 44% | 0.444 | S | S | . | . | H | α-helix | trans | -61.6 | -47 | 177.8 | 175.3 | -98.3 | 0 | 0 | 0 | 111.5 | F69 V70 N75 E76 A77 | F69-F73 HydrophobicContact CD1-CB 4.32Å; F69-F73 HydrophobicContact CE1-CB 4.03Å; F69-F73 HydrophobicContact CE1-CD2 4.46Å; F69-F73 HydrophobicContact CE1-CG 4.2Å; F69-F73 HydrophobicContact CZ-CB 4.28Å; F69-F73 HydrophobicContact CZ-CD2 4.22Å; F69-F73 HydrophobicContact CZ-CG 4.37Å; F69-F73 WeakPolarHBondContact O-CB 3.3Å; F69-F73 PolarHBondContact O-N 2.77Å; V70-F73 PolarHBondContact O-N 3.46Å; F73-N75 VanDerWaalsContact C-N 3.34Å; F73-N75 PolarHBondContact O-N 3.37Å; F73-E76 PolarHBondContact O-N 3.16Å; F73-A77 HydrophobicContact CE1-CB 4.32Å; F73-A77 HydrophobicContact CZ-CB 4.3Å; F73-A77 WeakPolarHBondContact O-CB 3.36Å; F73-A77 PolarHBondContact O-N 3.03Å |
| 74 | E | 95.5 | Very high | 93.1 | Very high | 102 Ų | 102 | 92.3 Ų | 92.3 | 48% | 0.477 | 44% | 0.442 | S | S | . | . | H | α-helix | trans | -60.9 | -43.5 | 178.9 | -77.1 | -175.7 | 173.8 | 0 | 0 | 112.2 | V70 R78 | V70-E74 HydrophobicContact CG1-CG 4.35Å; V70-E74 WeakPolarHBondContact O-CB 3.46Å; V70-E74 VanDerWaalsContact O-CG 3.3Å; V70-E74 WeakPolarHBondContact O-CG 3.33Å; V70-E74 PolarHBondContact O-N 3.32Å; E74-R78 WeakPolarHBondContact O-CB 3.3Å; E74-R78 PolarHBondContact O-N 3.4Å |
| 75 | N | 95.1 | Very high | 92 | Very high | 97 Ų | 97 | 94.1 Ų | 94.1 | 52% | 0.519 | 45% | 0.445 | S | S | . | . | H | α-helix | trans | -62.4 | -46.2 | 177.2 | -77.1 | -17.7 | 0 | 0 | 0 | 111.3 | R71 Y72 F73 R78 R79 | R71-N75 PolarHBondContact O-N 3Å; R71-N75 PolarHBondContact O-ND2 3.19Å; Y72-N75 PolarHBondContact O-N 3.06Å; F73-N75 VanDerWaalsContact C-N 3.34Å; F73-N75 PolarHBondContact O-N 3.37Å; N75-R78 PolarHBondContact O-N 3.37Å; N75-R79 WeakPolarHBondContact O-CB 3.41Å; N75-R79 PolarHBondContact O-N 3.42Å |
| 76 | E | 96.2 | Very high | 90.4 | Very high | 78 Ų | 78 | 97.2 Ų | 97.2 | 36% | 0.364 | 46% | 0.463 | S | S | . | . | H | α-helix | trans | -72 | -43.3 | -177.1 | -174.7 | 60 | -169.6 | 0 | 0 | 112.3 | Y72 F73 R78 R79 I80 | Y72-E76 VanDerWaalsContact O-CB 3.3Å; Y72-E76 WeakPolarHBondContact O-CB 3.36Å; Y72-E76 PolarHBondContact O-N 2.98Å; F73-E76 PolarHBondContact O-N 3.16Å; E76-R78 VanDerWaalsContact C-N 3.3Å; E76-R78 PolarHBondContact O-N 3.45Å; E76-R79 WeakPolarHBondContact O-CB 3.21Å; E76-R79 PolarHBondContact O-N 2.91Å; E76-R79 IonicContact OE1-CZ 3.38Å; E76-R79 IonicContact OE1-NE 3.35Å; E76-R79 PolarHBondContact OE1-NE 2.99Å; E76-R79 IonicContact OE1-NH2 2.62Å; E76-R79 PolarHBondContact OE1-NH2 3.49Å; E76-R79 IonicContact OE2-CZ 3.63Å; E76-R79 IonicContact OE2-NE 2.79Å; E76-R79 PolarHBondContact OE2-NE 3.4Å; E76-R79 IonicContact OE2-NH2 3.65Å; E76-I80 HydrophobicContact CG-CD1 3.92Å; E76-I80 WeakPolarHBondContact O-CB 3.34Å; E76-I80 VanDerWaalsContact O-CG1 3.31Å; E76-I80 WeakPolarHBondContact O-CG1 3.48Å; E76-I80 PolarHBondContact O-N 2.84Å |
| 77 | A | 93.8 | Very high | 88.7 | Confident | 31 Ų | 31 | 98.5 Ų | 98.5 | 26% | 0.256 | 47% | 0.467 | S | S | . | . | H | α-helix | trans | -59.2 | -43.7 | 173.9 | 0 | 0 | 0 | 0 | 0 | 110.9 | F73 R79 I80 C81 | F73-A77 HydrophobicContact CE1-CB 4.32Å; F73-A77 HydrophobicContact CZ-CB 4.3Å; F73-A77 WeakPolarHBondContact O-CB 3.36Å; F73-A77 PolarHBondContact O-N 3.03Å; A77-R79 PolarHBondContact O-N 3.4Å; A77-I80 PolarHBondContact O-N 2.74Å; A77-C81 WeakPolarHBondContact O-CB 3.19Å; A77-C81 PolarHBondContact O-N 3.35Å; A77-C81 PolarHBondContact O-SG 3.46Å |
| 78 | R | 93 | Very high | 86.8 | Confident | 119 Ų | 119 | 99.4 Ų | 99.4 | 45% | 0.449 | 47% | 0.472 | S | S | . | . | H | α-helix | trans | -63.2 | -41.2 | 176.2 | -173.9 | -170.1 | -64.3 | -177.1 | -0.3 | 111.7 | E74 N75 E76 R82 | E74-R78 WeakPolarHBondContact O-CB 3.3Å; E74-R78 PolarHBondContact O-N 3.4Å; N75-R78 PolarHBondContact O-N 3.37Å; E76-R78 VanDerWaalsContact C-N 3.3Å; E76-R78 PolarHBondContact O-N 3.45Å; R78-R82 VanDerWaalsContact CD-CZ 3.4Å; R78-R82 VanDerWaalsContact CG-NH1 3.29Å; R78-R82 WeakPolarHBondContact O-CB 3.46Å; R78-R82 WeakPolarHBondContact O-CG 3.42Å; R78-R82 PolarHBondContact O-N 2.92Å |
| 79 | R | 93.7 | Very high | 84.7 | Confident | 109 Ų | 109 | 103.4 Ų | 103.4 | 41% | 0.411 | 49% | 0.49 | S | S | . | . | H | α-helix | trans | -63 | -49.8 | 176 | -170.6 | -166.9 | 69.1 | 72.4 | -1.9 | 111.5 | N75 E76 A77 T83 | N75-R79 WeakPolarHBondContact O-CB 3.41Å; N75-R79 PolarHBondContact O-N 3.42Å; E76-R79 WeakPolarHBondContact O-CB 3.21Å; E76-R79 PolarHBondContact O-N 2.91Å; E76-R79 IonicContact OE1-CZ 3.38Å; E76-R79 IonicContact OE1-NE 3.35Å; E76-R79 PolarHBondContact OE1-NE 2.99Å; E76-R79 IonicContact OE1-NH2 2.62Å; E76-R79 PolarHBondContact OE1-NH2 3.49Å; E76-R79 IonicContact OE2-CZ 3.63Å; E76-R79 IonicContact OE2-NE 2.79Å; E76-R79 PolarHBondContact OE2-NE 3.4Å; E76-R79 IonicContact OE2-NH2 3.65Å; A77-R79 PolarHBondContact O-N 3.4Å; R79-T83 WeakPolarHBondContact O-CB 3.07Å; R79-T83 PolarHBondContact O-N 3Å; R79-T83 PolarHBondContact O-OG1 3.49Å |
| 80 | I | 91.7 | Very high | 82.5 | Confident | 86 Ų | 86 | 102.2 Ų | 102.2 | 44% | 0.441 | 49% | 0.493 | S | S | . | . | H | α-helix | trans | -64 | -48.5 | -180 | -67.3 | 168.6 | 0 | 0 | 0 | 110.7 | E76 A77 R82 T83 S84 | E76-I80 HydrophobicContact CG-CD1 3.92Å; E76-I80 WeakPolarHBondContact O-CB 3.34Å; E76-I80 VanDerWaalsContact O-CG1 3.31Å; E76-I80 WeakPolarHBondContact O-CG1 3.48Å; E76-I80 PolarHBondContact O-N 2.84Å; A77-I80 PolarHBondContact O-N 2.74Å; I80-R82 PolarHBondContact O-N 3.23Å; I80-T83 PolarHBondContact O-N 3.05Å; I80-S84 WeakPolarHBondContact O-CB 3.37Å; I80-S84 PolarHBondContact O-N 3.17Å |
| 81 | C | 88.1 | Confident | 80.5 | Confident | 69 Ų | 69 | 104.8 Ų | 104.8 | 47% | 0.466 | 51% | 0.509 | S | S | . | . | H | α-helix | trans | -63.6 | -38.6 | -179.3 | -73.7 | 0 | 0 | 0 | 0 | 112.5 | A77 S84 R85 | A77-C81 WeakPolarHBondContact O-CB 3.19Å; A77-C81 PolarHBondContact O-N 3.35Å; A77-C81 PolarHBondContact O-SG 3.46Å; C81-S84 PolarHBondContact O-N 2.96Å; C81-R85 VanDerWaalsContact O-CG 3.3Å; C81-R85 WeakPolarHBondContact O-CG 3.42Å; C81-R85 PolarHBondContact O-N 3.24Å |
| 82 | R | 84.2 | Confident | 78.3 | Confident | 147 Ų | 147 | 103.6 Ų | 103.6 | 56% | 0.555 | 52% | 0.518 | S | S | * | . | H | α-helix | trans | -65.6 | -45.2 | 173.4 | -75.9 | 174.2 | -179.6 | 153.3 | -2.6 | 111.9 | R78 I80 S84 R85 L86 | R78-R82 VanDerWaalsContact CD-CZ 3.4Å; R78-R82 VanDerWaalsContact CG-NH1 3.29Å; R78-R82 WeakPolarHBondContact O-CB 3.46Å; R78-R82 WeakPolarHBondContact O-CG 3.42Å; R78-R82 PolarHBondContact O-N 2.92Å; I80-R82 PolarHBondContact O-N 3.23Å; R82-S84 VanDerWaalsContact C-N 3.28Å; R82-S84 PolarHBondContact O-N 3.47Å; R82-R85 PolarHBondContact O-N 2.86Å; R82-R85 VanDerWaalsContact O-N 3.13Å; R82-L86 WeakPolarHBondContact O-CG 3.3Å; R82-L86 PolarHBondContact O-N 2.99Å |
| 83 | T | 79.5 | Confident | 76.1 | Confident | 62 Ų | 62 | 100.5 Ų | 100.5 | 38% | 0.38 | 52% | 0.52 | S | S | . | . | H | α-helix | trans | -60.8 | -41.4 | 177.4 | -51.3 | 0 | 0 | 0 | 0 | 110.8 | R79 I80 R85 L86 L87 | R79-T83 WeakPolarHBondContact O-CB 3.07Å; R79-T83 PolarHBondContact O-N 3Å; R79-T83 PolarHBondContact O-OG1 3.49Å; I80-T83 PolarHBondContact O-N 3.05Å; T83-R85 VanDerWaalsContact C-N 3.35Å; T83-R85 PolarHBondContact O-N 3.42Å; T83-L86 PolarHBondContact O-N 3.44Å; T83-L87 HydrophobicContact CG2-CD1 4.38Å; T83-L87 VanDerWaalsContact O-CG 3.3Å; T83-L87 WeakPolarHBondContact O-CG 3.34Å; T83-L87 PolarHBondContact O-N 2.86Å |
| 84 | S | 74.7 | Confident | 73.5 | Confident | 60 Ų | 60 | 102.1 Ų | 102.1 | 42% | 0.42 | 53% | 0.534 | S | S | . | . | H | α-helix | trans | -64.6 | -36.4 | 175.6 | -173.2 | 0 | 0 | 0 | 0 | 112.9 | I80 C81 R82 N88 | I80-S84 WeakPolarHBondContact O-CB 3.37Å; I80-S84 PolarHBondContact O-N 3.17Å; C81-S84 PolarHBondContact O-N 2.96Å; R82-S84 VanDerWaalsContact C-N 3.28Å; R82-S84 PolarHBondContact O-N 3.47Å; S84-N88 PolarHBondContact O-N 3.13Å; S84-N88 VanDerWaalsContact O-N 3.11Å |
| 85 | R | 72.6 | Confident | 70.8 | Confident | 176 Ų | 176 | 100.5 Ų | 100.5 | 66% | 0.664 | 54% | 0.544 | S | S | * | . | H | α-helix | trans | -67.7 | -44.2 | 174.9 | -72.4 | 174.6 | -170.8 | -168.7 | 2.3 | 111.4 | C81 R82 T83 L87 N88 D89 | C81-R85 VanDerWaalsContact O-CG 3.3Å; C81-R85 WeakPolarHBondContact O-CG 3.42Å; C81-R85 PolarHBondContact O-N 3.24Å; R82-R85 PolarHBondContact O-N 2.86Å; R82-R85 VanDerWaalsContact O-N 3.13Å; T83-R85 VanDerWaalsContact C-N 3.35Å; T83-R85 PolarHBondContact O-N 3.42Å; R85-L87 VanDerWaalsContact C-N 3.32Å; R85-L87 PolarHBondContact O-N 3.18Å; R85-N88 PolarHBondContact O-N 3.36Å; R85-N88 VanDerWaalsContact O-N 3.14Å; R85-D89 PolarHBondContact O-N 3.35Å |
| 86 | L | 64.7 | Low | 68.3 | Low | 121 Ų | 121 | 100.2 Ų | 100.2 | 63% | 0.634 | 55% | 0.55 | S | S | * | * | H | α-helix | trans | -63.6 | -36.9 | 176.6 | -66.8 | 176.3 | 0 | 0 | 0 | 112.4 | R82 T83 D89 S90 | R82-L86 WeakPolarHBondContact O-CG 3.3Å; R82-L86 PolarHBondContact O-N 2.99Å; T83-L86 PolarHBondContact O-N 3.44Å; L86-D89 PolarHBondContact O-N 3.06Å; L86-S90 WeakPolarHBondContact O-CB 3.37Å; L86-S90 PolarHBondContact O-N 2.89Å; L86-S90 PolarHBondContact O-OG 3.33Å |
| 87 | L | 61.3 | Low | 65.7 | Low | 106 Ų | 106 | 105.1 Ų | 105.1 | 56% | 0.555 | 57% | 0.573 | S | S | * | * | H | α-helix | trans | -65.1 | -40.7 | 173.6 | -71.7 | 173.8 | 0 | 0 | 0 | 111.4 | T83 R85 S90 V91 | T83-L87 HydrophobicContact CG2-CD1 4.38Å; T83-L87 VanDerWaalsContact O-CG 3.3Å; T83-L87 WeakPolarHBondContact O-CG 3.34Å; T83-L87 PolarHBondContact O-N 2.86Å; R85-L87 VanDerWaalsContact C-N 3.32Å; R85-L87 PolarHBondContact O-N 3.18Å; L87-S90 PolarHBondContact O-N 3.32Å; L87-S90 PolarHBondContact O-OG 3.4Å; L87-V91 WeakPolarHBondContact O-CG2 3.41Å; L87-V91 PolarHBondContact O-N 2.89Å |
| 88 | N | 57.5 | Low | 62.9 | Low | 106 Ų | 106 | 108.7 Ų | 108.7 | 57% | 0.567 | 60% | 0.596 | S | S | * | * | H | α-helix | trans | -66.7 | -39.2 | 176.5 | -73 | -10.7 | 0 | 0 | 0 | 112.3 | S84 R85 V92 | S84-N88 PolarHBondContact O-N 3.13Å; S84-N88 VanDerWaalsContact O-N 3.11Å; R85-N88 PolarHBondContact O-N 3.36Å; R85-N88 VanDerWaalsContact O-N 3.14Å; N88-V92 WeakPolarHBondContact O-CG2 3.3Å |
| 89 | D | 53.7 | Low | 60.3 | Low | 109 Ų | 109 | 110 Ų | 110 | 58% | 0.583 | 61% | 0.611 | S | S | * | * | H | α-helix | trans | -71.8 | -33.5 | 177.6 | -69.4 | -28.9 | 0 | 0 | 0 | 112.2 | R85 L86 V91 V92 S93 | R85-D89 PolarHBondContact O-N 3.35Å; L86-D89 PolarHBondContact O-N 3.06Å; D89-V91 VanDerWaalsContact C-N 3.27Å; D89-V91 PolarHBondContact O-N 3.46Å; D89-V92 PolarHBondContact O-N 3.08Å; D89-S93 PolarHBondContact O-N 2.93Å |
| 90 | S | 52.1 | Low | 57.9 | Low | 68 Ų | 68 | 115.3 Ų | 115.3 | 48% | 0.476 | 64% | 0.637 | S | S | . | * | H | α-helix | trans | -67.4 | -24.7 | 178 | 75.9 | 0 | 0 | 0 | 0 | 113.9 | L86 L87 | L86-S90 WeakPolarHBondContact O-CB 3.37Å; L86-S90 PolarHBondContact O-N 2.89Å; L86-S90 PolarHBondContact O-OG 3.33Å; L87-S90 PolarHBondContact O-N 3.32Å; L87-S90 PolarHBondContact O-OG 3.4Å |
| 91 | V | 53.3 | Low | 55.4 | Low | 119 Ų | 119 | 117.5 Ų | 117.5 | 72% | 0.721 | 66% | 0.655 | S | S | * | * | H | α-helix | trans | -83 | -23.5 | 177.8 | 177.4 | 0 | 0 | 0 | 0 | 111.6 | L87 D89 | L87-V91 WeakPolarHBondContact O-CG2 3.41Å; L87-V91 PolarHBondContact O-N 2.89Å; D89-V91 VanDerWaalsContact C-N 3.27Å; D89-V91 PolarHBondContact O-N 3.46Å |
| 92 | V | 51.2 | Low | 53.2 | Low | 125 Ų | 125 | 119 Ų | 119 | 76% | 0.758 | 67% | 0.666 | S | S | * | * | H | α-helix | trans | -92.9 | -23.1 | -177.7 | -177.6 | 0 | 0 | 0 | 0 | 112.4 | N88 D89 | N88-V92 WeakPolarHBondContact O-CG2 3.3Å; D89-V92 PolarHBondContact O-N 3.08Å |
| 93 | S | 49.7 | Very low | 51.1 | Low | 98 Ų | 98 | 120.7 Ų | 120.7 | 69% | 0.685 | 68% | 0.68 | S | S | * | * | S | Bend | trans | -89.6 | -0.4 | -174.6 | -145.1 | 0 | 0 | 0 | 0 | 115.8 | D89 G95 | D89-S93 PolarHBondContact O-N 2.93Å; S93-G95 VanDerWaalsContact C-N 3.3Å; S93-G95 PolarHBondContact O-N 3.45Å |
| 94 | N | 42.5 | Very low | 49.3 | Very low | 157 Ų | 157 | 123.2 Ų | 123.2 | 84% | 0.84 | 70% | 0.701 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -91.7 | 37.6 | -174.5 | -118.1 | 65.4 | 0 | 0 | 0 | 114.5 | ||
| 95 | G | 39.5 | Very low | 47.9 | Very low | 67 Ų | 67 | 124.4 Ų | 124.4 | 69% | 0.691 | 71% | 0.714 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -106.9 | -9.7 | -175.9 | 0 | 0 | 0 | 0 | 0 | 116.6 | S93 | S93-G95 VanDerWaalsContact C-N 3.3Å; S93-G95 PolarHBondContact O-N 3.45Å |
| 96 | S | 42.2 | Very low | 46.2 | Very low | 91 Ų | 91 | 124 Ų | 124 | 64% | 0.636 | 72% | 0.724 | S | S | * | * | S | Bend | trans | -151.9 | 127.8 | -169.1 | -43.3 | 0 | 0 | 0 | 0 | 111.1 | ||
| 97 | H | 41.9 | Very low | 45.1 | Very low | 182 Ų | 182 | 124 Ų | 124 | 84% | 0.843 | 73% | 0.733 | S | S | * | * | trans | 95.1 | 70.7 | 169.1 | -44.8 | -66.3 | 0 | 0 | 0 | 118.1 | ||||
| 98 | S | 35.1 | Very low | 44 | Very low | 105 Ų | 105 | 130.4 Ų | 130.4 | 73% | 0.734 | 75% | 0.75 | S | S | * | * | 34.4 | 121.1 | 107.2 | -150.1 | 0 | 0 | 0 | 0 | 119.3 | |||||
| 99 | L | 38 | Very low | 43.3 | Very low | 148 Ų | 148 | 133 Ų | 133 | 78% | 0.775 | 76% | 0.764 | S | S | * | * | trans | 76.2 | 77.8 | 154.8 | -53.6 | 171.8 | 0 | 0 | 0 | 118.8 | ||||
| 100 | F | 43 | Very low | 42.6 | Very low | 219 Ų | 219 | 131.5 Ų | 131.5 | 96% | 0.961 | 77% | 0.774 | S | S | * | * | trans | -139.7 | 138.1 | 134.9 | -85.4 | -75.9 | 0 | 0 | 0 | 111.4 | ||||
| 101 | T | 39.5 | Very low | 42.1 | Very low | 133 Ų | 133 | 131.3 Ų | 131.3 | 82% | 0.816 | 78% | 0.783 | S | S | * | * | trans | -75.1 | 158.4 | -165.6 | 4.6 | 0 | 0 | 0 | 0 | 113.7 | ||||
| 102 | S | 42.1 | Very low | 41.9 | Very low | 99 Ų | 99 | 129.8 Ų | 129.8 | 69% | 0.692 | 78% | 0.782 | S | S | * | * | trans | 97.7 | 106.7 | 153.4 | -151.3 | 0 | 0 | 0 | 0 | 117.8 | ||||
| 103 | E | 40.1 | Very low | 41.9 | Very low | 183 Ų | 183 | 135.3 Ų | 135.3 | 86% | 0.855 | 79% | 0.79 | S | S | * | * | trans | 47.1 | 107 | 139.8 | -64.4 | -173.9 | 125.6 | 0 | 0 | 118.7 | ||||
| 104 | S | 40.7 | Very low | 42 | Very low | 116 Ų | 116 | 134.4 Ų | 134.4 | 81% | 0.811 | 79% | 0.788 | S | S | * | * | 164.2 | 119.3 | 108.9 | -172.2 | 0 | 0 | 0 | 0 | 111.8 | |||||
| 105 | A | 45.8 | Very low | 42.2 | Very low | 84 Ų | 84 | 134.3 Ų | 134.3 | 69% | 0.694 | 78% | 0.782 | S | S | * | * | trans | 60.1 | 107.5 | 142.7 | 0 | 0 | 0 | 0 | 0 | 120.3 | C107 | A105-C107 PolarHBondContact O-N 3.45Š| ||
| 106 | L | 37 | Very low | 42.6 | Very low | 169 Ų | 169 | 138.8 Ų | 138.8 | 89% | 0.885 | 78% | 0.779 | S | S | * | * | trans | -28.2 | 122.4 | 141.9 | -67.5 | 77.2 | 0 | 0 | 0 | 113.1 | ||||
| 107 | C | 41.9 | Very low | 43.1 | Very low | 121 Ų | 121 | 140.6 Ų | 140.6 | 82% | 0.818 | 79% | 0.787 | S | S | * | * | trans | -156.4 | 104.1 | 150.1 | -91.3 | 0 | 0 | 0 | 0 | 110.4 | A105 | A105-C107 PolarHBondContact O-N 3.45Š| ||
| 108 | R | 38.1 | Very low | 43.3 | Very low | 240 Ų | 240 | 139.2 Ų | 139.2 | 91% | 0.906 | 79% | 0.785 | S | S | * | * | trans | -59.8 | 131.6 | 148.5 | -79.5 | 169.4 | 136.4 | -130.6 | 0.6 | 108 | ||||
| 109 | N | 42.2 | Very low | 43.8 | Very low | 160 Ų | 160 | 138.4 Ų | 138.4 | 86% | 0.856 | 78% | 0.78 | S | S | * | * | trans | 170.8 | 131.7 | 153.7 | -86.8 | -11.5 | 0 | 0 | 0 | 107.2 | ||||
| 110 | G | 38.3 | Very low | 44.2 | Very low | 77 Ų | 77 | 137.3 Ų | 137.3 | 79% | 0.794 | 77% | 0.774 | S | S | * | * | cis | 75.1 | 91.3 | 42.7 | 0 | 0 | 0 | 0 | 0 | 110.1 | ||||
| 111 | G | 41.6 | Very low | 44.2 | Very low | 65 Ų | 65 | 133.2 Ų | 133.2 | 67% | 0.67 | 77% | 0.771 | S | S | * | * | trans | 128 | -1.6 | 158.7 | 0 | 0 | 0 | 0 | 0 | 120.2 | R113 | G111-R113 VanDerWaalsContact C-N 3.32Å; G111-R113 PolarHBondContact O-N 2.92Å | ||
| 112 | A | 49.5 | Very low | 44.1 | Very low | 86 Ų | 86 | 131.7 Ų | 131.7 | 71% | 0.711 | 77% | 0.766 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -76.9 | -1.5 | -171.5 | 0 | 0 | 0 | 0 | 0 | 116.9 | ||
| 113 | R | 51 | Low | 43.8 | Very low | 242 Ų | 242 | 132 Ų | 132 | 91% | 0.913 | 77% | 0.768 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -80.4 | -21.8 | -176.1 | -171.4 | 171.7 | 167 | 169.8 | -3.5 | 114.1 | G111 | G111-R113 VanDerWaalsContact C-N 3.32Å; G111-R113 PolarHBondContact O-N 2.92Å |
| 114 | A | 51 | Low | 44.1 | Very low | 78 Ų | 78 | 132.5 Ų | 132.5 | 65% | 0.645 | 77% | 0.77 | S | S | * | * | S | Bend | trans | -96.8 | -9 | -170.9 | 0 | 0 | 0 | 0 | 0 | 115.2 | ||
| 115 | Q | 47.9 | Very low | 44.3 | Very low | 155 Ų | 155 | 132.6 Ų | 132.6 | 72% | 0.724 | 77% | 0.766 | S | S | * | * | S | Bend | trans | -91.6 | -9.5 | -176.2 | -69.1 | -170.9 | -14.6 | 0 | 0 | 114.5 | ||
| 116 | Y | 47.5 | Very low | 44.3 | Very low | 161 Ų | 161 | 136.4 Ų | 136.4 | 63% | 0.631 | 78% | 0.775 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -77.9 | -21.7 | -175.9 | -109.6 | -87.3 | 0 | 0 | 0 | 114.5 | N118 | Y116-N118 VanDerWaalsContact C-N 3.32Å; Y116-N118 PolarHBondContact O-N 3.14Å |
| 117 | V | 52.8 | Low | 44.6 | Very low | 130 Ų | 130 | 133 Ų | 133 | 79% | 0.788 | 77% | 0.766 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -77.5 | -15.6 | -177.6 | -64.7 | 0 | 0 | 0 | 0 | 113.7 | ||
| 118 | N | 45.9 | Very low | 44.5 | Very low | 152 Ų | 152 | 134.7 Ų | 134.7 | 81% | 0.813 | 77% | 0.766 | S | S | * | * | S | Bend | trans | -106.2 | -8.6 | -176.3 | -120.4 | 12.3 | 0 | 0 | 0 | 114.4 | Y116 | Y116-N118 VanDerWaalsContact C-N 3.32Å; Y116-N118 PolarHBondContact O-N 3.14Å |
| 119 | S | 46.2 | Very low | 44.7 | Very low | 88 Ų | 88 | 128.8 Ų | 128.8 | 62% | 0.615 | 76% | 0.76 | S | S | * | * | S | Bend | trans | -100.7 | 1 | -175.6 | -69.8 | 0 | 0 | 0 | 0 | 115 | ||
| 120 | L | 47 | Very low | 44.6 | Very low | 126 Ų | 126 | 126.9 Ų | 126.9 | 66% | 0.66 | 76% | 0.76 | S | S | * | * | S | Bend | trans | -98.5 | 4.4 | -176.1 | -61.5 | 178 | 0 | 0 | 0 | 114.3 | ||
| 121 | C | 41.7 | Very low | 45 | Very low | 132 Ų | 132 | 130.5 Ų | 130.5 | 89% | 0.892 | 76% | 0.761 | S | S | * | * | trans | -97 | 15.8 | 173.1 | -78 | 0 | 0 | 0 | 0 | 113.9 | ||||
| 122 | S | 38.2 | Very low | 45 | Very low | 101 Ų | 101 | 132 Ų | 132 | 71% | 0.706 | 76% | 0.761 | S | S | * | * | S | Bend | trans | -102.7 | 113.2 | 170 | -70.6 | 0 | 0 | 0 | 0 | 110.1 | E124 | S122-E124 PolarHBondContact O-N 3.11Š|
| 123 | S | 36 | Very low | 44.5 | Very low | 107 Ų | 107 | 135 Ų | 135 | 75% | 0.748 | 77% | 0.765 | S | S | * | * | trans | -46.1 | 121.2 | 176.3 | 56.8 | 0 | 0 | 0 | 0 | 113.6 | ||||
| 124 | E | 44.8 | Very low | 44.3 | Very low | 192 Ų | 192 | 131.1 Ų | 131.1 | 90% | 0.897 | 76% | 0.762 | S | S | * | * | trans | -119 | 91.3 | 155.8 | -55.2 | -166.7 | 139 | 0 | 0 | 106.4 | S122 D126 | S122-E124 PolarHBondContact O-N 3.11Å; E124-D126 PolarHBondContact O-N 2.92Å | ||
| 125 | T | 46.6 | Very low | 43.6 | Very low | 119 Ų | 119 | 132.6 Ų | 132.6 | 73% | 0.73 | 77% | 0.767 | S | S | * | * | trans | -67.6 | 99 | 166.4 | 47.8 | 0 | 0 | 0 | 0 | 107.9 | S127 | T125-S127 VanDerWaalsContact C-N 3.31Å; T125-S127 PolarHBondContact O-N 3.42Å | ||
| 126 | D | 44 | Very low | 43.2 | Very low | 164 Ų | 164 | 133 Ų | 133 | 88% | 0.877 | 77% | 0.769 | S | S | * | * | trans | -82.1 | 89 | 158.9 | -140.1 | -23.1 | 0 | 0 | 0 | 106.4 | E124 | E124-D126 PolarHBondContact O-N 2.92Š| ||
| 127 | S | 44.5 | Very low | 43 | Very low | 98 Ų | 98 | 133.2 Ų | 133.2 | 69% | 0.685 | 78% | 0.776 | S | S | * | * | trans | -92 | 109.6 | 171.4 | -68.1 | 0 | 0 | 0 | 0 | 108.3 | T125 C129 | T125-S127 VanDerWaalsContact C-N 3.31Å; T125-S127 PolarHBondContact O-N 3.42Å; S127-C129 PolarHBondContact O-N 3.13Å | ||
| 128 | D | 39.5 | Very low | 42.5 | Very low | 155 Ų | 155 | 136 Ų | 136 | 83% | 0.829 | 78% | 0.778 | S | S | * | * | trans | -45.2 | 126.6 | 155.1 | -79.5 | -46.5 | 0 | 0 | 0 | 110.1 | ||||
| 129 | C | 42.8 | Very low | 42.1 | Very low | 116 Ų | 116 | 133.2 Ų | 133.2 | 78% | 0.784 | 77% | 0.77 | S | S | * | * | trans | -175.2 | 100.4 | 143.8 | -95.1 | 0 | 0 | 0 | 0 | 109.5 | S127 N131 | S127-C129 PolarHBondContact O-N 3.13Å; C129-N131 PolarHBondContact O-N 3.02Å | ||
| 130 | S | 40 | Very low | 42.3 | Very low | 121 Ų | 121 | 137.7 Ų | 137.7 | 85% | 0.846 | 79% | 0.786 | S | S | * | * | trans | -44.3 | 120.2 | 156.2 | -60.2 | 0 | 0 | 0 | 0 | 110.9 | ||||
| 131 | N | 45.4 | Very low | 42.5 | Very low | 153 Ų | 153 | 141 Ų | 141 | 82% | 0.818 | 80% | 0.795 | S | S | * | * | trans | -138.3 | 110.7 | 156 | -91.8 | -39.3 | 0 | 0 | 0 | 110 | C129 | C129-N131 PolarHBondContact O-N 3.02Š| ||
| 132 | S | 41.9 | Very low | 43.2 | Very low | 97 Ų | 97 | 144.2 Ų | 144.2 | 68% | 0.678 | 79% | 0.794 | S | S | * | * | trans | -50.8 | 143.4 | 166.2 | 49.4 | 0 | 0 | 0 | 0 | 112.7 | ||||
| 133 | N | 40.3 | Very low | 44.1 | Very low | 148 Ų | 148 | 147.9 Ų | 147.9 | 79% | 0.791 | 80% | 0.797 | S | S | * | * | trans | 47.7 | 112.8 | 145.5 | -65.5 | -29.2 | 0 | 0 | 0 | 117.5 | ||||
| 134 | L | 46 | Very low | 45.1 | Very low | 161 Ų | 161 | 153.7 Ų | 153.7 | 84% | 0.843 | 80% | 0.803 | S | S | * | * | 167.5 | 111.3 | 112.3 | -83.5 | 165.4 | 0 | 0 | 0 | 110.1 | |||||
| 135 | S | 36.6 | Very low | 45.3 | Very low | 108 Ų | 108 | 147.8 Ų | 147.8 | 76% | 0.755 | 79% | 0.793 | S | S | * | * | trans | 20.4 | 110.3 | 141.3 | 57.2 | 0 | 0 | 0 | 0 | 119.1 | ||||
| 136 | H | 40 | Very low | 46.2 | Very low | 163 Ų | 163 | 150.4 Ų | 150.4 | 76% | 0.755 | 80% | 0.802 | S | S | * | * | -158.8 | 123.3 | 124.8 | -152.3 | -79.5 | 0 | 0 | 0 | 111.8 | F138 | H136-F138 AromaticContact CE1-CD2 3.64Å; H136-F138 AromaticContact CE1-CE2 3.27Å; H136-F138 WeakPolarHBondContact CE1-CE2 3.49Å; H136-F138 AromaticContact ND1-CD2 3.52Å; H136-F138 AromaticContact ND1-CE2 3.67Å | |||
| 137 | E | 42.3 | Very low | 47.3 | Very low | 167 Ų | 167 | 152.6 Ų | 152.6 | 78% | 0.78 | 80% | 0.804 | S | S | * | * | trans | -72 | 129.4 | 174.1 | -175.8 | -178.2 | -178.5 | 0 | 0 | 110.4 | ||||
| 138 | F | 43.2 | Very low | 48.1 | Very low | 188 Ų | 188 | 152.9 Ų | 152.9 | 83% | 0.825 | 81% | 0.806 | S | S | * | * | trans | -154.2 | 112.4 | 149.1 | -94.7 | -67.1 | 0 | 0 | 0 | 110.7 | H136 | H136-F138 AromaticContact CE1-CD2 3.64Å; H136-F138 AromaticContact CE1-CE2 3.27Å; H136-F138 WeakPolarHBondContact CE1-CE2 3.49Å; H136-F138 AromaticContact ND1-CD2 3.52Å; H136-F138 AromaticContact ND1-CE2 3.67Å | ||
| 139 | S | 37.7 | Very low | 49.6 | Very low | 94 Ų | 94 | 156.5 Ų | 156.5 | 66% | 0.657 | 81% | 0.808 | S | S | * | * | trans | -73.3 | 128.1 | 173.3 | -87.3 | 0 | 0 | 0 | 0 | 112.1 | ||||
| 140 | L | 50.6 | Low | 50.8 | Low | 182 Ų | 182 | 158.3 Ų | 158.3 | 95% | 0.953 | 81% | 0.809 | S | S | * | * | trans | -130.7 | 87.5 | 153.7 | -76.2 | 174.7 | 0 | 0 | 0 | 110.3 | K142 | L140-K142 PolarHBondContact O-N 3.07Š| ||
| 141 | K | 50.2 | Low | 51.5 | Low | 195 Ų | 195 | 157 Ų | 157 | 85% | 0.848 | 80% | 0.8 | S | S | * | * | trans | -74.4 | 109.2 | 163.4 | -68.6 | 176.3 | 177.8 | 172.6 | 0 | 109.4 | ||||
| 142 | K | 56.5 | Low | 52.3 | Low | 200 Ų | 200 | 160.3 Ų | 160.3 | 87% | 0.87 | 80% | 0.803 | S | S | * | * | trans | -163.4 | 92.6 | 153.6 | -110.2 | 170.9 | -176.7 | 177.4 | 0 | 108.8 | L140 | L140-K142 PolarHBondContact O-N 3.07Š| ||
| 143 | K | 57.8 | Low | 53.5 | Low | 177 Ų | 177 | 164.4 Ų | 164.4 | 77% | 0.77 | 81% | 0.808 | S | S | * | * | 61.9 | 107.7 | 103.8 | -85.3 | -168.9 | 176.7 | 177.9 | 0 | 115.2 | |||||
| 144 | R | 56 | Low | 54.2 | Low | 230 Ų | 230 | 163 Ų | 163 | 87% | 0.868 | 81% | 0.81 | S | S | * | * | trans | 70.5 | 110.2 | 130.8 | -72.2 | -177.1 | 173.2 | 161 | -2.5 | 118.7 | ||||
| 145 | G | 50.2 | Low | 54.7 | Low | 68 Ų | 68 | 162.2 Ų | 162.2 | 70% | 0.701 | 81% | 0.812 | S | S | * | * | 103.7 | 84.9 | 124.3 | 0 | 0 | 0 | 0 | 0 | 116 | |||||
| 146 | L | 64 | Low | 55.9 | Low | 173 Ų | 173 | 166 Ų | 166 | 91% | 0.906 | 81% | 0.814 | S | S | * | * | trans | -123.4 | 16.5 | 164.5 | -68.9 | 177.3 | 0 | 0 | 0 | 113.9 | S148 | L146-S148 PolarHBondContact O-N 3.43Š| ||
| 147 | F | 66.8 | Low | 56.8 | Low | 211 Ų | 211 | 169.1 Ų | 169.1 | 93% | 0.925 | 82% | 0.819 | S | S | * | * | trans | -78.7 | 80 | 163.5 | -65.7 | -71.3 | 0 | 0 | 0 | 109.3 | R149 | F147-R149 VanDerWaalsContact C-N 3.31Å; F147-R149 PolarHBondContact O-N 3.2Å | ||
| 148 | S | 62.5 | Low | 57.1 | Low | 103 Ų | 103 | 166.2 Ų | 166.2 | 72% | 0.72 | 82% | 0.817 | S | S | * | * | trans | -63.5 | 96.8 | 163.4 | -175.7 | 0 | 0 | 0 | 0 | 107.8 | L146 L150 | L146-S148 PolarHBondContact O-N 3.43Å; S148-L150 PolarHBondContact O-N 3.46Å | ||
| 149 | R | 71.5 | Confident | 58 | Low | 231 Ų | 231 | 164.2 Ų | 164.2 | 87% | 0.872 | 82% | 0.815 | S | S | * | * | trans | -66.3 | 98.1 | 173.7 | -173.6 | 173.8 | 178.4 | 163.7 | -0.5 | 107.5 | F147 S151 | F147-R149 VanDerWaalsContact C-N 3.31Å; F147-R149 PolarHBondContact O-N 3.2Å; R149-S151 VanDerWaalsContact C-N 3.31Å; R149-S151 PolarHBondContact O-N 3.18Å | ||
| 150 | L | 66.5 | Low | 59.2 | Low | 154 Ų | 154 | 167.6 Ų | 167.6 | 81% | 0.806 | 82% | 0.818 | S | S | * | * | trans | -60.9 | 96.7 | 168.5 | -66.3 | 175.5 | 0 | 0 | 0 | 108.3 | S148 Y152 | S148-L150 PolarHBondContact O-N 3.46Å; L150-Y152 PolarHBondContact O-N 3.25Å | ||
| 151 | S | 56.4 | Low | 59.4 | Low | 94 Ų | 94 | 168.2 Ų | 168.2 | 66% | 0.657 | 81% | 0.813 | S | S | * | * | trans | -72.7 | 104.2 | 175.2 | 165.5 | 0 | 0 | 0 | 0 | 109.3 | R149 K153 | R149-S151 VanDerWaalsContact C-N 3.31Å; R149-S151 PolarHBondContact O-N 3.18Å; S151-K153 PolarHBondContact O-N 2.93Å | ||
| 152 | Y | 61.5 | Low | 60 | Low | 223 Ų | 223 | 168.7 Ų | 168.7 | 88% | 0.875 | 82% | 0.815 | S | S | * | * | trans | -72 | 75 | 168.3 | -111.6 | -93.4 | 0 | 0 | 0 | 110.6 | L150 | L150-Y152 PolarHBondContact O-N 3.25Š| ||
| 153 | K | 66.7 | Low | 60.4 | Low | 182 Ų | 182 | 165.4 Ų | 165.4 | 79% | 0.791 | 81% | 0.814 | S | S | * | * | trans | -145.2 | 84.7 | 165.8 | -78.2 | -164.6 | 171.6 | -176.3 | 0 | 108 | S151 | S151-K153 PolarHBondContact O-N 2.93Š| ||
| 154 | S | 54.3 | Low | 60 | Low | 118 Ų | 118 | 162.1 Ų | 162.1 | 83% | 0.825 | 81% | 0.814 | S | S | * | * | trans | 153.6 | 81.6 | 152.7 | -70 | 0 | 0 | 0 | 0 | 111.1 | ||||
| 155 | V | 56.4 | Low | 59.9 | Low | 146 Ų | 146 | 159.2 Ų | 159.2 | 89% | 0.885 | 81% | 0.814 | S | S | * | * | trans | -124.1 | 83.7 | 152.7 | -176.2 | 0 | 0 | 0 | 0 | 106.4 | ||||
| 156 | K | 61.9 | Low | 60.1 | Low | 186 Ų | 186 | 165 Ų | 165 | 81% | 0.809 | 82% | 0.823 | S | S | * | * | trans | -107 | 113.3 | 168.2 | -83 | -174.7 | 175.3 | 177.3 | 0 | 107.6 | ||||
| 157 | R | 59 | Low | 59.7 | Low | 229 Ų | 229 | 164.7 Ų | 164.7 | 86% | 0.864 | 82% | 0.817 | S | S | * | * | S | Bend | trans | 64.3 | 137.8 | 149.4 | -59.5 | -171.9 | -70.6 | 174 | -2.2 | 119 | ||
| 158 | S | 49.7 | Very low | 58.8 | Low | 106 Ų | 106 | 158.8 Ų | 158.8 | 74% | 0.741 | 80% | 0.802 | S | S | * | * | trans | 84.3 | 89.6 | 143.2 | -170 | 0 | 0 | 0 | 0 | 116.9 | ||||
| 159 | L | 61 | Low | 58 | Low | 147 Ų | 147 | 160.9 Ų | 160.9 | 77% | 0.77 | 81% | 0.81 | S | S | * | * | trans | -132.3 | 108.5 | 150.7 | -69.1 | -179.6 | 0 | 0 | 0 | 109.1 | ||||
| 160 | F | 63.1 | Low | 56.8 | Low | 165 Ų | 165 | 158.9 Ų | 158.9 | 72% | 0.724 | 81% | 0.808 | S | S | * | * | trans | 68.7 | 95.3 | 149.5 | -51.4 | -63.5 | 0 | 0 | 0 | 117.9 | ||||
| 161 | K | 56.1 | Low | 56 | Low | 195 Ų | 195 | 157 Ų | 157 | 85% | 0.848 | 81% | 0.805 | S | S | * | * | 92.9 | 92.4 | 84.7 | -91.2 | -170.5 | 176.9 | -175.4 | 0 | 111.3 | |||||
| 162 | K | 61.9 | Low | 55.4 | Low | 204 Ų | 204 | 159.9 Ų | 159.9 | 89% | 0.887 | 81% | 0.813 | S | S | * | * | P | Polyproline II helix | trans | -68 | 137.4 | 158.2 | -98.4 | 171.3 | 163.8 | 171.1 | 0 | 109.1 | ||
| 163 | P | 64.4 | Low | 54.5 | Low | 131 Ų | 131 | 154.3 Ų | 154.3 | 85% | 0.851 | 81% | 0.807 | S | S | * | * | P | Polyproline II helix | trans | -76.1 | 123 | 158.9 | 10.9 | 2.1 | 0 | 0 | 0 | 109.3 | ||
| 164 | S | 50.2 | Low | 53.3 | Low | 109 Ų | 109 | 150.4 Ų | 150.4 | 76% | 0.762 | 80% | 0.801 | S | S | * | * | P | Polyproline II helix | trans | -80.5 | 128.4 | 165.4 | 55.2 | 0 | 0 | 0 | 0 | 109.2 | E166 | S164-E166 PolarHBondContact O-N 3.32Š|
| 165 | L | 54.2 | Low | 53 | Low | 169 Ų | 169 | 154.3 Ų | 154.3 | 89% | 0.885 | 80% | 0.803 | S | S | * | * | trans | -74.8 | 113 | 163.7 | -167.4 | 92.8 | 0 | 0 | 0 | 106.7 | ||||
| 166 | E | 53.7 | Low | 52.4 | Low | 189 Ų | 189 | 152.1 Ų | 152.1 | 88% | 0.883 | 79% | 0.794 | S | S | * | * | trans | -86.5 | 127.6 | 177 | -152 | -173.2 | -176 | 0 | 0 | 109.1 | S164 | S164-E166 PolarHBondContact O-N 3.32Š| ||
| 167 | E | 55.8 | Low | 51.6 | Low | 166 Ų | 166 | 151.7 Ų | 151.7 | 78% | 0.776 | 80% | 0.795 | S | S | * | * | trans | -109 | 120.4 | 178.9 | -171.8 | 169.9 | 140.6 | 0 | 0 | 109.3 | ||||
| 168 | S | 47.1 | Very low | 50.9 | Low | 87 Ų | 87 | 152.2 Ų | 152.2 | 61% | 0.608 | 80% | 0.797 | S | S | * | * | trans | 44.6 | 111.2 | 152.6 | 71.1 | 0 | 0 | 0 | 0 | 120.6 | ||||
| 169 | V | 46.7 | Very low | 50.8 | Low | 148 Ų | 148 | 153.6 Ų | 153.6 | 90% | 0.897 | 80% | 0.804 | S | S | * | * | trans | -146.8 | 117.1 | 132.9 | -177.1 | 0 | 0 | 0 | 0 | 108.3 | ||||
| 170 | F | 46 | Very low | 50.3 | Low | 188 Ų | 188 | 154.9 Ų | 154.9 | 83% | 0.825 | 81% | 0.811 | S | S | * | * | trans | -65.1 | 151.4 | 171.3 | -81 | -90.1 | 0 | 0 | 0 | 110.9 | ||||
| 171 | P | 50.7 | Low | 49.4 | Very low | 114 Ų | 114 | 152.7 Ų | 152.7 | 74% | 0.74 | 82% | 0.815 | S | S | * | * | -150.7 | 159.6 | 75.9 | 35.4 | -13.5 | 0 | 0 | 0 | 117.6 | |||||
| 172 | D | 42.1 | Very low | 49.4 | Very low | 156 Ų | 156 | 152.7 Ų | 152.7 | 83% | 0.834 | 82% | 0.816 | S | S | * | * | trans | 42 | 112.4 | 149.9 | -69.4 | -24 | 0 | 0 | 0 | 121 | ||||
| 173 | S | 43.1 | Very low | 48.8 | Very low | 106 Ų | 106 | 151.3 Ų | 151.3 | 74% | 0.741 | 81% | 0.812 | S | S | * | * | 151.5 | 121.3 | 102.5 | -161 | 0 | 0 | 0 | 0 | 112.6 | |||||
| 174 | C | 42.2 | Very low | 48.3 | Very low | 99 Ų | 99 | 154 Ų | 154 | 67% | 0.669 | 81% | 0.805 | S | S | * | * | trans | 65.6 | 111.7 | 147.7 | -68.3 | 0 | 0 | 0 | 0 | 122.6 | ||||
| 175 | K | 48.5 | Very low | 48.3 | Very low | 200 Ų | 200 | 156.6 Ų | 156.6 | 87% | 0.87 | 81% | 0.811 | S | S | * | * | trans | 72.8 | 138.5 | 136.3 | -55.3 | 178.4 | -174.5 | -174.3 | 0 | 116.4 | ||||
| 176 | S | 42.1 | Very low | 48.4 | Very low | 100 Ų | 100 | 157.6 Ų | 157.6 | 70% | 0.699 | 80% | 0.803 | S | S | * | * | cis | -170.5 | 151.5 | -0.6 | -166.8 | 0 | 0 | 0 | 0 | 107 | ||||
| 177 | E | 45.2 | Very low | 48.2 | Very low | 177 Ų | 177 | 154.5 Ų | 154.5 | 83% | 0.827 | 80% | 0.802 | S | S | * | * | trans | 77.6 | 100.7 | 153 | -74.3 | 175.6 | -162.7 | 0 | 0 | 124.2 | ||||
| 178 | R | 45.3 | Very low | 48.5 | Very low | 241 Ų | 241 | 156 Ų | 156 | 91% | 0.909 | 81% | 0.806 | S | S | * | * | trans | 29.5 | 137.2 | 140.9 | -62.7 | -178.3 | -169.5 | 174.7 | 4.6 | 122.1 | ||||
| 179 | P | 47.5 | Very low | 49 | Very low | 134 Ų | 134 | 158.9 Ų | 158.9 | 87% | 0.87 | 82% | 0.82 | S | S | * | * | trans | -132.4 | 153.3 | 134.8 | 31 | -14.4 | 0 | 0 | 0 | 115.6 | ||||
| 180 | L | 50.8 | Low | 49.2 | Very low | 175 Ų | 175 | 158 Ų | 158 | 92% | 0.916 | 82% | 0.819 | S | S | * | * | trans | -66.5 | 152.1 | -178.1 | -76.1 | 138.2 | 0 | 0 | 0 | 115.2 | ||||
| 181 | S | 44.1 | Very low | 50 | Low | 118 Ų | 118 | 153.4 Ų | 153.4 | 83% | 0.825 | 82% | 0.815 | S | S | * | * | trans | -63.9 | 137.8 | 178 | 54.2 | 0 | 0 | 0 | 0 | 115.8 | ||||
| 182 | K | 56.5 | Low | 50.9 | Low | 196 Ų | 196 | 158 Ų | 158 | 85% | 0.852 | 82% | 0.824 | S | S | * | * | trans | -124.4 | 153.4 | 160.9 | -84.1 | 176.7 | 178.3 | 173.9 | 0 | 106.2 | ||||
| 183 | Q | 48.4 | Very low | 52.3 | Low | 174 Ų | 174 | 156.8 Ų | 156.8 | 81% | 0.813 | 82% | 0.822 | S | S | * | * | cis | -172.5 | 146 | -5.1 | 174.9 | 177.6 | -31.1 | 0 | 0 | 104.9 | ||||
| 184 | R | 54.8 | Low | 53.8 | Low | 187 Ų | 187 | 158.2 Ų | 158.2 | 71% | 0.706 | 83% | 0.826 | S | S | * | * | trans | -71.8 | 132.2 | -169.2 | -168.3 | 171 | 80.3 | 162.3 | 2.2 | 113.9 | ||||
| 185 | N | 49.2 | Very low | 55.3 | Low | 164 Ų | 164 | 159.2 Ų | 159.2 | 88% | 0.877 | 83% | 0.829 | S | S | * | * | trans | -67 | 131.1 | 164.7 | -77.6 | -29.8 | 0 | 0 | 0 | 110.6 | ||||
| 186 | R | 56 | Low | 56.4 | Low | 191 Ų | 191 | 158.1 Ų | 158.1 | 72% | 0.721 | 83% | 0.827 | S | S | * | * | trans | -123.4 | 110 | 173.5 | -90.5 | -172.6 | 145.5 | -175.5 | -6.6 | 110.3 | ||||
| 187 | S | 49.5 | Very low | 57.9 | Low | 124 Ų | 124 | 160.5 Ų | 160.5 | 87% | 0.867 | 83% | 0.831 | S | S | * | * | trans | -67.1 | 140.8 | 159.9 | -48.2 | 0 | 0 | 0 | 0 | 109.8 | ||||
| 188 | K | 63.6 | Low | 58.9 | Low | 198 Ų | 198 | 159.4 Ų | 159.4 | 86% | 0.861 | 83% | 0.829 | S | S | * | * | trans | -122.7 | 109.9 | 169.7 | -71 | -176.3 | 178.5 | 178 | 0 | 109.4 | ||||
| 189 | T | 56.1 | Low | 60 | Low | 146 Ų | 146 | 156.1 Ų | 156.1 | 90% | 0.896 | 82% | 0.823 | S | S | * | * | P | Polyproline II helix | trans | -73.8 | 140.1 | 161.4 | 12.3 | 0 | 0 | 0 | 0 | 109.4 | ||
| 190 | C | 50.5 | Low | 60.2 | Low | 130 Ų | 130 | 161.9 Ų | 161.9 | 88% | 0.878 | 84% | 0.839 | S | S | * | * | P | Polyproline II helix | trans | -101.3 | 123.3 | 173.7 | -162.8 | 0 | 0 | 0 | 0 | 109.1 | ||
| 191 | A | 63.5 | Low | 60.7 | Low | 91 Ų | 91 | 161.3 Ų | 161.3 | 75% | 0.752 | 84% | 0.835 | S | S | * | * | P | Polyproline II helix | trans | -97.5 | 136.2 | 169.1 | 0 | 0 | 0 | 0 | 0 | 109.3 | ||
| 192 | K | 70.4 | Confident | 61.6 | Low | 210 Ų | 210 | 163.5 Ų | 163.5 | 91% | 0.913 | 84% | 0.835 | S | S | * | * | P | Polyproline II helix | trans | -94.5 | 125.8 | 169.9 | -96.1 | 175.2 | 169.2 | 174.6 | 0 | 108.2 | ||
| 193 | T | 71.9 | Confident | 61.9 | Low | 131 Ų | 131 | 161.7 Ų | 161.7 | 80% | 0.804 | 83% | 0.834 | S | S | * | * | P | Polyproline II helix | trans | -102.3 | 129.3 | 169 | -31.2 | 0 | 0 | 0 | 0 | 108.2 | ||
| 194 | V | 73.2 | Confident | 62.6 | Low | 137 Ų | 137 | 161 Ų | 161 | 83% | 0.83 | 84% | 0.836 | S | S | * | * | P | Polyproline II helix | trans | -98.9 | 128.2 | 169.7 | 175.1 | 0 | 0 | 0 | 0 | 106.8 | ||
| 195 | V | 75.1 | Confident | 63.1 | Low | 120 Ų | 120 | 159.4 Ų | 159.4 | 73% | 0.727 | 84% | 0.844 | S | S | * | * | trans | -107.6 | 120 | 173.1 | 175.9 | 0 | 0 | 0 | 0 | 107.5 | ||||
| 196 | E | 71.7 | Confident | 64.1 | Low | 177 Ų | 177 | 159.1 Ų | 159.1 | 83% | 0.827 | 84% | 0.842 | S | S | * | * | trans | -89.2 | 126.8 | 173.3 | -163.1 | 171.1 | -155.9 | 0 | 0 | 107.8 | ||||
| 197 | I | 72.4 | Confident | 64.6 | Low | 150 Ų | 150 | 156.8 Ų | 156.8 | 77% | 0.769 | 85% | 0.85 | S | S | * | * | trans | -104.1 | 114.7 | 175.1 | -55.8 | 175.5 | 0 | 0 | 0 | 106.8 | ||||
| 198 | I | 66.9 | Low | 65.8 | Low | 154 Ų | 154 | 159.3 Ų | 159.3 | 79% | 0.79 | 85% | 0.849 | S | S | * | * | trans | -78.1 | 127.1 | 171.7 | -63.1 | 169.8 | 0 | 0 | 0 | 107.3 | ||||
| 199 | H | 66.9 | Low | 66 | Low | 172 Ų | 172 | 156.1 Ų | 156.1 | 80% | 0.796 | 85% | 0.848 | S | S | * | * | trans | -91.1 | 143.7 | 169.6 | -132.1 | -97.8 | 0 | 0 | 0 | 109.2 | ||||
| 200 | E | 53.2 | Low | 66.9 | Low | 255 Ų | 255 | 157 Ų | 157 | 100% | 1.192 | 84% | 0.844 | S | S | * | * | trans | -40.8 | 0 | -178.5 | -156.7 | 173.6 | -172.7 | 0 | 0 | 116.7 |
Retrieved 200 of 200 residues in 29.1 ms
(Link to these results)